SMILES,Molecule Name,Target Name,Type,label,LF_score,GN_score,DD_score, RMSD_Energy
NC(N)=NCCCC(NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)c1nc2ccccc2s1,CHEMBL179910_active,TRY1,Active,1,-9.46216,-9.6,-0.68,-8.884556083837646
CC(O)[C@@H](C(=O)N[C@H](C)c1ccccc1)N(C)C(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)CCCN=C(N)N,CHEMBL105819_active,TRY1,Active,1,-8.19987,-7.37,-1.87,-7.62689827800152
O=C1O[C@H]2CCC[C@@H]2[C@@H]1Sc1ccccc1,CHEMBL100989_active,TRY1,Active,1,-6.33753,-6.13,-0.71,-5.494514437634396
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCN2CC[C@@](N)(Cc3ccccc3)CN12)C(=O)C(=O)NCCc1ccccc1,CHEMBL28817_active,TRY1,Active,1,-10.4904,-8.08,-1.68,-8.253824987595571
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C=O)CCCNC(=N)N,CHEMBL273196_active,TRY1,Active,1,-8.04972,-6.21,-0.86,-6.563368822527291
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCN2CC[C@@](N)(Cc3ccccc3)CN12)C(=O)C(=O)NCc1ccccc1,CHEMBL28365_active,TRY1,Active,1,-11.0221,-7.19,-3.12,-9.27796051478809
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCC2CC[C@@](N)(Cc3ccccc3)CN21)C(=O)c1nc2ccccc2s1,CHEMBL27852_active,TRY1,Active,1,-8.90187,-7.9,-1.03,-7.401686219375292
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)[C@](C)(CC(C)C)C2,CHEMBL11181_active,TRY1,Active,1,-8.59427,-8.74,-1.7,-7.385512709812689
N=C(N)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@H](NCC(=O)O)C(c2ccccc2)c2ccccc2)s1,CHEMBL420540_active,TRY1,Active,1,-9.45908,-8.7,-1.03,-18.61693757310609
N=C(N)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@H](NS(N)(=O)=O)C(c2ccccc2)c2ccccc2)cc1,CHEMBL1159687_active,TRY1,Active,1,-10.1385,-7.37,-0.26,-7.65425056202319
CC1=CCN(C(=O)[C@H](Cc2ccc(C(=N)N)cc2)NS(=O)(=O)c2ccc3c(c2)CN(C)CC3)[C@@H](C(=O)O)C1,CHEMBL430526_active,TRY1,Active,1,-10.2135,-8.6,-2.09,-12.094875014608675
O=C1O[C@H]2CCC[C@@H]2[C@@H]1Cc1ccccc1,CHEMBL101030_active,TRY1,Active,1,-6.76782,-6.12,-4.21,-5.997992801944378
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCN2CC[C@@](N)(Cc3ccccc3)CN12)C(=O)c1nc2ccccc2s1,CHEMBL282830_active,TRY1,Active,1,-10.705,-9.06,-1.43,-9.752120931282684
O=C(O)CN1CCCCC1CCNc1nccc2oc(Cc3cc(Cl)ccc3-n3cncn3)nc12,CHEMBL197593_active,TRY1,Active,1,-9.5677,-7.25,-3.02,-7.779275763999057
CS(=O)(=O)N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(C(=N)N)cc1,CHEMBL268640_active,TRY1,Active,1,-9.07568,-7.91,-0.64,-9.093167217546185
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CN(C(=O)CCc3ccccc3)CC(=O)N21)C(=O)c1nccs1,CHEMBL324413_active,TRY1,Active,1,-9.067,-8.71,-2.28,-13.30245072172963
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CN(C(=O)CCc3ccccc3)CC(=O)N21)C(=O)c1nc2ccccc2s1,CHEMBL352928_active,TRY1,Active,1,-9.89961,-9.84,-3.08,-10.123640740144058
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nccs1,CHEMBL451184_active,TRY1,Active,1,-8.85919,-8.17,-0.92,-7.559636448546693
CN[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2s1)C1CCCCC1,CHEMBL363003_active,TRY1,Active,1,-12.0164,-7.82,-0.23,-9.60528661010562
CS(=O)(=O)N[C@H](CC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(C(=N)N)cc1,CHEMBL7860_active,TRY1,Active,1,-10.0769,-8.07,-4.29,-7.723803731238346
CCCC(CCC)C(=O)N[C@@H](CC(=O)OC)C(=O)N1CCCC1C(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL112726_active,TRY1,Active,1,-8.41126,-7.5,-2.53,-8.528896665782359
CCCC(CCC)C(=O)N[C@@H](CC(=O)OC)C(=O)N1CCC[C@@H]1C(=O)N[C@H]1CCCC(C(=N)N)C1O,CHEMBL141574_active,TRY1,Active,1,-9.46622,-5.73,-3.18,-6.495827379178109
CN[C@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2s1)C(C)C,CHEMBL176063_active,TRY1,Active,1,-10.4281,-8.44,-2.56,-8.931537106631895
Clc1ccc(-n2cncn2)c(Cc2nc3c(NCCC4CCCCN4Cc4ccccc4)nccc3o2)c1,CHEMBL198978_active,TRY1,Active,1,-9.11417,-6.15,-4.09,-6.08062418984368
N=C(N)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@H](Nc2ccccc2)C(c2ccccc2)c2ccccc2)cc1,CHEMBL1159689_active,TRY1,Active,1,-9.20821,-9.15,-2.09,-13.271079513155367
COc1ccc2c(c1)CC[C@H](NS(=O)(=O)CC1CCCCC1)C(=O)N2CC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL85238_active,TRY1,Active,1,-9.19902,-7.55,-1.76,-7.0748470892952255
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)N[C@H]1CCCC(C(=N)N)C1O,CHEMBL423543_active,TRY1,Active,1,-7.57215,-7.45,-0.83,-7.500376569346926
N=C(N)c1ccc(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)s1,CHEMBL208140_active,TRY1,Active,1,-9.56083,-8.39,-2.02,-10.061105077990517
CN[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL361822_active,TRY1,Active,1,-11.1702,-8.55,-0.91,-8.908323469365307
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cccc(C(=N)N)c1)C(=O)c1nc2ccccc2s1,CHEMBL366688_active,TRY1,Active,1,-10.4124,-7.77,-1.2,-8.317228522117611
N=C(N)c1coc(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)c1,CHEMBL206205_active,TRY1,Active,1,-6.95816,-7.28,0.55,-5.750542124168157
CCOC(=O)[C@]1(NS(=O)(=O)Cc2ccccc2)CCCN(CC(=O)N[C@H]2CCCN(C(=N)N)[C@@H]2O)C1=O,CHEMBL85282_active,TRY1,Active,1,-7.89035,-8.15,-2.76,-7.6088076154594
N=C(N)NCCCC(NC(=O)CN1CCN(S(=O)(=O)c2cccc3cccnc23)CC1=O)C(=O)c1nccs1,CHEMBL355376_active,TRY1,Active,1,-9.02487,-8.74,-1.4,-7.759965772070403
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CN(C(=O)CCc3ccccc3)CC(=O)N21)C(=O)c1nc2c(s1)CCC2,CHEMBL169291_active,TRY1,Active,1,-10.303,-8.77,-2.34,-8.631610351112652
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCCCNC(=O)C1=O,CHEMBL317527_active,TRY1,Active,1,-8.82734,-7.91,-2.61,-6.810601735266349
N=C(N)N1CCC(CC(=O)[C@@H]2Cc3cccc4c3N2C(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)CCO3)CC4)CC1,CHEMBL163312_active,TRY1,Active,1,-10.6107,-9.91,-2.21,-9.411111187106254
COC(=O)C[C@H](NS(=O)(=O)Cc1ccccc1)C(=O)N1CCCC1C(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL112931_active,TRY1,Active,1,-7.50511,-5.32,-1.14,-6.177288335024878
CNC1(C(=O)N2CCC[C@H]2C(=O)NC(CCCN=C(N)N)C(=O)c2nc3ccccc3s2)CCCCC1,CHEMBL179961_active,TRY1,Active,1,-9.51625,-8.09,-0.68,-8.737998486018249
CC(=N)N1CCC(Oc2ccc3c(nc(C)n3Cc3ccc4ccc(C(=N)N)cc4c3)c2[N+](=O)[O-])CC1,CHEMBL25351_active,TRY1,Active,1,-9.05751,-9.05,-1.53,-7.565539916748039
CCS(=O)(=O)c1cc(-c2cc(C(=O)Nc3cccc(OC4CCCC4)c3)cc3ccc(C(=N)N)cc23)co1,CHEMBL320233_active,TRY1,Active,1,-11.111,-9.22,-1.76,-9.861817294852822
N=C(N)c1ccc(CNC(=O)[C@H]2CCCN2C(=O)[C@@H](CO)NS(=O)(=O)Cc2ccccc2)cc1,CHEMBL158939_active,TRY1,Active,1,-8.56036,-7.9,-3.04,-2.644686662909087
N=C(N)c1ccc(CC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccc4c(c3)CCO4)C2=O)cc1,CHEMBL354456_active,TRY1,Active,1,-8.20882,-8.32,-1.08,-8.28145324252111
C[C@H](NC(=O)[C@@H](CO)NS(=O)(=O)Cc1ccccc1)C(=O)NCc1ccc(C(=N)N)cc1,CHEMBL158405_active,TRY1,Active,1,-8.7398,-8.26,-2.18,-7.21953414147536
CS(=O)(=O)c1ccccc1-c1ccc(NC(=O)c2cc(C(F)(F)F)nn2-c2cccc(C(=N)N)c2)c(F)c1,CHEMBL358835_active,TRY1,Active,1,-8.32998,-6.45,-1.06,-5.337643296892209
N=C(N)c1cccc(-n2nncc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL157417_active,TRY1,Active,1,-9.92743,-8.09,-1.44,-8.3879715968747
CCS(=O)(=O)c1cc(-c2cc(C(=O)Nc3ccccc3)cc3ccc(C(=N)N)cc23)co1,CHEMBL321319_active,TRY1,Active,1,-9.8051,-8.52,-0.53,-15.562835982354263
CC(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL175497_active,TRY1,Active,1,-9.50366,-8.05,-0.27,-8.861887220456317
CN[C@H](CC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL368937_active,TRY1,Active,1,-9.65626,-8.82,-1.17,-9.121446903101988
C=CCN(CC(=O)O)C(=O)/C(C)=C/c1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1,CHEMBL85154_active,TRY1,Active,1,-7.24242,-7.63,-2.45,-7.297347528951787
CC(=N)N1CCC(Oc2ccc3nc(CCC(N)=O)n(Cc4ccc5ccc(C(=N)N)cc5c4)c3c2)CC1,CHEMBL367725_active,TRY1,Active,1,-10.9967,-8.89,-3.64,-7.358813575133046
Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc(C(=N)N)s1,CHEMBL277695_active,TRY1,Active,1,-9.20681,-8.67,-1.0,-7.503468752256017
CC(C)(C)NC(=O)N1CCN(C(=O)N2C(=O)[C@H](CCCN=C(N)N)[C@H]2C(=O)O)CC1,CHEMBL71037_active,TRY1,Active,1,-7.40449,-7.18,-1.14,-7.3337248894273
N=C(N)c1ccc2[nH]c(-c3cc(Cl)cc(-c4cccc(N)c4)c3O)nc2c1,CHEMBL73737_active,TRY1,Active,1,-8.88735,-8.8,0.23,-7.657147716480773
N=C(N)c1ccc(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)cn1,CHEMBL377681_active,TRY1,Active,1,-9.2445,-7.51,-0.94,-8.041324308402979
CC(=N)N1CCC(Oc2ccc(NC/C(C)=C/c3cccc(C(=N)N)c3)cc2[N+](=O)[O-])CC1,CHEMBL27228_active,TRY1,Active,1,-7.57867,-8.08,-2.71,-6.433890991291345
CC[C@](NC(=O)C(F)(F)F)(C(=O)N1CCC1C(=O)N[C@H](C=O)CCCN=C(N)N)c1ccccc1,CHEMBL141347_active,TRY1,Active,1,-7.81468,-7.53,-1.4,-7.288333943480984
N=C(N)NCCCC(NC(=O)[C@@H]1CCCN1C(=O)N[C@H](C=O)Cc1ccccc1)C(=O)c1nc2ccccc2s1,CHEMBL176329_active,TRY1,Active,1,-11.6109,-8.39,-2.11,-9.048976907163452
N=C(N)c1ccc(CC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccc4c(c3)CCO4)C2=O)s1,CHEMBL162452_active,TRY1,Active,1,-9.8489,-8.0,-1.86,-8.63736196313782
N=C(N)c1cccc(-n2nnnc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL160489_active,TRY1,Active,1,-9.59459,-6.83,-0.98,-5.767630390373232
CCc1nc2cc(OC3CCN(C(C)=N)CC3)ccc2n1C/C(C)=C/c1cccc(N)c1,CHEMBL24565_active,TRY1,Active,1,-8.52687,-8.63,-1.06,-7.283661843856247
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL421643_active,TRY1,Active,1,-8.71234,-7.51,-0.7,-8.869111646377362
CC(=N)N1CCC(Oc2ccc(NCc3ccc4ccc(C(=N)N)cc4c3)cc2[N+](=O)[O-])CC1,CHEMBL25034_active,TRY1,Active,1,-8.42005,-9.3,-2.04,-11.455128937915193
COC(=O)CN(c1ccc2c(c1)nc(C)n2Cc1ccc2ccc(C(=N)N)cc2c1)C1CCN(C(C)=N)CC1,CHEMBL355097_active,TRY1,Active,1,-10.0731,-9.39,-2.91,-8.351575193181326
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C[C@@H]1CCCN(C(=N)N)C1)C(=O)c1nc2ccccc2s1,CHEMBL366625_active,TRY1,Active,1,-10.1906,-7.01,-0.91,-8.678364039665016
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)C1=NC(=O)C2C=CC=CC2=N1,CHEMBL102919_active,TRY1,Active,1,-11.1384,-9.24,-2.2,-13.416847314698556
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc(O)c2ccccc2n1,CHEMBL367647_active,TRY1,Active,1,-8.09311,-8.69,-1.26,-7.997658910734248
N=C(N)c1ccc(CC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccccc3)C2=O)cc1,CHEMBL162216_active,TRY1,Active,1,-9.2859,-7.86,-1.02,-8.035812829270016
CCOC(=O)C1CCN(C(=O)C(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc3ccccc3c2)CC1,CHEMBL357067_active,TRY1,Active,1,-8.03954,-8.2,-0.76,-7.520615663323253
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CSCC1C(=O)N[C@H](C=O)CCCN=C(N)N,CHEMBL141834_active,TRY1,Active,1,-10.005,-8.89,-2.2,-9.09969473880525
NC(N)=NCCC[C@H](NC(=O)[C@@H]1CCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)c1nccs1,CHEMBL151087_active,TRY1,Active,1,-7.9016,-8.19,-2.53,-7.301685776177146
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(C=O)CCCN=C(N)N)c1ccc2ccccc2c1,CHEMBL110780_active,TRY1,Active,1,-7.77559,-7.34,-3.48,-7.678923846105394
N=C(N)NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)C1C[C@@H]2CCCC[C@@H]2CN1,CHEMBL140359_active,TRY1,Active,1,-9.23341,-8.29,-0.08,-7.865934298417156
CC(=O)N1CC=C[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL421466_active,TRY1,Active,1,-7.95024,-7.59,-0.15,-8.307413408521526
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)O,CHEMBL141584_active,TRY1,Active,1,-9.26645,-9.07,-3.88,-8.858708671006251
CC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL127773_active,TRY1,Active,1,-9.23112,-8.41,-0.35,-8.691562229535489
CS(=O)(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccc(C(=N)N)cc1)C1CCCCC1,CHEMBL451242_active,TRY1,Active,1,-8.51309,-8.4,-0.19,-17.346573326817087
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCNC(=O)C1=O,CHEMBL101049_active,TRY1,Active,1,-9.13395,-6.11,-2.66,-7.090298593706315
N=C(N)NCCC[C@@H](NC(=O)CN1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1=O)C(=O)c1nccs1,CHEMBL159695_active,TRY1,Active,1,-10.4855,-8.63,-2.16,-9.57351777628695
Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL289389_active,TRY1,Active,1,-7.52289,-8.33,-1.37,-7.747175883488981
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](c2ccccc2)NC(=O)CCCCCCCNC(=O)C1=O,CHEMBL431429_active,TRY1,Active,1,-8.38531,-6.91,-3.19,-6.507571058556951
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(CCCc3ccccc3)CC2)n1,CHEMBL209604_active,TRY1,Active,1,-9.90817,-8.51,-3.27,-8.611615958669217
COC(=O)CN(c1ccc2nc(C)n(Cc3ccc4ccc(C(=N)N)cc4c3)c2c1)C1CCN(C(C)=N)CC1,CHEMBL172532_active,TRY1,Active,1,-9.05887,-9.42,-3.37,-7.419813431857897
CC(C)Oc1cc(NC(=O)c2ccc3cc(C(=N)N)ccc3c2)cc(OC2CCCC2)c1,CHEMBL418839_active,TRY1,Active,1,-9.66212,-9.4,-0.64,-13.516169751439552
N=C(N)c1ccc(CNC(=O)[C@@H]2CCN2C(=O)[C@@H](NCC(=O)O)C2CCCCC2)cc1,CHEMBL278985_active,TRY1,Active,1,-8.91342,-7.94,-1.1,-8.804415440362321
N=C(N)N1CCC[C@H](NC(=O)C2CS[C@H]3CC[C@H](NS(=O)(=O)Cc4ccccc4)C(=O)N23)C1O,CHEMBL112727_active,TRY1,Active,1,-9.66638,-7.72,-1.61,-7.198015528120951
COc1cccc(S(=O)(=O)Nc2cccn(CC(=O)NCc3ccc(C(=N)N)cc3OC)c2=O)c1,CHEMBL416912_active,TRY1,Active,1,-8.24156,-6.71,-2.52,-5.979826935813875
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccccc2[nH]1,CHEMBL414655_active,TRY1,Active,1,-9.0669,-8.97,-3.26,-8.225834679719588
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(CCCCc3ccccc3)CC2)n1,CHEMBL378244_active,TRY1,Active,1,-10.6639,-7.62,-2.52,-7.719894729623958
CC(C)Oc1cccc(NC(=O)c2cc(C3CCOC3)c3cc(C(=N)N)ccc3c2)c1,CHEMBL421214_active,TRY1,Active,1,-9.77478,-8.74,-1.34,-10.626855807121824
N=C(N)c1ccc(CC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)cc1,CHEMBL355378_active,TRY1,Active,1,-8.51769,-8.27,-3.05,-7.91133647936316
Cc1ccc(NS(=O)(=O)Cc2ccccc2F)c(=O)n1CC(=O)N[C@H](CCCN=C(N)N)C(=O)O,CHEMBL431292_active,TRY1,Active,1,-7.51051,-9.28,-3.23,-7.215440402092802
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NCCc3cccs3)cc2)n1,CHEMBL213951_active,TRY1,Active,1,-12.5898,-8.57,-3.75,-9.22397803633509
CC(C)Oc1cc(NC(=O)c2ccc3cc(C(=N)N)ccc3c2)cc(OC(C)C)c1,CHEMBL111543_active,TRY1,Active,1,-9.24817,-8.02,-1.08,-12.041921648993508
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(C=O)CCCN=C(N)N)c1ccsc1,CHEMBL110755_active,TRY1,Active,1,-8.66786,-6.56,-2.78,-8.108203129733432
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(C=O)CCCN=C(N)N)C1CCCCC1,CHEMBL323401_active,TRY1,Active,1,-10.2323,-7.88,-1.07,-8.653913018629067
Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCc1ccc(C(=N)N)s1,CHEMBL19666_active,TRY1,Active,1,-8.615,-8.26,-0.11,-6.908885188695076
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CCc2ccccc2)NC(=O)CCCCCCCNC(=O)C1=O,CHEMBL99281_active,TRY1,Active,1,-8.53918,-6.02,-1.97,-8.325709845249957
CS(=O)(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC#Cc1c[nH]cn1)C(c1ccccc1)c1ccccc1,CHEMBL94787_active,TRY1,Active,1,-7.76668,-7.74,-1.97,-10.639637042179965
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NCCCCc3ccccc3)cc2)n1,CHEMBL214148_active,TRY1,Active,1,-10.8225,-9.07,-4.91,-8.906393295629423
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(C=O)CCCN=C(N)N)c1cccc2ccccc12,CHEMBL110898_active,TRY1,Active,1,-7.3332,-7.41,-1.1,-7.839550217156763
CN(C)C(=N)c1ccc(/C=C2/CCCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1,CHEMBL151481_active,TRY1,Active,1,-7.58322,-6.33,-0.85,-5.828956361108747
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nc2ccc3ccccc3c2s1,CHEMBL361377_active,TRY1,Active,1,-11.3943,-8.1,-2.43,-9.959284452765308
CC[C@@H](C)NC(=O)c1cc(N)cc(-c2cnc(NC(C)C)c(=O)n2CC(=O)NCc2ccc(C(=N)N)cc2)c1,CHEMBL192738_active,TRY1,Active,1,-8.82896,-7.78,-2.95,-9.274307450071966
Clc1cccc(Cc2nc3c(NCCC4CCCCN4)nccc3o2)c1,CHEMBL439678_active,TRY1,Active,1,-8.65239,-7.62,-1.4,-7.881212086333718
Cn1c(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)ccc1C(=N)N,CHEMBL540273_active,TRY1,Active,1,-8.57454,-7.89,-3.09,-8.40831291056953
COC(=O)c1ccccc1CS(=O)(=O)N[C@H]1CCCCN(CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C1=O,CHEMBL1161499_active,TRY1,Active,1,-10.5102,-8.48,-3.21,-8.350884524328038
N=C(N)C1CCC[C@H](NC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccccc3)C2=O)C1O,CHEMBL140890_active,TRY1,Active,1,-7.41965,-7.13,-1.77,-5.37416305846364
CCc1ccc(OP(=O)(Oc2ccc(CC)cc2)C(NC(=O)OCc2ccccc2)c2ccc(NC(=N)N)cc2)cc1,CHEMBL208575_active,TRY1,Active,1,-9.10274,-8.07,-3.0,-9.186040838159874
N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1,CHEMBL273264_active,TRY1,Active,1,-8.76345,-7.98,-2.01,-7.918056859327694
N=C(N)c1ccc2[nH]c(Cc3nc4cc(C(=N)N)ccc4[nH]3)nc2c1,CHEMBL99951_active,TRY1,Active,1,-8.42053,-7.95,-0.34,-7.159721679026407
FC(F)(CNc1nccc2oc(Cc3ccccc3-n3cnnn3)nc12)C1CCCCN1,CHEMBL198416_active,TRY1,Active,1,-8.43474,-6.1,-2.14,-5.548830369895376
COC(=O)CC1(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cn2)CC(c2cccc(C(=N)N)c2)=NO1,CHEMBL327404_active,TRY1,Active,1,-9.88812,-7.67,-2.79,-8.381387763929276
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NC/C=C/c3ccccc3)cc2)n1,CHEMBL276908_active,TRY1,Active,1,-11.3819,-7.23,-3.53,-8.18872054737185
COC(=O)CN(CCOc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)N)c1,CHEMBL320269_active,TRY1,Active,1,-8.57572,-7.55,-1.91,-6.734662872267358
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NCCCc3ccccc3)cc2)n1,CHEMBL379561_active,TRY1,Active,1,-9.73444,-8.46,-2.84,-7.551758989577672
N=C(N)NCCCC(C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]1Cc2ccccc2CN1,CHEMBL110291_active,TRY1,Active,1,-8.50328,-7.57,-2.08,-7.097829723391269
N=C(N)c1ccc(CC(=O)CN2C(=O)[C@@H](NS(=O)(=O)c3ccc4c(c3)CCO4)CCc3ccccc32)cc1,CHEMBL351256_active,TRY1,Active,1,-9.03751,-11.02,-2.17,-10.03581414512338
Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc(C(=N)N)cc1,CHEMBL19359_active,TRY1,Active,1,-8.52556,-8.82,-1.08,-8.73866502695258
CCOC(=O)N1C/C(=C/c2ccc(C(=N)N)cc2)C(=O)/C(=C\c2ccc(C(=N)N)cc2)C1,CHEMBL345492_active,TRY1,Active,1,-8.09425,-7.7,-2.75,-8.272873600733167
N=C(N)c1cccc(-n2nc(C(F)(F)F)cc2C(=O)Nc2ncc(-c3ccccc3S(N)(=O)=O)cn2)c1,CHEMBL346857_active,TRY1,Active,1,-9.34065,-9.02,-2.69,-7.664780930322249
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NCCc3ccccc3)cc2)n1,CHEMBL213780_active,TRY1,Active,1,-10.8011,-7.87,-3.63,-8.067546654680783
CCOC(=O)c1cc2ccc(OC3CCN(C(C)=N)CC3)cc2n1Cc1ccc2ccc(C(=N)N)cc2c1,CHEMBL433600_active,TRY1,Active,1,-9.13819,-8.5,-1.82,-9.204881113892574
N=C(N)c1ccc2cc(C(=O)Nc3ccc(CN)cc3)cc(Nc3ncccn3)c2c1,CHEMBL104166_active,TRY1,Active,1,-9.47075,-7.1,-1.56,-6.721314643197682
N=C(N)c1cccc(-c2nocc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL140072_active,TRY1,Active,1,-9.87946,-9.05,-0.7,-8.726054800997876
N=C(N)c1csc(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)n1,CHEMBL381709_active,TRY1,Active,1,-8.78913,-7.07,-0.96,-7.803328041560223
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NC3Cc4ccccc4C3)cc2)n1,CHEMBL213927_active,TRY1,Active,1,-10.6745,-8.36,-2.35,-8.024021016000775
CCc1nc2ccc(OC3CCN(C(C)=N)CC3)cc2n1C/C=C/c1cccc(N)c1,CHEMBL24460_active,TRY1,Active,1,-9.28835,-7.79,-1.53,-7.133491616661304
N=C(N)NCCCC(NC(=O)[C@@H]1CCCN1C(=O)CC(c1ccccc1)c1ccccc1)C(=O)c1nc2ccccc2s1,CHEMBL179210_active,TRY1,Active,1,-12.065,-8.11,-1.1,-9.241246197311067
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(C(=O)CCCc3ccccc3)CC2)n1,CHEMBL213778_active,TRY1,Active,1,-9.64912,-7.96,-2.9,-7.470308397882181
COc1ccc(Cc2nc(C(=O)[C@H](CCCCN)NC(=O)OCc3ccccc3)no2)cc1,CHEMBL213698_active,TRY1,Active,1,-9.12105,-8.64,-2.07,-7.800936578147911
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(C(=O)NCc3ccccc3)cc2)n1,CHEMBL386704_active,TRY1,Active,1,-9.03672,-8.75,-3.48,-7.521282730959487
N=C(N)NCCCC(C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1NCCc2ccccc21,CHEMBL326417_active,TRY1,Active,1,-8.30907,-8.15,-0.8,-8.950924436671572
O=C(NCC#Cc1c[nH]cn1)[C@@H]1CCCN1C(=O)[C@H](NS(=O)(=O)Cc1ccccc1)C(c1ccccc1)c1ccccc1,CHEMBL407631_active,TRY1,Active,1,-9.69133,-8.26,-3.19,-9.415834014586684
N=C(N)N1CCC(C(NS(=O)(=O)Cc2ccccc2)C(=O)NCC(=O)N[C@H]2CCCN(C(=N)N)C2O)CC1,CHEMBL163251_active,TRY1,Active,1,-9.90739,-8.65,-2.81,-10.994223148615358
CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1cccc2ccccc12)C(=O)N[C@@H]1CCCN(C(=N)N)C1O,CHEMBL544222_active,TRY1,Active,1,-10.3105,-7.92,-2.06,-9.823794175174289
N=C(N)c1cccc(-n2ccnc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL349323_active,TRY1,Active,1,-7.58659,-8.98,-2.02,-13.156975767247218
N=C(N)N1CCC[C@H](NC(=O)CN2C(=O)[C@@H](NS(=O)(=O)Cc3ccccc3)CCc3ccccc32)C1O,CHEMBL314576_active,TRY1,Active,1,-9.7101,-8.29,-1.71,-8.132988517091157
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCNC(=O)c2ccc(O)nc2)NS(=O)(=O)Cc2ccccc2)C1O,CHEMBL331807_active,TRY1,Active,1,-12.1597,-7.24,-3.15,-7.787196149795263
N=C(N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(c3ccccc3)CC2)c1,CHEMBL104970_active,TRY1,Active,1,-9.23226,-9.48,-0.16,-8.134420153435462
COc1ccc2c(c1)CC[C@H](NS(=O)(=O)c1ccc3ccccc3c1)C(=O)N2CC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL316213_active,TRY1,Active,1,-8.47329,-1.19,-1.82,-1.4901514005595595
NC1CCC([C@H](NC(=O)[C@@H]2CC[C@H]3CN(S(=O)(=O)Cc4ccccc4)CC(=O)N32)C(=O)C(=O)NCC(=O)O)CC1,CHEMBL328637_active,TRY1,Active,1,-8.97726,-5.89,-2.57,-5.679639550256316
N=C(N)c1ccc(/C=C2/CCCCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1,CHEMBL422321_active,TRY1,Active,1,-7.58186,-8.98,-2.08,-7.888090297419589
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC#Cc1c[nH]cn1)C(C1CCCCC1)C1CCCCC1,CHEMBL444548_active,TRY1,Active,1,-8.93934,-7.22,-2.72,-7.712831642309403
N=C(N)NCCCC(NC(=O)C1CCCC1)C(=O)c1nc2ccccc2s1,CHEMBL360684_active,TRY1,Active,1,-8.92245,-7.45,-0.82,-8.10894996504991
N=C(N)c1ccc2ccc(Cn3c4ccccc4c4ccc(OC5CCNCC5)cc43)cc2c1,CHEMBL174702_active,TRY1,Active,1,-9.14593,-9.09,-1.71,-7.823930685966972
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCNC(=O)c2cnccn2)NC(=O)OCc2ccccc2)C1O,CHEMBL116245_active,TRY1,Active,1,-8.77619,-8.63,-2.91,-6.863511437018744
CCN(CC)C(=O)c1cccc(-c2ccc3c(c2)C[C@H]2[C@H]3[C@@H](CCCCC(=N)N)C(=O)N2C(=O)OC)c1,CHEMBL46845_active,TRY1,Active,1,-8.55506,-8.73,-1.24,-7.773915727144327
N=C(N)N1CCCC(C[C@@H](NS(=O)(=O)Cc2ccccc2)C(=O)NCC(=O)N[C@H]2CCCN(C(=N)N)C2O)C1,CHEMBL162443_active,TRY1,Active,1,-10.3267,-8.83,-2.22,-9.101858071966936
N=C(N)c1cccc(-n2cc(Br)cc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL346834_active,TRY1,Active,1,-9.81763,-9.22,-1.26,-8.75183894044192
N=C(N)c1ccc(CNC(=O)Cn2c(-c3cccc(N)c3)c(Cl)nc(NC3CCC3)c2=O)cc1,CHEMBL77490_active,TRY1,Active,1,-8.65563,-8.22,-1.98,-8.08383565645594
CN(C(=O)[C@H](Cc1ccc(C(=N)NN)cc1)NS(=O)(=O)c1ccc2ccccc2c1)C1CCCC1,CHEMBL7962_active,TRY1,Active,1,-9.12987,-9.61,-3.06,-9.434991366772184
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(C(=O)CCc3ccccc3)CC2)n1,CHEMBL213554_active,TRY1,Active,1,-10.199,-7.63,-1.65,-9.780380371779271
N=C(N)NCCC[C@@H](NC(=O)CN1CCN(S(=O)(=O)Cc2ccccc2)CC1=O)C(=O)c1nccs1,CHEMBL162461_active,TRY1,Active,1,-10.8828,-8.36,-3.48,-10.68272141228011
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(Cc2ccc(OCCc3ccccc3)cc2)n1,CHEMBL426330_active,TRY1,Active,1,-10.9522,-8.13,-3.64,-7.584583913290195
Cn1nnnc1C(=O)[C@@H](NC(=O)[C@@H]1CC[C@H]2CN(S(=O)(=O)Cc3ccccc3)CC(=O)N21)C1CCC(N)CC1,CHEMBL97948_active,TRY1,Active,1,-10.3663,-8.48,-2.33,-11.544638912851818
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](CC1CCCCC1)NC(=O)c1ccc(-c2cccc(CN)c2)cc1,CHEMBL45106_active,TRY1,Active,1,-12.1682,-9.46,-2.28,-10.536254359716322
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2cccc[n+]2C)cc1,CHEMBL44586_active,TRY1,Active,1,-8.71579,-9.1,-2.53,-7.882613734291453
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2cccc[n+]2[O-])cc1,CHEMBL46708_active,TRY1,Active,1,-8.79516,-8.92,-3.35,-7.979331776610395
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](CC(C)C)NC(=O)c1ccc(-c2cccc(CN)c2)cc1,CHEMBL44831_active,TRY1,Active,1,-9.88574,-8.03,-2.68,-11.928897222812338
O=C1N(Cc2ccccc2)C(=O)N1Cc1ccccc1,CHEMBL47394_active,TRY1,Active,1,-6.44132,-6.05,-0.7,-1.746511424206261
COC(=O)CN(CCCc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)N)c1,CHEMBL18767_active,TRY1,Active,1,-9.78979,-7.66,-3.08,-8.755918918647772
N=C(N)c1ccc2cc(C(=O)Nc3ccc4c(c3)C(C3CCCC3)NCC4)ccc2c1,CHEMBL111338_active,TRY1,Active,1,-9.26422,-10.43,-1.31,-9.586328393949588
N=C(N)NCCCC(NC(=O)CN1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1=O)C(=O)c1nccs1,CHEMBL163174_active,TRY1,Active,1,-11.1323,-9.25,-2.85,-12.391987149873248
CN1CCCCCOc2ccc(Cl)cc2CNC(=O)Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)C1,CHEMBL92615_active,TRY1,Active,1,-8.57783,-6.92,-2.96,-4.8479000250730815
COc1cc([C@@H](Nc2ccc(C(=N)N)cc2)C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1OCc1ccccc1,CHEMBL178616_active,TRY1,Active,1,-10.8669,-8.3,-1.56,-9.431239243805102
N=C(N)c1ccc2cnn(CC(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cn3)c2c1,CHEMBL136100_active,TRY1,Active,1,-9.55605,-8.19,-2.4,-8.620337585172326
CC(C)OC(=O)c1ccccc1CS(=O)(=O)N[C@H]1CCCCN(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)C1=O,CHEMBL332537_active,TRY1,Active,1,-8.78303,-9.06,-3.46,-8.739899521093108
NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(C(=O)OCc3ccccc3)CC2)n1,CHEMBL378910_active,TRY1,Active,1,-8.94775,-8.51,-1.52,-8.239605271083507
CC(=N)N1CCC(Oc2ccc(NCc3cccc(-c4cccc(C(=N)N)c4)c3)cc2[N+](=O)[O-])CC1,CHEMBL25461_active,TRY1,Active,1,-8.05036,-9.24,-4.0,-7.423691059855758
CC(C)C1=NCCc2ccc(NC(=O)c3ccc4cc(C(=N)N)ccc4c3)cc21,CHEMBL109367_active,TRY1,Active,1,-8.31323,-9.65,-1.29,-7.407095807018738
CC(C)C1NCCc2ccc(NC(=O)c3ccc4cc(C(=N)N)ccc4c3)cc21,CHEMBL442201_active,TRY1,Active,1,-8.98407,-10.34,-1.06,-11.012823026419706
N=C(N)c1ccc2ncn(CC(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)c2c1,CHEMBL343495_active,TRY1,Active,1,-9.75251,-8.34,-1.3,-8.441712635486534
N=C(N)c1cccc(C2=NOC(Cn3cncn3)(C(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)C2)c1,CHEMBL436684_active,TRY1,Active,1,-10.3464,-7.43,-1.33,-7.586866085100594
Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCc1ccc(C(=N)N)cc1,CHEMBL19731_active,TRY1,Active,1,-7.79715,-9.2,-3.16,-7.107910402002281
Cn1c(CNc2ccc(C(=N)N)cc2)nc2cc(C(=O)N(CCC(=O)O)c3ccccn3)ccc21,CHEMBL48361_active,TRY1,Active,1,-8.18739,-9.03,-2.36,-7.0067857782092045
COC(=O)[C@@H]1CN(Cc2ccc(-c3ccccc3S(N)(=O)=O)cc2)C[C@H]1c1cccc(C(=N)N)c1,CHEMBL18225_active,TRY1,Active,1,-10.1057,-8.76,-1.32,-9.169655954150366
N=C(N)c1cccc(N2CCCCN(C3CCN(S(=O)(=O)c4cccs4)CC3)C2=O)c1,CHEMBL104995_active,TRY1,Active,1,-8.42479,-8.32,-2.51,-7.319681921482191
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2ccc[n+](C)c2)cc1,CHEMBL295454_active,TRY1,Active,1,-8.13865,-8.9,-0.32,-17.507396242376206
CS(=O)(=O)NC1(Cc2ccccc2)CCCN(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)C1=O,CHEMBL79832_active,TRY1,Active,1,-7.81677,-9.91,-1.78,-8.089291827331376
N=C(N)NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1NCC[C@@H]2CCCC[C@@H]21,CHEMBL136647_active,TRY1,Active,1,-8.71146,-6.72,-1.68,-8.191496899986168
CC(=O)N1CC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1,CHEMBL339703_active,TRY1,Active,1,-8.83041,-7.74,-1.04,-9.230598632275722
COc1ccc2cc(S(=O)(=O)NN(Cc3cccc(C(=N)N)c3)C(=O)N3CCCCCC3)ccc2c1,CHEMBL41947_active,TRY1,Active,1,-8.92145,-7.53,-1.21,-13.741365998623976
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)c1nc2ccccc2s1)C1CCC(CN)CC1,CHEMBL367337_active,TRY1,Active,1,-10.9609,-7.75,-2.24,-10.82329029729714
N=C(N)c1ccc(/C=C2\CC(c3ccccc3)C/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1,CHEMBL149410_active,TRY1,Active,1,-8.33312,-8.09,-1.0,-15.425130574142685
COC(=O)CN(CCc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)N)c1,CHEMBL105121_active,TRY1,Active,1,-9.56427,-8.05,-1.25,-8.899350680527562
N=C(N)c1cccc(N2CCCCN(C3CCN(S(=O)(=O)Cc4ccccn4)CC3)C2=O)c1,CHEMBL1160792_active,TRY1,Active,1,-8.02169,-8.76,-4.24,-9.276882591632496
N=C(N)c1cccc(-n2cncc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL158219_active,TRY1,Active,1,-8.93857,-9.29,-2.03,-7.07469579846537
N=C(N)c1ccc2cc(C(=O)Nc3ccc4c(c3)C(C3CCCC3)=NCC4)ccc2c1,CHEMBL323387_active,TRY1,Active,1,-9.13061,-9.15,-2.19,-7.974550961957957
Cc1cc(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cn2)n(-c2cccc(C(=N)N)c2)n1,CHEMBL154322_active,TRY1,Active,1,-9.58802,-8.79,-1.88,-8.425362941053178
Cc1nc(-c2cccc(C(=N)N)c2)c(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)s1,CHEMBL156924_active,TRY1,Active,1,-9.71318,-6.4,-2.49,-6.231858940397189
N=C(N)c1ccc2scc(C3(C(=O)Nc4ccc(-n5cnc6ccccc65)cc4)CC3)c2c1,CHEMBL185330_active,TRY1,Active,1,-8.49187,-9.53,-0.58,-7.691695715601801
N=C(N)c1cccc(N2CCCCN(C3CCN(S(=O)(=O)c4ccccc4)CC3)C2=O)c1,CHEMBL102502_active,TRY1,Active,1,-7.9778,-6.38,-1.78,-4.966904238746463
CC(C)(C)NC(=O)N1CCN(C(=O)N2C(=O)[C@H](CC3CCNCC3)[C@H]2C(=O)O)CC1,CHEMBL70155_active,TRY1,Active,1,-7.17673,-5.14,-3.07,-5.279718643573451
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCCNC(=O)C1=O,CHEMBL328200_active,TRY1,Active,1,-7.6954,-8.21,-2.71,-6.545437082916052
CCN(CC)C(=O)c1cccc(-c2ccc3c(c2)[C@@H]2[C@@H](CCCCC(=N)N)C(=O)N(S(=O)(=O)c4ccccc4)[C@H]2C3)c1,CHEMBL297169_active,TRY1,Active,1,-9.83562,-8.96,-1.72,-8.128699236529231
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](CCc1ccccc1)NC(=O)c1ccc(-c2ccccc2)cc1,CHEMBL45407_active,TRY1,Active,1,-9.86559,-9.28,-2.14,-8.0774138794607
CCc1nc2cc(OC3CCN(C(C)=N)CC3)ccc2n1Cc1cccc(-c2cccc(C(=N)N)c2)c1,CHEMBL25527_active,TRY1,Active,1,-10.2821,-9.17,-1.58,-7.509617572673848
COC(=O)[C@@H]1CN(Cc2ccc(-c3ccccc3S(N)(=O)=O)cc2)O[C@H]1c1cccc(C(=N)N)c1,CHEMBL279267_active,TRY1,Active,1,-10.041,-8.42,-1.43,-8.999474650922544
COCC1(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)CC(c2cccc(C(=N)N)c2)=NO1,CHEMBL350499_active,TRY1,Active,1,-10.4094,-7.69,-2.37,-7.63832653767781
CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)[C@H]5[C@H](C[C@]4(C)C3=CCC2[C@]1(C)C(=O)O)OC(=O)[C@@H]5CC(=O)C=C(C)C,CHEMBL328621_active,TRY1,Active,1,-7.80264,-6.47,-3.27,-5.826358018285582
COC(=O)C1C/C(=C\c2ccc(C(=N)N)cc2)C(=O)/C(=C/c2ccc(C(=N)N)cc2)C1,CHEMBL345990_active,TRY1,Active,1,-7.47345,-7.17,-2.34,-9.858795866621604
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)c1ccccn1,CHEMBL404728_active,TRY1,Active,1,-8.49539,-8.33,-2.66,-8.175518902694332
CCc1nc2ccc(OC3CCN(C(C)=N)CC3)cc2n1Cc1ccc(-c2cccc(C(=N)N)c2)cc1,CHEMBL24780_active,TRY1,Active,1,-8.69765,-8.14,-2.25,-7.39906108304874
CC1CCN(C(=O)C(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1,CHEMBL356216_active,TRY1,Active,1,-8.32314,-9.67,-1.08,-10.026524185446066
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCNC(=O)c2cn[nH]c2)NC(=O)OCc2ccccc2)C1O,CHEMBL419222_active,TRY1,Active,1,-8.00814,-7.81,-2.42,-7.931926371384729
N=C(N)C1CCC[C@H](NC(=O)CN2CCCC[C@H](NS(=O)(=O)Cc3ccccc3)C2=O)C1O,CHEMBL343805_active,TRY1,Active,1,-8.873,-7.93,-2.85,-7.229592418582122
CN(CC(=O)N[C@H]1CCCC(C(=N)N)C1O)C(=O)[C@@H](CCCN=C(N)N)NS(=O)(=O)Cc1ccccc1,CHEMBL431985_active,TRY1,Active,1,-9.69203,-8.02,-3.08,-8.455447449752885
N=C(N)NCCCC(NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL117672_active,TRY1,Active,1,-9.38584,-8.75,-3.61,-8.301420449355852
N=C(N)c1ccc2[nH]c(-c3cc([N+](=O)[O-])cc(-c4ccccc4)c3O)cc2c1,CHEMBL94775_active,TRY1,Active,1,-7.43742,-8.42,0.3,-13.063765717985502
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](Cc1ccccc1)NC(=O)c1ccc(-c2ccccc2)cc1,CHEMBL43264_active,TRY1,Active,1,-9.30905,-9.48,-3.08,-13.064420386325065
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2ccncc2)cc1,CHEMBL296046_active,TRY1,Active,1,-8.38089,-8.9,-1.39,-8.454646374117555
COC(=O)CN(CCCOc1ccc(-c2ccccc2S(N)(=O)=O)cc1)c1cccc(C(=N)N)c1,CHEMBL106743_active,TRY1,Active,1,-8.68293,-7.44,-2.02,-8.653603536665656
N=C(N)NCc1ccc(C2CC/C(=C/I)OC2=O)cc1,CHEMBL135723_active,TRY1,Active,1,-8.92565,-6.53,-1.59,-7.217786704579034
CCOC(=O)C(Oc1ccc2c(c1)CN(C(=N)N)CC2)c1ccc(OC2CCN(C(=N)CC)CC2)cc1,CHEMBL147631_active,TRY1,Active,1,-10.4779,-8.02,-1.16,-7.483218483071716
N=C(N)c1cccc(Oc2ccc3c4ccccc4n(Cc4ccc5ccc(C(=N)N)cc5c4)c3c2)c1,CHEMBL174735_active,TRY1,Active,1,-9.2757,-10.82,-1.96,-7.922973246184882
N=C(N)c1cccc(C2=NOC(Cc3ccccc3)(C(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)C2)c1,CHEMBL316070_active,TRY1,Active,1,-10.8391,-9.6,-1.65,-7.881236457453709
N=C(N)c1cccc(N2CCCCN(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)C2=O)c1,CHEMBL103993_active,TRY1,Active,1,-7.86769,-9.06,-1.66,-9.949593973661283
CC(=O)N1C[C@H](O)C[C@H]1C(=O)NC(CCCN=C(N)N)C(=O)c1nccs1,CHEMBL341083_active,TRY1,Active,1,-8.71421,-7.4,-1.28,-8.270168023069667
CCC1CNCc2ccc(NC(=O)c3ccc4cc(C(=N)N)ccc4c3)cc21,CHEMBL108447_active,TRY1,Active,1,-9.11316,-8.89,-0.72,-11.1191846732015
N=C(N)c1ccc(CC(=O)CN2CCCC[C@H](NS(=O)(=O)Cc3ccccc3)C2=O)cc1,CHEMBL350955_active,TRY1,Active,1,-8.44039,-7.81,-2.69,-7.911340708983573
N=C(N)c1ccc(OCC[C@@H]2CCCCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)cc1,CHEMBL81056_active,TRY1,Active,1,-8.29953,-8.67,-1.48,-12.715697410177532
CN(C)C(=O)COc1ccc2c3ccccc3n(Cc3ccc4ccc(C(=N)N)cc4c3)c2c1,CHEMBL174995_active,TRY1,Active,1,-8.95377,-7.76,-0.85,-7.420634950146965
O=C1Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)CNCCCCOc2ccc(Cl)cc2CN1,CHEMBL316901_active,TRY1,Active,1,-7.10836,-5.73,-2.76,-4.38946239768145
N=C(N)c1cccc(C2=NOC(Cn3ncnn3)(C(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)C2)c1,CHEMBL91999_active,TRY1,Active,1,-9.98837,-8.66,-3.38,-7.496823837763086
NC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)[C@H](N)C(c2ccccc2)c2ccccc2)CC1,CHEMBL416795_active,TRY1,Active,1,-9.85387,-9.06,-0.16,-8.803357658405329
COC(=O)CC(CCc1ccc(NC(=N)N)cc1)c1cccc(C(=N)N)c1,CHEMBL156161_active,TRY1,Active,1,-9.52734,-7.49,-1.84,-8.825578727279167
CC1CNc2c(cccc2S(=O)(=O)N[C@H]2CCC[C@H]3CC[C@@H](C(=O)N[C@H]4CCCN(C(=N)N)C4O)N3C2=O)C1,CHEMBL544760_active,TRY1,Active,1,-8.21613,-6.42,-1.8,-5.8594565803223
Cc1[nH]cnc1/C=C/CNC(=O)[C@@H]1CCCN1C(=O)[C@H](N)C(c1ccccc1)c1ccccc1,CHEMBL200153_active,TRY1,Active,1,-8.4477,-7.99,-0.17,-7.111910383527363
N=C(N)c1cccc(Oc2ccc(NC(=O)Nc3ccccc3)c(Oc3cccc(C(=N)N)c3)n2)c1,CHEMBL300622_active,TRY1,Active,1,-10.6692,-8.29,-1.45,-9.04731945348206
CNS(=O)(=O)Nc1c(CCc2ccccc2)ccn(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)c1=O,CHEMBL171271_active,TRY1,Active,1,-8.07211,-7.85,-1.02,-7.16191955030556
COc1ccc(CCN(Cc2ccc3ccc(C(=N)N)cc3c2)C(=O)c2cccc3ccccc23)cc1OC,CHEMBL380813_active,TRY1,Active,1,-9.30404,-6.35,-2.01,-6.357495891561971
C[C@H]1ON=C(c2cccc(C(=N)N)c2)[C@@H]1C(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cc1,CHEMBL436235_active,TRY1,Active,1,-8.22961,-7.69,-3.64,-6.443128560163506
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C)c(CC(=O)NCc3ccc(C(=N)N)cc3)c2O)c1,CHEMBL537420_active,TRY1,Active,1,-8.91738,-8.24,-2.26,-7.590250122116503
N=C(N)c1ccc(CNC(=O)CNC(=O)[C@@H](CO)NS(=O)(=O)CC2CCCCC2)cc1,CHEMBL158814_active,TRY1,Active,1,-10.6669,-8.2,-1.33,-7.718577351768744
O=C1Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)CNCCOCCOc2ccc(Cl)cc2CN1,CHEMBL96354_active,TRY1,Active,1,-8.76381,-5.08,-1.94,-4.766989347618942
O=C1Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)CNC(=O)OC/C=C\COc2ccc(Cl)cc2CN1,CHEMBL94952_active,TRY1,Active,1,-8.8175,-6.82,-2.04,-5.452977008329026
CC1CCN(C(=O)N(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc3ccccc3c2)CC1,CHEMBL37318_active,TRY1,Active,1,-9.93863,-10.3,-1.66,-9.932620234921847
N=C(N)NCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL163543_active,TRY1,Active,1,-10.3238,-8.39,-4.11,-8.526177268369983
N=C(N)c1ccc(N2CCCCN(c3cccc(C(=N)N)c3)C2=O)cc1,CHEMBL91654_active,TRY1,Active,1,-7.9044,-8.0,-0.16,-6.8637633805204095
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)c2ccc(OCc3ccccc3)cc2)CC1,CHEMBL70813_active,TRY1,Active,1,-8.44126,-9.25,-3.07,-6.906098239703818
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1,CHEMBL73215_active,TRY1,Active,1,-7.34395,-6.18,-3.15,-4.841213912007685
CNS(=O)(=O)c1ccccc1-c1ccc(NC(=O)Cc2c[nH]c3ccc(C(=N)N)cc23)cc1,CHEMBL138956_active,TRY1,Active,1,-9.40969,-6.33,-1.02,-5.641408808704078
NC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)[C@H](N)C(C2CCCCC2)C2CCCCC2)CC1,CHEMBL289395_active,TRY1,Active,1,-10.2937,-8.65,-1.23,-9.469057448211585
N=C(N)c1cccc(C2=NOC(Cn3cnnn3)(C(=O)Nc3ncc(-c4ccccc4S(N)(=O)=O)cn3)C2)c1,CHEMBL327331_active,TRY1,Active,1,-10.6602,-10.56,-3.07,-8.312609651538024
N=C(N)c1cccc(N2CCCCN(C3CCN(Cc4ccccn4)CC3)C2=O)c1,CHEMBL1160810_active,TRY1,Active,1,-8.84167,-7.85,-0.38,-7.43571635850284
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2ccc[n+]([O-])c2)cc1,CHEMBL46969_active,TRY1,Active,1,-8.85634,-8.97,-0.92,-15.947421845771697
COc1ccc2cc(S(=O)(=O)N[C@@H](Cc3ccc(C(=N)N)s3)C(=O)N(C)C3CCCC3)ccc2c1,CHEMBL296956_active,TRY1,Active,1,-10.2928,-9.41,-1.59,-9.156691492735302
COC(=O)Cc1cn(CC(=O)N2CCC(Cc3ccccc3)CC2)c2ccc(C(=N)N)cc12,CHEMBL422722_active,TRY1,Active,1,-9.80974,-8.45,-1.04,-9.307581831639473
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1,CHEMBL431557_active,TRY1,Active,1,-8.2777,-8.06,-2.12,-6.344299915006394
N=C(N)c1ccc2c(c1)C(CC(=O)Nc1ccc(-c3ccccc3S(N)(=O)=O)cc1)CN2,CHEMBL341979_active,TRY1,Active,1,-8.78602,-10.06,-3.16,-8.16765450408645
Cc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)NCC3CCN(C(=N)N)CC3)c2=O)cc1,CHEMBL36397_active,TRY1,Active,1,-9.08646,-9.56,-3.61,-8.733279285451424
CCc1nc2cc(OC3CCN(C(C)=N)CC3)ccc2n1Cc1ccc(-c2cccc(C(=N)N)c2)cc1,CHEMBL283901_active,TRY1,Active,1,-10.5854,-7.92,-1.51,-8.23011117225359
N=C(N)C1CCC[C@H](NC(=O)CN2CCC[C@H](NS(=O)(=O)NC3CCCCC3)C2=O)C1O,CHEMBL422470_active,TRY1,Active,1,-10.1908,-6.58,-1.39,-7.595905259353809
CCCc1ccc(S(=O)(=O)N[C@@H](Cc2ccc(C(=N)N)s2)C(=O)N(C)C2CCCC2)cc1,CHEMBL48133_active,TRY1,Active,1,-9.56244,-8.72,-1.64,-9.258235111895186
Cc1nc2c(Oc3cc(C(=N)N)ccc3O)nc(Oc3cccc(C(=O)N(C)C)c3)nc2n1Cc1ccccc1,CHEMBL305809_active,TRY1,Active,1,-9.54921,-7.93,-1.87,-7.545128329283057
N=C(N)c1ccc2[nH]cc(C(Cc3ccccc3)C(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)c2c1,CHEMBL361607_active,TRY1,Active,1,-11.0861,-8.7,-4.04,-8.978541304476614
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)CC1,CHEMBL70766_active,TRY1,Active,1,-9.24894,-8.15,-2.85,-7.027268817656974
CN(C)C(=O)c1cccc(Oc2cc(C(=O)O)cc(Oc3cc(C(=N)N)ccc3O)n2)c1,CHEMBL79303_active,TRY1,Active,1,-8.51522,-8.06,-2.11,-8.264048518389677
N=C(N)c1ccc2[nH]cc(CC(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cn3)c2c1,CHEMBL138709_active,TRY1,Active,1,-9.78633,-10.52,-2.44,-9.62504254497103
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CNC(=O)c2cnccn2)NS(=O)(=O)Cc2ccccc2)C1O,CHEMBL117721_active,TRY1,Active,1,-9.49829,-7.81,-1.64,-7.80359806410936
CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCCN(C(=N)N)C1O,CHEMBL538226_active,TRY1,Active,1,-7.28268,-7.25,-1.53,-7.357355544262146
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)c1nc2ccccc2s1,CHEMBL341148_active,TRY1,Active,1,-9.5248,-8.49,-2.14,-8.67866045006263
Cc1cn(-c2cccc(Oc3cc(C(=O)O)cc(Oc4cc(C(=N)N)ccc4O)n3)c2)cn1,CHEMBL79828_active,TRY1,Active,1,-8.8087,-8.64,-2.12,-8.26686584467998
Cc1ncc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL39475_active,TRY1,Active,1,-7.94818,-8.37,-1.86,-6.596332431748463
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CN(C(=O)CCc3ccccc3)CC(=O)N21)C(=O)c1ccccn1,CHEMBL169946_active,TRY1,Active,1,-8.41426,-8.54,-1.83,-7.55627418945411
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCNC(=O)c2cnccn2)NS(=O)(=O)Cc2ccccc2)C1O,CHEMBL420688_active,TRY1,Active,1,-9.7671,-8.56,-2.7,-7.972108016071923
N=C(N)N1CCC(C[C@@H](NS(=O)(=O)Cc2ccccc2)C(=O)NCC(=O)N[C@H]2CCCN(C(=N)N)C2O)CC1,CHEMBL162399_active,TRY1,Active,1,-9.9639,-9.58,-1.75,-8.933902723514084
N=C(N)c1ccc(C[C@@H](NC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCC2)cc1,CHEMBL51173_active,TRY1,Active,1,-8.86614,-9.69,-2.02,-8.22399785380708
CCOC(=O)N[C@@H](CCCCN)C(=O)c1noc(Cc2ccc(C(=O)NC3Cc4ccccc4C3)cc2)n1,CHEMBL214368_active,TRY1,Active,1,-10.3881,-8.06,-4.42,-8.36984758251838
COC(=O)CC1(C(=O)Nc2ncc(-c3ccccc3S(N)(=O)=O)cn2)CC(c2cccc(C(=N)N)c2)=NO1,CHEMBL327213_active,TRY1,Active,1,-10.6938,-8.95,-2.09,-7.96706472377176
N=C(N)c1cccc(N2CCCCN(C3CCN(Cc4cccs4)CC3)C2=O)c1,CHEMBL102345_active,TRY1,Active,1,-9.10813,-7.22,-1.53,-12.884938805785808
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2c[nH]cn2)cc1,CHEMBL44113_active,TRY1,Active,1,-8.47427,-8.24,-1.63,-15.852062080073267
N=C(N)c1cccc(OC(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2)c1,CHEMBL305828_active,TRY1,Active,1,-9.8691,-8.81,-1.55,-8.774077272850814
CC(C)[C@@H](NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nccs1,CHEMBL150787_active,TRY1,Active,1,-9.17429,-7.58,-1.79,-8.615104634667887
N=C(N)c1cccc(C2=NO[C@H](Cn3cnnn3)[C@H]2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL347838_active,TRY1,Active,1,-9.12958,-8.31,-1.55,-10.779470901069384
COC(=O)CN(c1cccc(C(=N)N)c1)S(=O)(=O)CCc1ccc(-c2ccccc2S(N)(=O)=O)cc1,CHEMBL325101_active,TRY1,Active,1,-8.19674,-7.89,-3.0,-7.219580267925242
CCOC(=O)N[C@@H](CCCCN)C(=O)c1noc(Cc2ccc(C(=O)NCCc3cccc(Cl)c3)cc2)n1,CHEMBL209395_active,TRY1,Active,1,-11.105,-7.21,-4.5,-7.17290135568994
COC(=O)CC1(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)nc2)CC(c2cccc(C(=N)N)c2)=NO1,CHEMBL321314_active,TRY1,Active,1,-9.81228,-7.69,-2.55,-11.877155488908624
C/C(=C1\CC(=O)N(c2ccc(-c3ccccc3S(N)(=O)=O)cc2)C1=O)c1cccc(C(=N)N)c1,CHEMBL99629_active,TRY1,Active,1,-8.1769,-8.92,-2.15,-12.7412330655744
CCCOc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1-c1ccccn1,CHEMBL317917_active,TRY1,Active,1,-9.91354,-5.86,-2.52,-7.459835192809951
N=C(N)N1CCC[C@H](NC(=O)Cn2ccc(CCc3ccccc3)c(NS(=O)(=O)c3ccccc3)c2=O)C1O,CHEMBL174431_active,TRY1,Active,1,-7.93134,-9.07,-2.85,-7.837689483925702
C/C(=C(\F)C(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cc1Cl)c1cccc(C(=N)N)c1,CHEMBL38201_active,TRY1,Active,1,-8.33314,-8.93,-1.91,-7.890301130368855
Cc1nc(-c2cccc(C(=N)N)c2)c(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)o1,CHEMBL160958_active,TRY1,Active,1,-10.2598,-6.47,-2.65,-5.560263907261154
CCOC(=O)N[C@@H](CCCCN)C(=O)c1noc(Cc2ccc(OCCc3ccccc3)cc2)n1,CHEMBL211561_active,TRY1,Active,1,-9.71413,-8.25,-2.64,-8.103884957422402
N=C(N)c1ccc(/C=C2/CCCCCC/C(=C/c3ccc(C(=N)N)cc3)C2=O)cc1,CHEMBL150739_active,TRY1,Active,1,-8.67074,-6.67,-0.13,-6.136001343966108
CCc1nc2ccc(OC3CCN(C(C)=N)CC3)cc2n1Cc1cccc(-c2cccc(C(=N)N)c2)c1,CHEMBL282260_active,TRY1,Active,1,-10.4555,-9.83,-1.93,-8.958183059593432
Cc1ccc(N2C(=O)N(c3ccc(C)cc3)C2=O)cc1,CHEMBL296771_active,TRY1,Active,1,-5.53545,-7.25,-1.55,-4.25394451216336
COCc1onc(-c2cccc(C(=N)N)c2)c1C(=O)Nc1ccc(-c2ccccc2S(N)(=O)=O)cn1,CHEMBL160115_active,TRY1,Active,1,-8.62169,-8.69,-1.21,-8.027229566475699
CCOC(=O)C(Oc1ccc2c(c1)CN(C(=N)N)CC2)c1ccc(OC2CCN(C(=N)c3ccc(OC)cc3)CC2)cc1,CHEMBL144707_active,TRY1,Active,1,-11.2392,-8.83,-2.27,-7.902556551751724
N=C(N)c1ccc2cccc(N)c2c1,CHEMBL319264_active,TRY1,Active,1,-6.86413,-7.5,0.46,-14.939797913237276
N=C(N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCNCC2)c1,CHEMBL319868_active,TRY1,Active,1,-8.94404,-8.81,-1.08,-9.65205775629882
Cn1cc(C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c(-c2cccc(C(=N)N)c2)n1,CHEMBL347606_active,TRY1,Active,1,-8.99611,-6.03,-0.12,-6.01771937693743
CS(=O)(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccc(CN)nc1)C(c1ccccc1)c1ccccc1,CHEMBL7418_active,TRY1,Active,1,-9.19019,-8.09,-1.85,-16.092992730270424
CN1CCN=C1c1cccc(Oc2cc(C(=O)O)cc(Oc3cc(C(=N)N)ccc3O)n2)c1,CHEMBL84065_active,TRY1,Active,1,-9.20211,-8.12,-1.41,-8.910494922884553
CCOC(=O)C(CCc1cccc(C(=N)N)c1)Cn1cnc2cc(C(=N)N)ccc21,CHEMBL140016_active,TRY1,Active,1,-8.4378,-7.6,-1.39,-7.304540940998262
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](/C=C/c1ccccc1)NC(=O)c1ccc(-c2ccccc2)cc1,CHEMBL417714_active,TRY1,Active,1,-9.88825,-9.37,-2.18,-8.257993430420129
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCNC(=O)c2ccccn2)NS(=O)(=O)Cc2ccccc2)C1O,CHEMBL323642_active,TRY1,Active,1,-9.22182,-6.96,-3.77,-7.103657411062602
N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1)C(=O)c1nccs1,CHEMBL151379_active,TRY1,Active,1,-10.0537,-8.31,-1.07,-9.721283794579223
COC(=O)CC1(C(=O)Nc2cccc(C(=N)N)c2)CC(c2cccc(C(=N)N)c2)=NO1,CHEMBL93445_active,TRY1,Active,1,-9.92676,-8.15,-1.18,-8.076840664160274
N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCCCc1c[nH]cn1)C(c1ccccc1)c1ccccc1,CHEMBL371769_active,TRY1,Active,1,-8.7845,-8.72,-0.39,-7.685020505852656
NCCCC[C@H](NC(=O)c1ccc(F)cc1)C(=O)c1noc(Cc2ccc(C(=O)NCCc3cccc(Cl)c3)cc2)n1,CHEMBL213928_active,TRY1,Active,1,-9.82464,-9.44,-2.5,-7.426470913049476
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCCCc2cccc3ccccc23)CC1,CHEMBL72532_active,TRY1,Active,1,-7.71502,-8.13,-3.41,-6.761830802287771
O=C1Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)NCCCCCCOc2ccc(Cl)cc2CN1,CHEMBL317393_active,TRY1,Active,1,-7.65856,-5.65,-3.79,-3.979462972819591
N=C(N)c1ccc(CNC(=O)Cn2c(-c3ccccc3)c(Cl)nc(NCCc3ccccc3)c2=O)cc1,CHEMBL75084_active,TRY1,Active,1,-9.63794,-8.5,-1.44,-7.693860125529206
N=C(N)c1ccc(O)c(/C=C/CNC(=O)c2ccc(-c3cccc(S(N)(=O)=O)c3)cc2)c1,CHEMBL71418_active,TRY1,Active,1,-10.8281,-9.77,-2.55,-8.111971532681375
CCOC(=O)CN(NC(=O)OC(C)(C)C)C(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H](C=O)CCCN=C(N)N,CHEMBL110631_active,TRY1,Active,1,-8.72419,-7.05,-3.06,-8.214441638407749
CS(=O)(=O)Nc1c(CCC2CCCCC2)ccn(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)c1=O,CHEMBL170338_active,TRY1,Active,1,-8.65479,-6.98,-1.71,-6.2111892652422185
N=C(N)c1cccc(-c2ncccc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL351755_active,TRY1,Active,1,-8.20638,-8.97,-1.56,-7.458734230235829
N=C(N)c1cccc(Oc2ccc(NC(=O)c3ccccc3)c(Oc3cccc(C(=N)N)c3)n2)c1,CHEMBL295263_active,TRY1,Active,1,-10.6164,-7.25,-2.5,-8.014291542803939
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)C2CCCCC2)c(N)c1=O,CHEMBL32881_active,TRY1,Active,1,-7.99054,-8.6,-1.99,-7.933564991337818
N=C(N)NCCCC(C=O)NC(=O)[C@@H]1CCCN1C(=O)c1cc2ccccc2[nH]1,CHEMBL108848_active,TRY1,Active,1,-7.90768,-8.32,-3.0,-6.487376715276643
N=C(N)c1cccc(-c2ocnc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL157299_active,TRY1,Active,1,-7.97842,-8.21,-0.58,-7.525491020974249
CCC(C(=O)Nc1ccc(-n2cnc3ccccc32)cc1)c1csc2ccc(C(=N)N)cc12,CHEMBL361520_active,TRY1,Active,1,-8.78737,-8.06,-2.1,-6.078115167816916
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCCNC(=O)C1=O,CHEMBL430844_active,TRY1,Active,1,-7.67056,-7.66,-2.95,-6.290377380843577
N=C(N)c1cccc(N2CCCCN(C3CCN(Cc4ccccc4)CC3)C2=O)c1,CHEMBL421370_active,TRY1,Active,1,-8.46759,-5.79,-1.76,-5.379400119344485
N=C(N)c1ccc(O)c(OCC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1,CHEMBL76443_active,TRY1,Active,1,-8.82764,-7.97,-0.4,-6.807343519160411
N=C(N)N1CCC[C@H](NC(=O)CN2C(=O)C(NS(=O)(=O)Cc3ccccc3)Cc3ccccc32)C1O,CHEMBL88079_active,TRY1,Active,1,-9.5669,-8.48,-1.78,-7.790347590957376
N=C(N)c1ccc2cc(OC(=O)c3ccc(NC4=NCCN4)cc3)ccc2c1,CHEMBL1201881_active,TRY1,Active,1,-9.59807,-9.36,-1.06,-10.104774778464364
N=C(N)c1ccc2[nH]c(-c3cccc(Br)c3O)cc2c1,CHEMBL328772_active,TRY1,Active,1,-7.60651,-8.34,0.82,-11.747134504919632
N=C(N)c1ccc2ccc(CN(CCc3ccccn3)C(=O)c3cccc4ccccc34)cc2c1,CHEMBL195032_active,TRY1,Active,1,-8.69402,-8.26,-1.25,-8.445521829674117
N=C(N)c1ccc(-n2ccc3ccc(NCc4ccc5ccc(C(=N)N)cc5c4)cc32)cc1,CHEMBL172413_active,TRY1,Active,1,-8.61947,-9.1,-1.67,-7.199638953448244
N=C(N)c1ccc2ncn(CC(=O)c3ccc(-c4ccccc4S(N)(=O)=O)cc3)c2c1,CHEMBL139970_active,TRY1,Active,1,-8.84394,-8.96,-1.23,-8.223944905552557
NC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)CC(c2ccccc2)C2CCCCC2)CC1,CHEMBL408125_active,TRY1,Active,1,-9.12362,-8.62,-0.01,-7.590865113740043
CC1CCCC(C)N1CCCCN1C(=O)C(c2cccc(C(=N)N)c2)Oc2ccccc21,CHEMBL130313_active,TRY1,Active,1,-9.01711,-8.42,-0.66,-10.868101509593094
NCc1ccc(Cl)cc1CNC(=O)[C@@H]1CCCN1C(=O)C1(O)c2cc(Cl)ccc2-c2ncccc21,CHEMBL191441_active,TRY1,Active,1,-10.339,-8.28,-0.76,-8.285358629943051
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2cc[n+]([O-])cc2)cc1,CHEMBL46618_active,TRY1,Active,1,-8.44201,-9.01,-0.65,-17.29063072692015
COc1ccc2ccc(S(=O)(=O)N[C@H]3CCN(Cc4cc(C(=N)N)ccc4O)C3=O)cc2c1,CHEMBL93854_active,TRY1,Active,1,-8.58041,-8.39,-0.54,-10.077782655579066
Cn1cc(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)cc1C(=N)N,CHEMBL543817_active,TRY1,Active,1,-7.94029,-8.01,-0.88,-6.400594588488688
Cn1c(=O)c(Cc2ccc(C(=N)N)cc2)nc2cc(C3(C(=O)N4CCCC4)CC3)ccc21,CHEMBL431577_active,TRY1,Active,1,-8.82102,-9.06,-2.28,-7.786964864694602
COc1cc(C(Nc2ccc(C(=N)N)cc2)C(=O)O)ccc1OCc1ccccc1,CHEMBL199268_active,TRY1,Active,1,-9.29687,-8.73,-1.86,-18.14651206016768
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)c2ccc(CCCc3ccccc3)cc2)CC1,CHEMBL70703_active,TRY1,Active,1,-8.75686,-8.22,-2.82,-6.923742218396105
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCCCc2ccccc2)CC1,CHEMBL70350_active,TRY1,Active,1,-8.60057,-7.33,-3.25,-6.365660312066916
CN1CCN=C1c1cccc(Oc2nc(Oc3cc(C(=N)N)ccc3O)c(F)c(O[C@H]3CN[C@H](C(=O)O)C3)c2F)c1,CHEMBL332189_active,TRY1,Active,1,-11.1234,-9.27,-2.19,-8.920944643837602
Cn1c(=O)c(Cc2ccc(C(=N)N)cc2)nc2cc(C(C)(C)C(=O)N3CCCC3)ccc21,CHEMBL77215_active,TRY1,Active,1,-8.21955,-9.09,-2.2,-7.716890126096909
CN(C)C(=O)c1cccc(Oc2nc3c(c(Oc4cc(C(=N)N)ccc4O)n2)NC(=O)CN3)c1,CHEMBL71175_active,TRY1,Active,1,-8.89494,-9.21,-2.66,-10.74917012575523
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCCCCc2cccc3ccccc23)CC1,CHEMBL72708_active,TRY1,Active,1,-9.56832,-8.51,-2.61,-7.158003955362112
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCCCc2ccc3ccccc3c2)CC1,CHEMBL304359_active,TRY1,Active,1,-7.96059,-8.54,-4.41,-6.729372087877875
N=C(N)c1cccc(C(=O)N[C@@H](C(=O)N2CCC(C(=O)c3ccccc3)CC2)c2ccccc2)c1,CHEMBL283765_active,TRY1,Active,1,-9.81411,-8.25,-1.09,-8.4915845917696
COc1ccc2ccc(C(=N)N)cc2c1C1CCOC1,CHEMBL320817_active,TRY1,Active,1,-7.82533,-7.72,0.28,-19.94695988255421
N=C(N)N1CCC[C@H](NC(=O)CNC(=O)[C@@H](CCCNC(=O)c2cnccn2)NS(=O)(=O)Cc2ccccc2)C1O,CHEMBL420322_active,TRY1,Active,1,-8.61088,-8.07,-4.41,-6.820887602303221
CN1CCN=C1c1cccc(Oc2nc(Oc3cc(C(=N)N)ccc3O)c(F)c(OC3CCN(CC(=O)O)CC3)c2F)c1,CHEMBL332322_active,TRY1,Active,1,-10.7508,-7.82,-1.97,-9.330444257107365
CC1CCCC(C)N1CCCCCN1C(=O)C(c2cccc(C(=N)N)c2)Oc2ccccc21,CHEMBL133326_active,TRY1,Active,1,-8.90731,-8.29,-1.76,-10.049698470717209
N=C(N)c1ccc2[nH]cc(C(Cc3ccccc3)C(=O)Nc3ccc(-n4cnc5ccccc54)cc3F)c2c1,CHEMBL360894_active,TRY1,Active,1,-9.4233,-8.95,-2.46,-10.9342628070029
C[C@@H]1C(=O)N(CCCc2ccccc2)CC(=O)N1CC(=O)N[C@@H](CC1CCCN(C(=N)N)C1)C(=O)c1nccs1,CHEMBL82977_active,TRY1,Active,1,-9.48064,-9.03,-2.45,-8.866019800772946
N=C(N)c1cccc(C(=O)N[C@@H](C(=O)N2CCN(c3ccccc3)CC2)c2ccccc2)c1,CHEMBL435865_active,TRY1,Active,1,-8.73263,-6.29,-1.52,-6.679083019232581
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)c2cccs2)c(N)c1=O,CHEMBL33839_active,TRY1,Active,1,-9.04124,-8.58,-1.54,-8.483722189513841
N=C(N)c1ccc(C[C@H](N)C(=O)C2CCCCN2C(=O)[C@@H](N)S(=O)(=O)c2cccc3ccccc23)cc1,CHEMBL92820_active,TRY1,Active,1,-7.20034,-9.21,-2.79,-6.70155271979583
Cc1ccc(NC(=O)OCc2ccccc2)c(=O)n1CC(=O)NCC1CCN(C(=N)N)CC1,CHEMBL37836_active,TRY1,Active,1,-8.84894,-9.98,-3.0,-8.825182060737701
N=C(N)N1CCCCC1,CHEMBL103102_active,TRY1,Active,1,-5.73419,-5.67,0.42,-12.225346993040096
Cc1c(F)c(N(C)c2cccc(C(=N)N)c2)nc(N(C)c2cccc(C(=N)N)c2)c1F,CHEMBL49958_active,TRY1,Active,1,-9.61105,-8.46,-2.76,-11.798377030373498
NCc1ccc(Cl)c(NC(=O)CN2CCCCC(NC(=O)c3ccc(-c4ccccc4)cc3)C2=O)c1,CHEMBL323783_active,TRY1,Active,1,-9.42023,-10.54,-1.69,-7.809832268875224
CC1CCCCN1CCCN(Cc1ccc2ccc(C(=N)N)cc2c1)C(=O)c1cccc2ccccc12,CHEMBL197032_active,TRY1,Active,1,-9.61963,-8.71,-2.09,-10.332498902001785
N=C(N)N1CCC(OCCC2CCCCN2C(=O)[C@@H](CC2CCCCC2)NCC(=O)O)CC1,CHEMBL309670_active,TRY1,Active,1,-10.5776,-7.73,-1.6,-9.031581238201362
N=C(N)c1ccc2ccc(CN(CCc3c[nH]cn3)C(=O)c3cccc4ccccc34)cc2c1,CHEMBL195314_active,TRY1,Active,1,-7.65301,-7.83,-2.58,-8.791483667652559
N=C(N)c1ccc2ccc(CN(CCCN3CCOCC3)C(=O)c3cccc4ccccc34)cc2c1,CHEMBL197563_active,TRY1,Active,1,-8.67294,-8.85,-2.15,-9.636777021630389
N=C(N)c1cccc(-c2[nH]c(O)nc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL156505_active,TRY1,Active,1,-9.64997,-10.62,-1.85,-10.219871208437535
Cn1cc(NS(=O)(=O)Cc2ccccc2)c(=O)n(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)c1=O,CHEMBL40071_active,TRY1,Active,1,-8.28748,-8.33,-2.05,-7.672901830875602
CCOC(=O)C(C)(C)c1ccc2c(c1)nc(Cc1ccc(C(=N)N)cc1)c(=O)n2C,CHEMBL74701_active,TRY1,Active,1,-8.0524,-8.26,-1.58,-6.211486369932047
N=C(N)c1ccc(-n2ccc3ccc(NC(=O)c4cccc(C(=N)N)c4)cc32)cc1,CHEMBL368839_active,TRY1,Active,1,-8.53535,-8.84,-1.86,-7.216472729382207
N=C(N)c1cccc(CNc2ccc3ccn(-c4cccc(C(=N)N)c4)c3c2)c1,CHEMBL172147_active,TRY1,Active,1,-8.50985,-9.07,-1.09,-8.090752748063249
COC(=O)N[C@H](CC1CCN(C(=N)N)CC1)C(=O)NCC(=O)N[C@H]1CCCN(C(=N)N)C1O,CHEMBL162277_active,TRY1,Active,1,-9.52931,-7.45,-1.48,-7.9769877639873075
NCc1ccc(Cl)cc1CNC(=O)Cn1c(Cl)cnc(NCC(F)(F)c2cccc[n+]2[O-])c1=O,CHEMBL419773_active,TRY1,Active,1,-8.8582,-7.93,-2.15,-7.00314901601983
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)[C@H](CC1CCC1)C2,CHEMBL274152_active,TRY1,Active,1,-8.1969,-8.58,-1.29,-8.010390209418642
Nc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc(Cl)c(Cl)c2)NS(=O)(=O)Cc2ccccc2)cn1,CHEMBL121982_active,TRY1,Active,1,-10.3645,-7.98,-3.14,-8.754938482294987
CN1CCCC1CCN(Cc1ccc2ccc(C(=N)N)cc2c1)C(=O)c1cccc2ccccc12,CHEMBL194689_active,TRY1,Active,1,-8.5602,-10.04,-1.2,-11.211800259488577
N=C(N)c1ccc(CCC(CC(=O)n2cccc2)c2cccc(C(=N)N)c2)cc1,CHEMBL158063_active,TRY1,Active,1,-8.55155,-8.08,-1.57,-9.493330002772597
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)Cc2ccc(OCc3ccccc3)cc2)CC1,CHEMBL69394_active,TRY1,Active,1,-9.53684,-6.66,-3.17,-6.387881949443914
N=C(N)c1ccc2[nH]c(-c3cc(C(=O)O)cc(Br)c3O)c(Cc3ccccc3)c2c1,CHEMBL417020_active,TRY1,Active,1,-9.00424,-9.01,-0.12,-13.42976628797352
CC(C)CCN(Cc1ccc2ccc(C(=N)N)cc2c1)C(=O)c1ccc2ccccc2c1,CHEMBL193745_active,TRY1,Active,1,-8.89235,-8.93,-1.33,-9.086293142481892
N=C(N)c1cccc(C(=O)N[C@@H](C(=O)N2CCN(C(=O)c3ccccc3)CC2)c2ccccc2)c1,CHEMBL350632_active,TRY1,Active,1,-8.52181,-9.23,-0.7,-9.504317084005931
N=C(N)C1CCC[C@H](NC(=O)CN2CCC[C@@H](NS(=O)(=O)Cc3ccccc3)C2=O)C1O,CHEMBL139656_active,TRY1,Active,1,-8.63583,-8.95,-2.69,-7.8547864201136415
Cc1cn(C)c(-c2cccc(Oc3cc(C(=O)O)cc(Oc4cc(C(=N)N)ccc4O)n3)c2)n1,CHEMBL79529_active,TRY1,Active,1,-9.08987,-8.99,-2.28,-8.947708511960007
CS(=O)(=O)Nc1c(CCCc2ccccc2)ccn(CC(=O)N[C@H]2CCCN(C(=N)N)C2O)c1=O,CHEMBL170400_active,TRY1,Active,1,-8.9178,-8.81,-2.59,-7.773544304427639
COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2ncc[nH]2)cc1,CHEMBL45298_active,TRY1,Active,1,-8.02337,-8.46,-2.52,-7.869911720596018
CN1CCN(CCCN(Cc2ccc3ccc(C(=N)N)cc3c2)C(=O)c2cccc3ccccc23)CC1,CHEMBL371051_active,TRY1,Active,1,-8.53793,-8.19,-1.62,-8.151120285364367
CCOC(=O)[C@@H]1CCCCC1NC(=O)C(Cc1ccccc1)c1cccc2ccc(C(=N)N)cc12,CHEMBL362478_active,TRY1,Active,1,-10.0285,-5.69,-2.65,-7.443093993337006
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)c2ccccc2)c(N)c1=O,CHEMBL32531_active,TRY1,Active,1,-7.82543,-9.35,-2.2,-7.13346819698892
C/C(=C1\CC(=O)N(c2ccc(C(C)(C)C)cc2)C1=O)c1cccc(C(=N)N)c1,CHEMBL99630_active,TRY1,Active,1,-9.05069,-7.97,0.03,-8.026126768578061
N=C(N)c1ccc(C2=NOC(CC(=O)Nc3cccc(C(=N)N)c3)C2)cc1,CHEMBL317590_active,TRY1,Active,1,-9.46939,-9.21,-0.63,-8.233292322089413
N=C(N)c1ccc(-n2c3ccccc3c3ccc(OCc4ccc5ccc(C(=N)N)cc5c4)cc32)cc1,CHEMBL367166_active,TRY1,Active,1,-10.1639,-11.26,-2.02,-10.165683279412104
Cc1ccc(S(=O)(=O)NC(Cc2cccc(C(=N)N)c2)C(=O)N2CCC(C)CC2)cc1,CHEMBL422147_active,TRY1,Active,1,-8.60801,-8.3,-0.72,-10.050631076557872
N=C(N)N1CCC[C@H](NC(=O)CN2CCC(NS(=O)(=O)Cc3ccccc3)C2=O)C1O,CHEMBL431782_active,TRY1,Active,1,-7.98496,-7.51,-1.63,-6.843310484923988
CCCCCCC(NC(=O)c1ccc(C#N)cc1)C(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCC,CHEMBL108294_active,TRY1,Active,1,-8.04811,-5.33,-4.36,-6.397749984187201
CS(=O)(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1csc(C(=N)NN)c1)C(c1ccccc1)c1ccccc1,CHEMBL7292_active,TRY1,Active,1,-10.2169,-8.31,-0.93,-18.87471987985576
Cn1c(=O)c(Cc2ccc(C(=N)N)cc2)nc2cc(C3(N(C(=O)CC(=O)O)C4CCCC4)CC3)ccc21,CHEMBL74263_active,TRY1,Active,1,-9.9256,-7.52,-2.84,-6.994318447496588
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)CC2CCC2)c(N)c1=O,CHEMBL32541_active,TRY1,Active,1,-7.45401,-8.65,-2.88,-9.084486515234603
CN(C1CCCCC1)[C@@H](CCC(=O)O)C(=O)N1CCCC[C@H]1CCOC1CCN(C(=N)N)CC1,CHEMBL312647_active,TRY1,Active,1,-9.87161,-7.71,-1.68,-9.242805713087844
CCOC(=O)C1(c2ccc3c(C)cc(Oc4ccc(C(=N)N)cc4)nc3c2)CCCC1,CHEMBL75828_active,TRY1,Active,1,-8.87719,-9.06,-3.18,-7.420968124673798
N=C(N)c1cccc(C(=O)N[C@@H](C(=O)N2CCN(c3ccncc3)CC2)c2ccccc2)c1,CHEMBL159375_active,TRY1,Active,1,-9.01846,-8.54,-0.78,-12.576881741359632
Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCC1CCN(C(=N)N)CC1,CHEMBL287614_active,TRY1,Active,1,-7.75609,-8.75,-1.36,-7.017592471988959
N=C(N)NCCCC(C=O)NC(=O)[C@@H]1CCCN1C(=O)C1CCc2ccccc2N1,CHEMBL108338_active,TRY1,Active,1,-8.69552,-7.73,-2.18,-6.635665817489477
CCOC(=O)C1(c2ccc3c(c2)nc(Cc2ccc(C(=N)N)cc2)c(=O)n3C)CC1,CHEMBL308600_active,TRY1,Active,1,-8.2896,-8.44,-1.31,-6.312196305842104
N=C(N)c1ccc(/C=C2\CC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1,CHEMBL150962_active,TRY1,Active,1,-9.31191,-9.49,-2.47,-8.503823274496009
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCc2ccc3ccccc3c2)CC1,CHEMBL70763_active,TRY1,Active,1,-8.60813,-8.38,-3.14,-8.150174150292745
COC(=O)CC(CCc1ccc(NS(=O)(=O)c2ccccc2)cc1)c1cccc(C(=N)N)c1,CHEMBL348038_active,TRY1,Active,1,-8.12699,-8.51,-2.98,-7.3622643860470385
CC(=N)N1CCC(Oc2ccc(C(Cc3ccc4cc[n+](C(=N)N)cc4c3)C(=O)O)cc2)C1,CHEMBL180677_active,TRY1,Active,1,-10.2219,-8.59,-1.81,-8.630662978934254
CC1CCN(C(=O)C(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2cccc3ccccc23)CC1,CHEMBL348443_active,TRY1,Active,1,-7.82601,-8.96,-2.27,-8.455158985596855
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)CC2CCCC2)c(N)c1=O,CHEMBL33480_active,TRY1,Active,1,-8.41196,-8.74,-2.56,-7.092493642582893
N=C(N)c1ccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1,CHEMBL156858_active,TRY1,Active,1,-7.85397,-9.04,-0.53,-7.917509885027596
N=C(N)c1cccc(C(=O)N[C@@H](C(=O)N2CCC(Cc3ccccc3)CC2)c2ccccc2)c1,CHEMBL163578_active,TRY1,Active,1,-9.79596,-8.4,-1.31,-8.755963648652042
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccc(N)nc1)C(C1CCCCC1)C1CCCCC1,CHEMBL122331_active,TRY1,Active,1,-9.23213,-8.48,-1.76,-11.485217675292189
N=C(N)Nc1ccc(C2C/C(=C/I)OC(=O)C2NC(=O)c2ccccc2)cc1,CHEMBL135724_active,TRY1,Active,1,-9.13333,-7.4,-0.95,-9.793898384353565
N=C(N)c1ccc(CNc2ccc3ccn(Cc4ccc(C(=N)N)cc4)c3c2)cc1,CHEMBL173622_active,TRY1,Active,1,-9.31527,-8.72,-1.97,-8.19173609050209
N=C(N)NCCCNOC(=O)CN(C(=O)[C@@H](CC1CCCCC1)NCC(=O)O)C1CCCC1,CHEMBL332655_active,TRY1,Active,1,-9.00943,-7.24,-2.46,-7.849134522555674
Cc1c(F)c(Oc2cccc(C(=N)N)c2)nc(N(C)c2cccc(C(=N)N)c2)c1F,CHEMBL52205_active,TRY1,Active,1,-8.31483,-9.26,-0.86,-8.82740664762826
CC(C)CCN(Cc1ccc2ccc(C(=N)N)cc2c1)C(=O)c1cccc2ccccc12,CHEMBL382064_active,TRY1,Active,1,-7.28713,-8.76,-1.24,-8.750391143082295
N=C(N)N1CCC(OCC[C@@H]2CCCCN2C(=O)[C@H](CC(=O)O)NC2CCCCCC2)CC1,CHEMBL309403_active,TRY1,Active,1,-8.79375,-8.28,-2.86,-7.649702497675826
N=C(N)NCCC[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CCCCCNC(=O)C1=O,CHEMBL98856_active,TRY1,Active,1,-8.69306,-6.94,-2.43,-7.233454860755873
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1C(=O)N[C@H](C=O)CCCN=C(N)N,CHEMBL139490_active,TRY1,Active,1,-7.30253,-7.52,0.1,-7.804020299317808
N=C(N)N1CCC(OCCC2CCCCN2C(=O)[C@H](CC(=O)O)NC2CCCCCCC2)CC1,CHEMBL82658_active,TRY1,Active,1,-9.28907,-8.37,-2.48,-8.70586130942738
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC1,CHEMBL71061_active,TRY1,Active,1,-7.54459,-6.44,-2.29,-6.44151950735066
Cc1c(F)c(Oc2cccc(C(=N)N)c2)cc(Oc2cccc(C(=N)N)c2)c1F,CHEMBL126575_active,TRY1,Active,1,-9.48562,-7.72,-1.16,-8.718643037150558
CCOC(=O)[C@@H]1C[C@@H](Oc2c(F)c(Oc3cccc(C(=O)N(C)C)c3)nc(Oc3cc(C(=N)N)ccc3O)c2F)CN1,CHEMBL332388_active,TRY1,Active,1,-10.0371,-8.28,-2.5,-7.850319604760976
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc(S(=O)(=O)NCC2CCC2)c(N)c1=O,CHEMBL32661_active,TRY1,Active,1,-8.21764,-8.66,-2.69,-7.898572640200668
N=C(N)c1ccc2ccc(CN(CCC[n+]3cc[nH]c3)C(=O)c3cccc4ccccc34)cc2c1,CHEMBL196182_active,TRY1,Active,1,-8.77711,-8.14,-1.63,-10.440129848375229
COC(=O)CC(CCCCc1ccc(NC(=N)N)cc1)c1cccc(C(=N)N)c1,CHEMBL351329_active,TRY1,Active,1,-8.72999,-7.76,-3.02,-7.564993772667524
N=C(N)c1cccc(OC2N=C(Oc3cccc(C(=N)N)n3)CNC2=O)c1,CHEMBL50961_active,TRY1,Active,1,-8.51368,-8.56,-0.86,-8.363016075804962
N=C(N)c1cccc(Oc2nccc(Oc3cccc(C(=N)N)n3)n2)c1,CHEMBL45732_active,TRY1,Active,1,-8.96174,-8.63,-1.46,-7.888662750237932
CC1CCC(C)N1CCCCCN1C(=O)C(c2cccc(C(=N)N)c2)Oc2ccccc21,CHEMBL130569_active,TRY1,Active,1,-9.42596,-8.16,-0.52,-9.200956261394444
CN(C)C(=O)c1cccc(Oc2nc(Oc3cc(C(=N)N)ccc3O)c(F)c(OC3CCN(CC(=O)O)CC3)c2F)c1,CHEMBL120438_active,TRY1,Active,1,-10.6287,-8.0,-2.19,-8.861720434018428
N=C(N)C1CCC[C@H](NC(=O)CN2CCC[C@H](NS(=O)(=O)c3ccccc3)C2=O)C1O,CHEMBL141106_active,TRY1,Active,1,-9.18656,-6.6,-1.73,-6.645672849831389
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cc2c(c1=O)NC(=O)[C@H](CC1CC1)C2,CHEMBL10785_active,TRY1,Active,1,-8.42823,-8.64,-1.79,-8.52062974887634
N=C(N)c1cccc(-c2ccccc2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL160515_active,TRY1,Active,1,-8.57664,-9.34,-1.69,-8.17057383167789
C[C@@H]1CCN(C(=O)[C@H](CC(=O)NC[C@@H]2CCCN(C(=N)N)C2)NS(=O)(=O)c2ccc3ccccc3c2)[C@@H](C(=O)O)C1,CHEMBL126238_active,TRY1,Active,1,-9.93458,-9.06,-3.91,-9.025094209542848
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCC(C)(C)c2ccccc2)c1=O,CHEMBL143139_active,TRY1,Active,1,-8.38266,-8.64,-1.71,-7.666456747056613
Cc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCC(F)(F)c2ccccn2)c1=O,CHEMBL143418_active,TRY1,Active,1,-8.19605,-8.94,-1.99,-7.941068673771613
COc1cccc(CCC(=O)N2CCN(C(=O)N3C(=O)[C@H](CC4CCNCC4)[C@H]3C(=O)O)CC2)c1,CHEMBL304985_active,TRY1,Active,1,-7.52697,-7.42,-4.7,-6.821713218878218
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)CCCCc2ccccc2)CC1,CHEMBL305738_active,TRY1,Active,1,-8.73669,-7.21,-2.11,-7.9981435253426225
N=C(N)c1ccc2[nH]c(-c3cc(Cc4nn[nH]n4)cc(Br)c3O)c(Cc3ccccc3)c2c1,CHEMBL49987_active,TRY1,Active,1,-8.81348,-8.85,-1.17,-8.462649527098911
COc1cccc(-c2csc(-c3cc(C(=N)N)sc3SC)n2)c1,CHEMBL29205_active,TRY1,Active,1,-8.11678,-7.01,-1.55,-6.670566445180382
NC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)C2(O)c3ccccc3-c3ccccc32)CC1,CHEMBL262967_active,TRY1,Active,1,-7.72389,-8.13,-1.73,-7.490453119394546
COc1ccc2sc(S(=O)(=O)N[C@H]3CCN(Cc4cc(C(=N)N)ccc4N)C3=O)cc2n1,CHEMBL96218_active,TRY1,Active,1,-9.91153,-7.81,-0.72,-7.480699445900258
N=C(N)N1CCC(CC(=O)CN2CCCC[C@H](NS(=O)(=O)c3ccc4c(c3)CCO4)C2=O)CC1,CHEMBL349172_active,TRY1,Active,1,-9.33918,-8.5,-1.88,-8.33097737588999
N=C(N)c1cccc(OCC(=O)Nc2ccc(C(=O)N3CC=CC3)cc2)c1,CHEMBL76408_active,TRY1,Active,1,-7.64206,-7.71,-1.78,-7.087760737370172
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc3c(c2)OCO3)cs1,CHEMBL31967_active,TRY1,Active,1,-7.59812,-7.6,-0.98,-6.5172564456274165
N=C(N)c1cccc(C(=O)N2Cc3ccc(O)cc3C[C@H]2C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL99262_active,TRY1,Active,1,-9.02289,-9.78,-1.52,-8.167189284220667
Cc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)c(=O)n1CC(=O)NCC1CCN(C(=N)N)CC1,CHEMBL37035_active,TRY1,Active,1,-9.32266,-8.11,-2.91,-7.977094580463227
NC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)CC(c2ccccc2)c2ccccn2)CC1,CHEMBL332870_active,TRY1,Active,1,-9.64968,-8.38,-1.87,-8.346045274867853
N=C(N)c1ccc(CNC(=O)CNC(=O)[C@@H](CO)NS(=O)(=O)CCc2ccccc2)cc1,CHEMBL415741_active,TRY1,Active,1,-9.35631,-6.54,-1.15,-7.148797768858757
N=C(N)c1ccc2ccc(CN(CCCc3ccccc3)C(=O)c3cccc4ccccc34)cc2c1,CHEMBL195238_active,TRY1,Active,1,-8.48207,-8.12,-3.56,-10.68821127077858
CCN(c1nc2ccccc2c(=O)o1)S(=O)(=O)c1ccc(Cl)cc1,CHEMBL165932_active,TRY1,Active,1,-6.71294,-5.51,-1.1,-4.874815941844632
Cc1ccc(NC(=O)CCc2ccccc2)c(=O)n1CC(=O)NCC1CCN(C(=N)N)CC1,CHEMBL290947_active,TRY1,Active,1,-9.46345,-10.05,-2.05,-7.82515286905728
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)Cc2ccc(Oc3ccccc3)cc2)CC1,CHEMBL302792_active,TRY1,Active,1,-9.09989,-6.54,-2.39,-6.193854693099824
N=C(N)N1CCC[C@H](NC(=O)CN2CCCC[C@@](N)(Cc3ccccc3)C2=O)C1O,CHEMBL431396_active,TRY1,Active,1,-8.42473,-7.62,-0.63,-5.920366492747535
O=C(O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)N1CCN(C(=O)Cc2cccc(Oc3ccccc3)c2)CC1,CHEMBL305457_active,TRY1,Active,1,-7.73775,-6.66,-4.25,-5.933611789082716
N=C(N)c1cccc(Oc2cncc(Oc3cccc(C(=N)N)n3)n2)c1,CHEMBL45785_active,TRY1,Active,1,-8.84039,-8.3,-2.28,-8.266215164934032
N=C(N)c1cccc(Oc2ccccc2NC(=O)c2ccc(-c3ccccc3S(N)(=O)=O)cc2)c1,CHEMBL297835_active,TRY1,Active,1,-9.46221,-8.82,-1.1,-7.184038117098155
CC1(C)C2CCC1(CS(=O)(=O)N=C(N)N)C(=O)C2,CHEMBL51292_active,TRY1,Active,1,-6.30065,-7.27,-0.83,-8.98399079986966
CC(C)(CNC(=O)c1ccccc1)C(=O)OC(=O)C(C)(C)CNC(=O)c1ccccc1,CHEMBL134268_active,TRY1,Active,1,-7.0394,-6.72,-3.65,-6.626403055174863
NC(=S)N/N=C/[C@@H](O)[C@H](O)[C@H](O)CO,C04018031_decoy,TRY1,Decoy,0,-7.00505,-5.32,-1.21,-6.829616500571465
[NH2+]=C1NNC(=[NH2+])C1=NNc1ccc([N+](=O)[O-])cc1,C04477398_decoy,TRY1,Decoy,0,-8.15985,-8.85,-0.91,-10.069346022474765
NC(=S)NN[C@@H]1OC[C@H](O)[C@@H](O)[C@@H]1O,C04529966_decoy,TRY1,Decoy,0,-5.79632,-5.91,-2.61,-5.516278490314197
NC(=O)N[C@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O,C04718899_decoy,TRY1,Decoy,0,-4.9986,-4.11,-2.26,-3.405895445284396
NC(=O)N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@H]1O,C04718902_decoy,TRY1,Decoy,0,-4.87037,-4.32,-3.37,-3.431228453912921
Nc1nc(N)nc(CCc2nc(N)nc(N)n2)n1,C01674441_decoy,TRY1,Decoy,0,-7.57241,-6.38,-1.8,-7.470222710601594
NC(=O)N[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C05131877_decoy,TRY1,Decoy,0,-4.48949,-4.78,-2.4,-3.4478802126578096
OC[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,C05224152_decoy,TRY1,Decoy,0,-5.02178,-7.62,-3.62,-6.975598956623241
CC(C)[C@H]([NH3+])C(=O)NNC(=O)[C@@H]([NH3+])C(C)C,C01605714_decoy,TRY1,Decoy,0,-6.62388,-4.13,-1.25,-4.122861260712765
C[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1[NH2+][C@@H]1C=C(CO)[C@H](O)[C@H](O)[C@@H]1O,C05736110_decoy,TRY1,Decoy,0,-6.93241,-6.22,-2.15,-4.8464175926798445
[NH3+][C@@H]1C=C(C(=O)[O-])O[C@H]([C@H](O)[C@H](O)CO)[C@@H]1O,C06158052_decoy,TRY1,Decoy,0,-9.41682,-4.43,-1.75,-5.574947815783779
C[C@H]1O[C@@H](OC[C@H]2O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C06468498_decoy,TRY1,Decoy,0,-4.48727,-5.66,-1.41,-4.208724033474788
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C06469326_decoy,TRY1,Decoy,0,-4.30346,-5.67,-1.66,-3.509989102095609
Nc1ncc([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(N)n1,C04772566_decoy,TRY1,Decoy,0,-6.43934,-7.06,-0.74,-7.615897238186839
[NH2+]=C1N[C@@H]2[C@@H](N1)N(C=O)[C@H]1NC(=[NH2+])N[C@H]1N2C=O,C15134554_decoy,TRY1,Decoy,0,-8.37766,-5.04,0.09,-4.9466616833640815
NC(=S)NN[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O,C16137473_decoy,TRY1,Decoy,0,-5.6419,-6.45,-1.26,-6.649748339015311
C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C1NNC(=S)NN1,C16322549_decoy,TRY1,Decoy,0,-7.36382,-5.36,-0.04,-8.608538907309242
CN[C@@H](NCCCCc1n[nH]c(N)n1)[NH2+]C#N,C19319963_decoy,TRY1,Decoy,0,-7.17498,-5.78,-2.15,-6.3202604999750704
C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@H](CO)O[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22059715_decoy,TRY1,Decoy,0,-5.43536,-5.84,-2.84,-4.239832943373491
C[C@@H]1O[C@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@H](CO)O[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22059719_decoy,TRY1,Decoy,0,-5.18395,-5.72,-2.04,-3.9488086511809377
[NH3+]CCN[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C22591934_decoy,TRY1,Decoy,0,-6.62808,-5.8,-2.2,-6.566565872453437
OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@@H]1[NH2+]CCS1,C32107339_decoy,TRY1,Decoy,0,-8.00632,-4.0,-2.45,-5.050954985463493
O=c1[nH]c(Nc2[nH]c(=O)[nH]c(=O)[nH+]2)[nH+]c(=O)[nH]1,C33665985_decoy,TRY1,Decoy,0,-6.72696,-6.68,-0.4,-3.6538077240758526
Nc1nc(N)nc(CSc2n[nH]c(N)n2)n1,C17527325_decoy,TRY1,Decoy,0,-6.88626,-7.49,-0.95,-7.380369199613802
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1[NH2+]CCS1,C04320893_decoy,TRY1,Decoy,0,-7.72209,-5.17,-0.75,-6.956165906878281
C=CCOC[C@@H](O)CN/C(N)=N/C(N)=[NH2+],C38646447_decoy,TRY1,Decoy,0,-7.75729,-6.23,-0.33,-11.700707057467705
CCN(CCO)c1nc[nH+]c(NN)c1N,C40736212_decoy,TRY1,Decoy,0,-7.63523,-6.21,-1.99,-8.515047261028904
NNc1[nH+]cnc(Nc2cccnc2)c1N,C40759723_decoy,TRY1,Decoy,0,-7.74812,-7.27,0.17,-8.919956228231015
C[NH+](C)CCCCNC(=O)[C@@H]([NH3+])CC(N)=O,C41679629_decoy,TRY1,Decoy,0,-7.79662,-4.96,-2.96,-6.513839540816278
[NH3+][C@@H]1C=C(C(=O)[O-])O[C@@H]([C@@H](O)[C@H](O)CO)[C@@H]1O,C44019145_decoy,TRY1,Decoy,0,-9.2219,-4.6,-1.64,-5.196762995050988
CCC1(C)[C@H](C[NH3+])C(=O)NC(=O)[C@@H]1C[NH3+],C44250091_decoy,TRY1,Decoy,0,-8.47805,-3.83,-1.87,-4.610910516482921
[NH3+][C@H](CO)CC(C[C@H]([NH3+])CO)c1ccncc1,C44466679_decoy,TRY1,Decoy,0,-8.7448,-6.23,-1.82,-11.9108850325255
[NH3+][C@H](CO)Cc1sccc1C[C@@H]([NH3+])CO,C44467099_decoy,TRY1,Decoy,0,-8.80671,-5.21,-1.8,-7.602977483730308
[NH3+][C@H](CO)Cc1cccc(C[C@H]([NH3+])CO)c1O,C44468449_decoy,TRY1,Decoy,0,-8.43143,-6.36,-0.63,-10.505055879180029
C[C@@H](C(=O)NC(N)=O)[NH+]1CCC(C[NH3+])CC1,C44514402_decoy,TRY1,Decoy,0,-6.9289,-4.45,-0.24,-4.47591774714575
C[C@H]1O[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](CO)O[C@@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C44699268_decoy,TRY1,Decoy,0,-5.24095,-7.36,-1.19,-7.748368052248168
C[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](O)O[C@H]2CO)[C@@H](O)[C@@H](O)[C@H]1O,C44699274_decoy,TRY1,Decoy,0,-4.56437,-5.89,-1.67,-5.22212247528373
C[NH+](CC(=O)NC(N)=O)C1(C[NH3+])CCCC1,C50090287_decoy,TRY1,Decoy,0,-7.66119,-3.76,-1.52,-4.397777424616222
CCC(CC)(C[NH3+])[NH+](C)CC(=O)NC(N)=O,C50092433_decoy,TRY1,Decoy,0,-7.05235,-4.48,-0.75,-4.765807969670487
NC(=O)C[C@H]([NH3+])C(=O)NC1(CO)CCCC1,C53071994_decoy,TRY1,Decoy,0,-7.80926,-5.91,-1.76,-7.496954007309426
NC(=S)NN[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C34254325_decoy,TRY1,Decoy,0,-6.30364,-4.28,-2.86,-3.945556240936842
NC(=S)N/N=C/c1ncc(N)cc1N,C13756696_decoy,TRY1,Decoy,0,-6.95654,-4.47,-0.89,-5.112633787909926
CCCCCc1[nH+]c(N)c(C#N)c(N)c1N,C16638658_decoy,TRY1,Decoy,0,-9.29351,-5.28,-0.63,-5.428593883052455
NC(=O)CN(CC(N)=O)C(=O)[C@@H]1C[C@H]1[NH3+],C61805601_decoy,TRY1,Decoy,0,-8.11297,-5.42,-1.1,-10.707095505534822
C[C@H](C[NH+](CC(N)=O)CC(N)=O)C(N)=S,C61807115_decoy,TRY1,Decoy,0,-7.50918,-5.29,-1.41,-7.400709921595782
CC[C@H](CC(N)=S)[NH+](CC(N)=O)CC(N)=O,C61807123_decoy,TRY1,Decoy,0,-7.25103,-3.85,-4.07,-5.128079025995876
NC(=O)C[NH+](CC(N)=O)CC1(O)CC[NH2+]CC1,C61807384_decoy,TRY1,Decoy,0,-7.41388,-4.12,-2.71,-4.355370081360708
CC[C@H](C)[C@H]([NH3+])C(=O)N(CC(N)=O)CC(N)=O,C61808704_decoy,TRY1,Decoy,0,-7.04688,-4.19,-1.52,-4.631549116388127
CC[C@H](C)[C@@H]([NH3+])C(=O)N(CC(N)=O)CC(N)=O,C61808766_decoy,TRY1,Decoy,0,-7.74646,-5.51,-1.38,-6.737629776418312
NC(=O)NNC(=N\O)/C(=N/O)NNC(N)=O,C13757287_decoy,TRY1,Decoy,0,-7.14437,-7.41,-1.75,-7.2255282790208515
CCOc1ccc2[nH+]c(NCCNC(=O)Nc3c(C)cccc3C)c(C#N)cc2c1,C04937018_decoy,TRY1,Decoy,0,-7.51029,-6.29,-2.33,-5.238024895139509
CCC[NH+]1CCc2c(sc(NC(=O)c3ccccc3SCC)c2C(N)=O)C1,C05240792_decoy,TRY1,Decoy,0,-9.05392,-5.87,-2.47,-5.985403170955841
CCOc1ccc([C@@H]2CCC[NH+]2Cc2nc(N)nc(Nc3ccccc3C)n2)cc1,C06822341_decoy,TRY1,Decoy,0,-7.92416,-6.5,-3.63,-6.833185115327616
CCOc1ccc([C@H]2CCC[NH+]2Cc2nc(N)nc(Nc3ccccc3C)n2)cc1,C06822346_decoy,TRY1,Decoy,0,-7.25337,-6.86,-1.04,-5.649814118920887
CCOc1cc(C[NH2+]Cc2cccs2)cc(Br)c1OCC(N)=O,C08253735_decoy,TRY1,Decoy,0,-9.04863,-6.06,-2.47,-10.092889033846513
CCOc1ccc([C@H]2CCC[NH+]2Cc2nc(N)nc(Nc3ccc(C)cc3)n2)cc1,C09223058_decoy,TRY1,Decoy,0,-8.87869,-6.0,-1.47,-5.2378033665008825
C[NH+](C)CCOc1ccc(Cl)cc1CCNS(=O)(=O)c1ccc(N)cc1,C11863697_decoy,TRY1,Decoy,0,-8.53273,-7.3,-2.13,-8.501449437545189
C[C@H]([NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C32791558_decoy,TRY1,Decoy,0,-9.11766,-7.66,-2.03,-10.018164898884924
C[C@H]([NH2+][C@H](C)c1ccc(Cl)c(Cl)c1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C32791560_decoy,TRY1,Decoy,0,-7.37194,-6.68,-1.56,-5.861495047584418
COC(=O)C1=C(C)NC(C)=C(C(=O)OCC[NH3+])[C@H]1c1ccccc1C(F)(F)F,C34909544_decoy,TRY1,Decoy,0,-6.18936,-3.89,-2.49,-4.3294629812720125
COc1c(Br)cc(Cl)cc1S(=O)(=O)NC[C@@H]([NH3+])CC(C)C,C36299126_decoy,TRY1,Decoy,0,-8.42932,-5.05,-2.97,-5.153813892453123
C[NH+](C)CCNS(=O)(=O)c1c(N)cc(Br)cc1Br,C37054688_decoy,TRY1,Decoy,0,-7.37229,-5.49,-2.75,-5.0678102724826815
O=C(c1ccccc1)N1N[C@H](c2cccnc2)N[C@H]1[NH2+]CC1=CC2=CC=N[C@@H]2C=C1,C38576871_decoy,TRY1,Decoy,0,-8.78804,-8.1,-0.71,-7.327093504561503
[O-][C@@H]1CN([C@H](C[NH2+]Cc2ccccc2)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531154_decoy,TRY1,Decoy,0,-9.52101,-7.78,-1.79,-7.267778826555661
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4cccnc4Cl)CC34CC[NH2+]CC4)c2c1,C39655901_decoy,TRY1,Decoy,0,-8.64581,-7.65,-0.74,-7.009135705920589
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4)CC34CC[NH2+]CC4)c2c1,C39655923_decoy,TRY1,Decoy,0,-9.17438,-8.55,-2.57,-7.31257858781709
Cc1cccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)c1,C39676372_decoy,TRY1,Decoy,0,-8.20582,-7.7,-1.49,-5.583415380491809
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4ccc(Cl)cc4)CC34CC[NH2+]CC4)c[nH]c12,C39684103_decoy,TRY1,Decoy,0,-8.54484,-8.93,-1.64,-7.972428426872921
CC1(C)C[C@@H]2C[C@@](C)(CN2c2cncc(/C(N)=[NH+]\NC(=S)N3CCCC3)n2)C1,C44552077_decoy,TRY1,Decoy,0,-9.08565,-7.3,-1.91,-6.275430105587473
CCOc1ccc(Nc2c(CC)c(N[C@@H]3CCC[NH2+]C3)c(C#N)c3ccnn23)cc1,C45314651_decoy,TRY1,Decoy,0,-7.46805,-5.74,-3.14,-5.521029430779604
COc1cc(-c2nc(C(C)(C)C[NH3+])[nH]c2-c2ccncc2)ccc1Br,C45337307_decoy,TRY1,Decoy,0,-10.1118,-6.74,-2.32,-10.56226869204945
C[C@@H]([NH2+]CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1ccc(Cl)cc1Cl,C08531615_decoy,TRY1,Decoy,0,-8.60227,-8.71,-1.0,-7.902927413648923
Cc1c(C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)oc2ccccc12,C49798416_decoy,TRY1,Decoy,0,-7.60828,-7.11,-1.02,-8.151686493297158
Cc1c(C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)[NH+](C)C)oc2ccccc12,C49798417_decoy,TRY1,Decoy,0,-7.98306,-6.81,-3.6,-5.862302340929514
COc1ccc2[nH]cc(C3=CC[NH+]([C@H](C)C(=O)NC(=O)NCC(C)C)CC3)c2c1,C53073733_decoy,TRY1,Decoy,0,-8.06559,-7.91,-2.6,-5.761339761121612
CN(C)/C=C(C(\N)=[NH+]\N=c1\[nH]c2ccccc2s1)/S(=O)(=O)c1ccccc1,C17082258_decoy,TRY1,Decoy,0,-8.22852,-7.7,-0.84,-7.33688989772295
C[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1F)c1ccc(OCC(=O)NC2CC2)cc1,C56184486_decoy,TRY1,Decoy,0,-7.57085,-7.16,-3.59,-5.8054396740820176
CCCNC(=O)CCNC(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C57297705_decoy,TRY1,Decoy,0,-8.62561,-6.05,-3.46,-6.076977967946686
Cc1ccccc1C[NH+]1CCN([C@H](C)c2nc(N)nc(Nc3ccccc3)n2)CC1,C58452340_decoy,TRY1,Decoy,0,-6.92446,-6.96,-1.33,-6.431124547888103
CC[NH+](CC)C[C@@H](C)NS(=O)(=O)c1cc(Cl)cc(N)c1Br,C61882502_decoy,TRY1,Decoy,0,-7.87993,-4.42,-2.4,-4.930335009854313
CC[NH+](CC)C[C@H](C)NS(=O)(=O)c1cc(Cl)cc(N)c1Br,C61882504_decoy,TRY1,Decoy,0,-8.07266,-3.9,-3.74,-5.041621422605659
CNC1=C(C(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2cccs2)[C@@H](C)NS1,C63127498_decoy,TRY1,Decoy,0,-8.40479,-7.7,-1.2,-8.942450903138386
O=C(CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1)NC[C@H](O)c1ccccc1,C63271544_decoy,TRY1,Decoy,0,-8.27814,-6.72,-2.5,-5.524603962841004
CCCCN1C(=S)NC(=O)[C@H]([C@H]2NCCC3=c4cc(OC)ccc4=[NH+][C@@H]32)[C@H]1O,C63375938_decoy,TRY1,Decoy,0,-8.04193,-5.0,-2.21,-4.654255498746045
C[C@@H]1CC(=O)N2[C@H](NC(NCCC3=c4ccccc4=[NH+]C3)=N[C@H]2c2ccccc2)N1,C63633456_decoy,TRY1,Decoy,0,-8.38187,-6.2,-2.27,-6.29160592255702
C[C@@H]1CC(=O)N2[C@H](NC(NCCC3=c4ccccc4=[NH+]C3)=N[C@@H]2c2ccccc2)N1,C63633461_decoy,TRY1,Decoy,0,-8.50537,-6.26,-1.54,-5.159638298982246
O=C(C[C@H]1CS[C@H](NC(=O)c2ccco2)N1)NCCC1=c2ccccc2=[NH+]C1,C63686727_decoy,TRY1,Decoy,0,-7.35631,-8.18,-1.53,-6.962297514624003
O=C(C[C@H]1CS[C@@H](NC(=O)c2ccco2)N1)NCCC1=c2ccccc2=[NH+]C1,C63686729_decoy,TRY1,Decoy,0,-7.92698,-8.5,-1.25,-7.533327980489261
CC(C)(C(=O)NNC(=O)NCCCn1cc[nH+]c1)c1ccc(Cl)c(Cl)c1,C50612130_decoy,TRY1,Decoy,0,-8.33295,-7.39,-2.46,-6.262402640022942
CCCNC(=O)c1ccc(NC(=O)NCc2cn3cc(C)ccc3[nH+]2)cc1Cl,C54476657_decoy,TRY1,Decoy,0,-8.47026,-5.78,-2.17,-5.061554148776956
CC[C@@H](C)[NH+](C)CCNC(=O)CCNC(=O)Nc1ccc(Br)cc1,C66149773_decoy,TRY1,Decoy,0,-8.7978,-6.55,-2.25,-6.560567882124578
CC[C@H](C)[NH+](C)CCNC(=O)CCNC(=O)Nc1ccc(Br)cc1,C66149774_decoy,TRY1,Decoy,0,-8.86903,-6.0,-1.51,-6.183012086628886
CC[C@H](C)[NH+](C)CCNC(=O)NCCC(=O)Nc1ccc(Br)cc1,C66187334_decoy,TRY1,Decoy,0,-9.08324,-6.24,-2.94,-6.191572365708883
Cc1ccccc1C[NH+]1CCC(NC(=O)NNC(=O)Cc2ccccc2F)CC1,C66924859_decoy,TRY1,Decoy,0,-7.7754,-6.85,-2.4,-5.533396141084045
Oc1ccccc1C[NH2+]C[C@H](O)COc1ccc(I)cc1,C66992937_decoy,TRY1,Decoy,0,-7.39072,-6.52,-1.42,-5.152093522747199
Oc1cccc(C[NH2+]C[C@H](O)COc2ccc(I)cc2)c1,C66992962_decoy,TRY1,Decoy,0,-7.80382,-6.86,-1.46,-8.012033063625797
COc1cc(CN[C@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)cc(Cl)c1OCC(N)=O,C67251449_decoy,TRY1,Decoy,0,-9.36902,-5.57,-4.82,-5.725426206868095
CC(C)(CO)[NH2+]C[C@H](O)COC(c1ccc(Cl)cc1)c1ccc(Cl)cc1,C67486171_decoy,TRY1,Decoy,0,-8.63669,-6.72,-2.11,-12.14050968921882
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2cc3c(cc2Cl)OCCCO3)CC1,C67538587_decoy,TRY1,Decoy,0,-9.10045,-6.87,-2.33,-5.840861317340811
Cc1cc(Br)cc(C)c1NC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67544516_decoy,TRY1,Decoy,0,-9.30381,-5.67,-1.41,-6.625908723105125
Cc1n[nH]c2cnc(-c3cncc(OC[C@@H]([NH3+])Cc4cccc(C(F)(F)F)c4)c3)cc12,C06718675_decoy,TRY1,Decoy,0,-8.5723,-7.4,-2.63,-6.3212214822316
Cc1snc(SCC(=O)NNC(=[NH2+])COc2ccc(Cl)cc2Cl)c1C#N,C03128078_decoy,TRY1,Decoy,0,-9.05446,-7.84,-2.52,-7.210913862343468
C[NH+](CC(=O)Nc1ccccc1C(F)(F)F)CC(=O)C(C#N)=C1Nc2ccccc2N1,C08942654_decoy,TRY1,Decoy,0,-6.39591,-8.26,-1.19,-6.374716731550431
O=C1NC(=O)[C@@](Cc2ccccc2)(C2CC[NH+](Cc3c[nH]nc3-c3ccccc3)CC2)N1,C15006983_decoy,TRY1,Decoy,0,-6.97361,-7.81,-1.99,-5.247874880901658
O=C1NC(=O)[C@](Cc2ccccc2)(C2CC[NH+](Cc3c[nH]nc3-c3ccccc3)CC2)N1,C15006985_decoy,TRY1,Decoy,0,-6.12671,-7.81,-3.38,-5.601721252504652
CCOc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NCCc2c[nH]c3ccccc23)cc1,C15072261_decoy,TRY1,Decoy,0,-8.70742,-7.9,-1.43,-6.921443662616728
CCCCc1[nH]cc(CN2CCC([C@@]3(Cc4ccccc4F)NC(=O)NC3=O)CC2)[nH+]1,C20206653_decoy,TRY1,Decoy,0,-8.93332,-7.23,-1.25,-6.075446376640211
CCCCc1[nH]cc(CN2CCC([C@]3(Cc4ccccc4F)NC(=O)NC3=O)CC2)[nH+]1,C20206657_decoy,TRY1,Decoy,0,-9.04299,-5.51,-2.79,-5.760333916146252
CC1(C)Cc2c(c(N3CCCC3)nc3sc4c(NCCCC[NH3+])ncnc4c23)CO1,C20392065_decoy,TRY1,Decoy,0,-9.68792,-6.88,-0.83,-8.244521513468136
CCCCNC(=O)NC(=O)[C@H](C)[NH+](C)CC(=O)Nc1ccc(Br)cc1C,C24375762_decoy,TRY1,Decoy,0,-8.00107,-7.25,-2.29,-7.50059706730763
CCCCNC(=O)NC(=O)[C@@H](C)[NH+](C)CC(=O)Nc1ccc(Br)cc1C,C24375761_decoy,TRY1,Decoy,0,-8.30403,-5.85,-1.95,-6.292879899545155
C[NH+](C)[C@@H](CNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1)c1ccccc1Cl,C29051672_decoy,TRY1,Decoy,0,-8.70689,-7.34,-1.08,-6.229494260450713
C[NH+](C)[C@H](CNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1)c1ccccc1Cl,C29051677_decoy,TRY1,Decoy,0,-8.03597,-7.8,-2.94,-6.1842590777839535
C[NH+](C)[C@@H](CNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1)c1ccccc1Cl,C29051682_decoy,TRY1,Decoy,0,-7.90734,-7.74,-2.21,-6.285053990073533
C[NH+](C)[C@H](CNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1)c1ccccc1Cl,C29051689_decoy,TRY1,Decoy,0,-7.92152,-7.22,-2.4,-5.9965118963414525
CC[NH+](CC)CCNS(=O)(=O)c1c(Br)cc(N)cc1Br,C37055407_decoy,TRY1,Decoy,0,-7.66,-4.71,-1.46,-4.985182871939447
C[C@@H](C(=O)NCC(=O)Nc1ccc(F)c(F)c1F)[NH+]1CCN(c2ccc(O)cc2)CC1,C09126378_decoy,TRY1,Decoy,0,-7.27019,-8.94,-0.87,-5.861184562328729
CC[NH+]1[C@@H](SCC(=O)Nc2nnc(-c3ccccc3)s2)NN[C@H]1c1ccccc1,C39024370_decoy,TRY1,Decoy,0,-7.57274,-6.31,-1.37,-5.304822301598445
CC[NH+]1[C@@H](SCC(=O)Nc2nnc(-c3ccccc3)s2)NN[C@@H]1c1ccccc1,C39024371_decoy,TRY1,Decoy,0,-8.49366,-7.93,-2.68,-6.371535320172305
COc1ccc([C@H]2NN(c3ccccc3)C[C@H]2C[NH2+]CCSc2cnn[nH]2)c(F)c1,C39479188_decoy,TRY1,Decoy,0,-8.44966,-7.19,-2.64,-6.875882363405545
COc1ccc([C@H]2NN(c3ccccc3)C[C@@H]2C[NH2+]CCSc2cnn[nH]2)c(F)c1,C39479190_decoy,TRY1,Decoy,0,-8.6715,-5.88,-1.39,-5.888298115507016
COc1ccc([C@@H]2NN(c3ccccc3)C[C@@H]2C[NH2+]CCSc2cnn[nH]2)c(F)c1,C39479191_decoy,TRY1,Decoy,0,-9.37648,-5.84,-1.56,-5.946983830942811
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1F,C39631598_decoy,TRY1,Decoy,0,-8.34268,-7.64,-4.71,-6.105369417769682
Cc1ccsc1C(=O)N1C[C@H](C(=O)NCCNc2ccccc2)C2(CC[NH2+]CC2)C1,C39655698_decoy,TRY1,Decoy,0,-7.85142,-6.63,-1.6,-5.890896901011522
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685773_decoy,TRY1,Decoy,0,-10.7127,-6.82,-3.37,-7.141101293096974
Cc1c(C(N)=O)sc(NC(=O)CN2CC[NH+](Cc3cccc(Br)c3)CC2)c1C#N,C39965209_decoy,TRY1,Decoy,0,-8.54985,-5.49,-1.74,-5.411980331563709
Cc1ccc(C[NH+]2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CC[C@@H](C)C4)CC2)o1,C39965279_decoy,TRY1,Decoy,0,-8.27591,-7.57,-2.62,-5.750780970996595
Cc1occc1C(=O)Nc1cc(NC(=O)NC[C@@H](c2cccs2)[NH+](C)C)ccc1F,C40105589_decoy,TRY1,Decoy,0,-9.16418,-7.09,-2.99,-6.000710139080803
Cc1occc1C(=O)Nc1cc(NC(=O)NC[C@H](c2cccs2)[NH+](C)C)ccc1F,C40105590_decoy,TRY1,Decoy,0,-8.78391,-7.51,-3.56,-6.3785092428795656
O[C@@H](C[NH2+]C[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)COC[C@@H]1CCCO1,C40459098_decoy,TRY1,Decoy,0,-8.77454,-5.79,-3.63,-5.348209954108577
O[C@@H](C[NH2+]C[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)COC[C@@H]1CCCO1,C40459101_decoy,TRY1,Decoy,0,-8.05486,-7.74,-1.6,-11.120795173708826
O[C@H](C[NH2+]C[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)COC[C@@H]1CCCO1,C40459103_decoy,TRY1,Decoy,0,-8.18438,-7.56,-2.78,-8.774779025987378
O[C@H](C[NH2+]C[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)COC[C@@H]1CCCO1,C40459105_decoy,TRY1,Decoy,0,-7.69536,-7.77,-1.94,-8.028732355344532
C[NH+](C)CCCCNS(=O)(=O)c1c(N)cc(Br)cc1Br,C45665370_decoy,TRY1,Decoy,0,-8.30267,-5.62,-5.09,-5.381293952578998
C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1c(Br)cc(N)cc1Br,C49554807_decoy,TRY1,Decoy,0,-7.21157,-5.51,-1.72,-4.992543812478528
CC(C)[NH+](C)CCNS(=O)(=O)c1c(Br)cc(N)cc1Br,C54111676_decoy,TRY1,Decoy,0,-7.53755,-5.76,-4.83,-5.135215722566523
CC(C)[NH+](C)CCNS(=O)(=O)c1c(N)cc(Br)cc1Br,C54111677_decoy,TRY1,Decoy,0,-8.51289,-6.0,-4.01,-5.7295770338020615
COc1cc2c(cc1NC(=O)CNc1ccccc1[NH+]1CCC(O)CC1)oc1ccccc12,C59806969_decoy,TRY1,Decoy,0,-8.77348,-6.13,-2.28,-7.183931836516616
Cc1ccc(C[NH2+]CC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCCCN3)c2)cc1,C14359640_decoy,TRY1,Decoy,0,-7.64937,-7.04,-3.73,-5.458703991620472
O=C(CNC(=O)c1ccc2c(c1)[C@@H](c1ccccc1)ON2)NCCC1=c2ccccc2=[NH+]C1,C63279481_decoy,TRY1,Decoy,0,-7.1035,-6.5,-1.78,-4.831187220810624
O=C(CNC(=O)c1ccc2c(c1)[C@H](c1ccccc1)ON2)NCCC1=c2ccccc2=[NH+]C1,C63279482_decoy,TRY1,Decoy,0,-7.88582,-7.55,-3.54,-6.002744867805889
O=C(/C=C1/CS[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)N1)NCC[C@H]1C=c2ccccc2=[NH+]1,C63282160_decoy,TRY1,Decoy,0,-8.11966,-7.27,-3.29,-8.105989891472161
CC(C)C[C@@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557206_decoy,TRY1,Decoy,0,-8.44999,-7.01,-2.45,-6.575287674903412
CC(C)C[C@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557207_decoy,TRY1,Decoy,0,-8.47439,-6.86,-2.29,-6.851476632047553
CC(C)C[C@@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557208_decoy,TRY1,Decoy,0,-7.92968,-5.38,-1.45,-5.279376620335645
CC(C)C[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557209_decoy,TRY1,Decoy,0,-8.7787,-7.02,-1.75,-6.55485831944754
O=C(NCCC1=c2ccccc2=[NH+]C1)C1CCC(CN2NNc3ccccc3C2=O)CC1,C63782308_decoy,TRY1,Decoy,0,-9.07982,-6.45,-2.05,-5.749626793433587
Cc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)N[C@@H]3NN[C@H](C(C)(C)C)S3)CC1=O)C[NH+]=2,C63941161_decoy,TRY1,Decoy,0,-9.04346,-6.21,-2.43,-6.7869165010736685
CCc1[nH]c(CN2CCC(C(=O)Nc3cccc([C@@H]4NN=C(C)S4)c3)CC2)c(C)[nH+]1,C64066829_decoy,TRY1,Decoy,0,-8.03115,-8.34,-3.52,-7.177493358241155
CC(=O)N[C@H]1Nc2ccc(CC(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)cc2S1,C64491147_decoy,TRY1,Decoy,0,-9.31487,-7.42,-1.5,-6.204250285774044
O[C@H](C[NH+]1CCCCC1)c1ccc(CCc2ccc([C@@H](O)C[NH+]3CCCCC3)cc2)cc1,C04808233_decoy,TRY1,Decoy,0,-8.53301,-7.82,-2.04,-7.238143378039417
O[C@@H](C[NH+]1CCCCC1)c1ccc(CCc2ccc([C@@H](O)C[NH+]3CCCCC3)cc2)cc1,C04808237_decoy,TRY1,Decoy,0,-9.14699,-6.33,-3.39,-7.77216022358481
O[C@H](COc1ccccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1)C[NH+]1CCSCC1,C12459492_decoy,TRY1,Decoy,0,-7.48833,-7.07,-4.09,-5.577877994711341
COc1ccc(C[NH2+]Cc2ccc(F)c(F)c2)cc1OC[C@@H](O)CN1CC[NH+](C)CC1,C19743089_decoy,TRY1,Decoy,0,-8.55037,-6.15,-2.75,-6.448497994328447
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH+](Cc1cccc(Cl)c1)Cc1cccc(Cl)c1,C20464704_decoy,TRY1,Decoy,0,-9.60445,-5.37,-3.47,-7.169742272823067
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CN1CCN(c2cccc[nH+]2)CC1)Nc1ccsc1,C20503902_decoy,TRY1,Decoy,0,-10.3191,-6.59,-2.52,-5.944254269266152
COc1ccccc1CN(C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1)C1CC[NH+](C)CC1,C21264188_decoy,TRY1,Decoy,0,-9.37289,-6.06,-5.11,-6.073801048001776
CCn1nc(C)c(C[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCc3ccccc3C2)c1C,C23214365_decoy,TRY1,Decoy,0,-8.42691,-7.13,-3.19,-6.839595647794427
CCOc1ccccc1NC(=O)Nc1ccc(N2CC[NH+](Cc3ccsc3)CC2)[nH+]c1,C35852331_decoy,TRY1,Decoy,0,-9.8336,-6.05,-2.26,-6.252744842598378
O=C(NCCCn1cc[nH+]c1)C1=CNN2C1=[NH+][C@H](c1ccc(F)cc1)C[C@@H]2C(F)(F)F,C12846132_decoy,TRY1,Decoy,0,-7.51415,-7.21,-1.9,-6.408214134278972
O=C(CCCCCC(=O)N/N=C/C1=c2ccccc2=[NH+]C1)N/N=C/C1=c2ccccc2=[NH+]C1,C39029726_decoy,TRY1,Decoy,0,-8.45399,-7.42,-2.02,-8.483858739781622
O=C(NCC[NH+]1CCCCC1)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39627898_decoy,TRY1,Decoy,0,-8.88101,-7.59,-1.52,-7.225524045564519
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCC[NH+]2CCCCC2)C2(CC[NH2+]CC2)C1,C39627951_decoy,TRY1,Decoy,0,-8.94966,-7.76,-2.76,-9.267950827565311
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39631010_decoy,TRY1,Decoy,0,-10.1371,-7.23,-1.56,-7.219928698803516
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39663919_decoy,TRY1,Decoy,0,-8.63202,-5.18,-1.45,-5.855868896710193
Cc1ccc(CC(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)cc1,C39674857_decoy,TRY1,Decoy,0,-10.1121,-8.37,-1.64,-7.531520569046004
Cc1ccc(CC(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@H]3C)C3(CC[NH2+]CC3)C2)cc1,C39674859_decoy,TRY1,Decoy,0,-8.92293,-8.65,-2.17,-7.164412633989192
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39675730_decoy,TRY1,Decoy,0,-9.05095,-6.48,-2.85,-6.42549471785301
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NC[C@H](c2ccccc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39675732_decoy,TRY1,Decoy,0,-8.33456,-5.61,-1.39,-5.955917719101017
CCCC[NH+]1CCC(CNC(=O)[C@@H]2CN(C(=O)c3ccc(C)c(F)c3F)CC23CC[NH2+]CC3)CC1,C39683509_decoy,TRY1,Decoy,0,-10.4008,-6.73,-1.34,-6.741282879273722
CC[C@H](C)CC(=O)N1C[C@H](C(=O)NC2CCN(c3cccc[nH+]3)CC2)C2(CC[NH2+]CC2)C1,C39687503_decoy,TRY1,Decoy,0,-8.91071,-7.43,-1.53,-6.274484456420521
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NC2CCN(c3cccc[nH+]3)CC2)C2(CC[NH2+]CC2)C1,C39687505_decoy,TRY1,Decoy,0,-9.27718,-6.34,-3.31,-6.443823388001166
O=C(NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ncccn2)CC1)Nc1ccsc1,C43527490_decoy,TRY1,Decoy,0,-9.22466,-7.87,-0.94,-6.78712866630352
NC(=O)[C@H](C1CCN(C(=O)/C=C/c2cc(F)c(F)c(F)c2)CC1)[NH+]1CCC(C2=c3cccnc3=[NH+]C2)CC1,C52550564_decoy,TRY1,Decoy,0,-10.0046,-6.95,-1.58,-6.331151331546189
O[C@@H](COc1cccc(C[NH2+]CCc2ccc(F)cc2)c1)C[NH+]1CCc2ccccc2C1,C14967275_decoy,TRY1,Decoy,0,-7.96442,-8.02,-3.0,-6.408050098922522
CC[NH+]1CCC(NC(=O)CS[C@@H]2NN=C(C3=c4ccccc4=[NH+]C3)N2C[C@H]2CCCO2)CC1,C39778870_decoy,TRY1,Decoy,0,-8.88992,-6.56,-0.84,-7.646448381821454
CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)Nc1nc(C[NH+]2CCCCCC2)cs1,C63122568_decoy,TRY1,Decoy,0,-9.19976,-6.16,-2.07,-5.608046658668487
O[C@@H](C[NH2+]C[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl)COCc1ccc2c(c1)OCO2,C63234697_decoy,TRY1,Decoy,0,-8.29843,-8.55,-2.35,-7.338502141332818
CCOC(=O)[C@@H]1S[C@@H](NC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)N[C@@H]1c1ccccc1,C63303353_decoy,TRY1,Decoy,0,-7.96191,-7.62,-1.13,-7.039518636972505
COc1cc(C[NH2+]CCC2=c3ccccc3=[NH+]C2)ccc1O[C@@H]1N=NNN1c1ccccc1,C63316130_decoy,TRY1,Decoy,0,-7.18347,-7.08,-1.38,-5.510880967797883
COc1ccc2c(c1)=[NH+][C@@H](SCC(=O)NC1=CC=CN3C[C@@H](c4ccccc4)N[C@H]13)[NH+]=2,C63514612_decoy,TRY1,Decoy,0,-9.88755,-6.0,-3.38,-5.855016710924218
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)NC1=CC=CN3C[C@@H](c4ccccc4)N[C@H]13)[NH+]=2,C63514613_decoy,TRY1,Decoy,0,-9.55218,-7.44,-1.36,-6.5444467981854535
CCOC(=O)C1=C(CS[C@H]2[NH+]=c3cccnc3=[NH+]2)NC(=O)N[C@@H]1c1cc(C)ccc1C,C63515323_decoy,TRY1,Decoy,0,-7.42507,-7.3,-2.9,-6.982863937135437
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1C=C3[NH+]=C(c4ccccc4)C=C(C(F)(F)F)N3N1)C[NH+]=2,C63547157_decoy,TRY1,Decoy,0,-8.93701,-9.12,-1.37,-7.785972814819814
C[C@H](NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1)[C@@H](c1cccs1)N1CC[NH+](C)CC1,C63663793_decoy,TRY1,Decoy,0,-8.71948,-7.5,-3.45,-6.492294431279741
CCc1ccc(NC(=O)Nc2nnc(SC[C@@H]3[NH+]=c4ccccc4=[NH+]C3=O)s2)cc1,C63752100_decoy,TRY1,Decoy,0,-9.78906,-5.66,-3.11,-5.7171420137339055
C[NH+](C)[C@@H](CNC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1ccc(F)cc1)c1cccs1,C63807613_decoy,TRY1,Decoy,0,-8.80684,-7.14,-3.13,-6.3161039392265685
CCOc1ccccc1C[NH+]1CCNC(=O)[C@H]1CC(=O)NC[C@@H]1C=c2cc(F)ccc2=[NH+]1,C64023760_decoy,TRY1,Decoy,0,-7.65341,-8.63,-1.28,-7.0308566576283456
C[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2)c1ccccc1,C64044550_decoy,TRY1,Decoy,0,-8.06279,-8.48,-1.37,-6.552367273490439
C[C@@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2)c1ccccc1,C64044551_decoy,TRY1,Decoy,0,-7.83303,-8.41,-1.36,-8.97945630634122
COc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NCCC2=c3ccccc3=[NH+]C2)cc1C,C64061232_decoy,TRY1,Decoy,0,-7.32331,-8.24,-1.62,-6.380860243924023
COc1ccc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NCCC2=c3ccccc3=[NH+]C2)cc1C,C64061233_decoy,TRY1,Decoy,0,-8.66642,-8.29,-1.73,-7.5237312599755795
Cc1c[nH+]c(CN(C)C(=O)C[C@H]2C(=O)NCC[NH+]2Cc2ccc(-c3ccccc3)cc2)[nH]1,C32565347_decoy,TRY1,Decoy,0,-7.72305,-5.85,-1.09,-6.027552339540196
COc1ccc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NCCc2cn3ccccc3[nH+]2)cc1C,C39485900_decoy,TRY1,Decoy,0,-8.73572,-7.65,-3.3,-6.502604142199267
CCN1C(=O)[C@@H]([NH+]2CCC(C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)CC2)Nc2ccccc21,C64491434_decoy,TRY1,Decoy,0,-10.6874,-8.22,-2.57,-7.613403735746536
CCN1C(=O)[C@@H]([NH+]2CCC(C(=O)NCCC3=c4ccccc4=[NH+]C3)CC2)Nc2cccnc21,C64502349_decoy,TRY1,Decoy,0,-9.14428,-8.57,-1.22,-7.381996751484288
O=C(CN1CC[NH+](C[C@@H]2Nc3ccccc3S2)CC1)NCCC1=c2ccccc2=[NH+]C1,C64713659_decoy,TRY1,Decoy,0,-9.91619,-8.61,-1.14,-7.888424786215103
O=C(CN1CC[NH+](C[C@H]2Nc3ccccc3S2)CC1)NCCC1=c2ccccc2=[NH+]C1,C64713662_decoy,TRY1,Decoy,0,-8.5608,-8.53,-1.17,-7.4781474122464
CCC[NH+]1CCN(c2nn3c(NC4CCCC4)c(-c4ccc(O)c(OC)c4)[nH+]c3s2)CC1,C64746069_decoy,TRY1,Decoy,0,-10.3198,-5.61,-1.64,-6.226977763154677
O=C(NCC[NH+]1CCc2ccccc2C1)c1cccc(N2CC[NH2+][C@H](c3ccccc3)C2)n1,C65256362_decoy,TRY1,Decoy,0,-7.88038,-8.49,-3.34,-6.190317060747351
CC[NH+](CC)CCn1[nH]c2c3ccc(=O)cc3sc3c(NCC[NH3+])ccc1c32,C05499407_decoy,TRY1,Decoy,0,-9.50365,-6.86,-0.53,-10.454664071446546
CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]21,C05883419_decoy,TRY1,Decoy,0,-6.30907,-5.55,-2.03,-4.83296169822369
CC(=O)O[C@@]1(C)C[C@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C08952338_decoy,TRY1,Decoy,0,-6.43761,-4.95,-3.95,-3.871501665703467
Cc1cccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)n1,C09975196_decoy,TRY1,Decoy,0,-7.20827,-8.22,-1.21,-8.186182095054674
O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)ccc12,C01591116_decoy,TRY1,Decoy,0,-6.66387,-9.01,-0.88,-7.217424006311324
COC(=O)C1=CO[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1C=C[C@@]2(O)CO,C13660242_decoy,TRY1,Decoy,0,-7.28489,-6.33,-3.2,-5.3302406485628815
O=C1c2c(O)cccc2[C@](O)([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C14442632_decoy,TRY1,Decoy,0,-8.80221,-5.7,-2.53,-5.237810394334858
O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)cc(O)c12,C15259616_decoy,TRY1,Decoy,0,-7.92075,-7.86,-1.94,-6.632551308494503
O=C1NC(=S)NC(=O)C1=CNc1ccccc1NC=C1C(=O)NC(=S)NC1=O,C03067016_decoy,TRY1,Decoy,0,-9.0401,-7.86,-0.8,-8.359238552786259
O=c1c2ncn([C@H]3C[C@@H](O)[C@H](O)[C@@H](CO)O3)c2ncn1[C@H]1C[C@@H](O)[C@H](O)[C@@H](CO)O1,C16939547_decoy,TRY1,Decoy,0,-5.84173,-7.34,-2.52,-4.414357991950115
Oc1ccc([C@H]2Oc3cc(O[C@H]4OC[C@H](O)[C@@H](O)[C@@H]4O)cc(O)c3C[C@@H]2O)cc1O,C17021318_decoy,TRY1,Decoy,0,-9.28219,-9.67,-2.12,-10.587588845295684
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O,C20611638_decoy,TRY1,Decoy,0,-7.42472,-6.14,-1.07,-4.371350885871782
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(CO)=CC[C@]12O,C31163175_decoy,TRY1,Decoy,0,-6.72037,-5.81,-3.57,-5.198785990155893
O=c1[nH]cnc2c1nc(N1CCN(C[C@H](O)CO)CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C33709097_decoy,TRY1,Decoy,0,-8.38111,-6.6,-2.97,-6.81659621211396
O=C1c2c(O)cccc2[C@@](O)([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2cc(CO)cc(O)c21,C35271224_decoy,TRY1,Decoy,0,-8.05003,-8.54,-1.42,-6.22099320877713
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C35423049_decoy,TRY1,Decoy,0,-6.655,-7.94,-3.02,-7.110090379240731
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c21,C35456726_decoy,TRY1,Decoy,0,-8.53455,-7.34,-2.93,-7.077897932993485
CC(=O)O[C@]1(C)C[C@H](O)[C@@]2(O)C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]21,C35780712_decoy,TRY1,Decoy,0,-6.41525,-5.32,-1.64,-4.634928141695481
Nc1c(Br)cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1Br,C36556657_decoy,TRY1,Decoy,0,-7.96391,-5.97,-1.61,-5.242282143185827
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)CC[C@]12O,C36378730_decoy,TRY1,Decoy,0,-6.22756,-6.32,-2.59,-4.964738575089672
C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/[C@@H](CO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C36378661_decoy,TRY1,Decoy,0,-6.87444,-6.59,-3.68,-5.088681583986519
CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21,C08952339_decoy,TRY1,Decoy,0,-7.04935,-4.55,-3.23,-4.505354490457556
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C04404499_decoy,TRY1,Decoy,0,-7.33376,-7.62,-2.51,-6.289390294528592
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@](C)(O)[C@@H](O)C[C@]12O,C04102138_decoy,TRY1,Decoy,0,-7.87762,-5.97,-2.83,-5.930496057740588
Oc1ccc([C@H]2Oc3cc(O[C@@H]4OC[C@@H](O)[C@@H](O)[C@@H]4O)cc(O)c3C[C@@H]2O)cc1O,C26745304_decoy,TRY1,Decoy,0,-9.65667,-9.44,-4.07,-9.369845546588513
C[C@H]1C[C@H](O)CC(C)(C)[C@]1(O)/C=C/[C@@H](CO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C35456939_decoy,TRY1,Decoy,0,-7.47512,-6.56,-2.13,-5.353161701836843
COC(=O)C1=CO[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@]2(O)CO,C35456930_decoy,TRY1,Decoy,0,-6.85035,-4.64,-2.39,-4.611396996506773
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2C(CO)=C[C@@H](O)[C@H]12,C35456913_decoy,TRY1,Decoy,0,-8.32668,-5.83,-1.84,-5.912416165500828
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@]1(O)[C@H](O)C[C@]2(C)O,C34235769_decoy,TRY1,Decoy,0,-8.14735,-7.28,-4.44,-5.800465318059216
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C35423044_decoy1,TRY1,Decoy,0,-6.27452,-6.06,,-4.530410588474709
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C35423047_decoy,TRY1,Decoy,0,-6.67037,-5.68,-1.42,-4.357141550593714
CSc1c(C#N)c(=[NH2+])nc2n1NC(=[NH2+])/C2=N/Nc1ccc(S(N)(=O)=O)cc1,C08444443_decoy,TRY1,Decoy,0,-8.79572,-7.06,-2.17,-5.127026741098328
Nc1nc2c(nc(SCC[NH3+])n2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C38580929_decoy,TRY1,Decoy,0,-6.5472,-7.49,-0.95,-7.796426188132455
Nc1[nH]c(=O)[nH]c(=O)c1[C@@H]1C(c2ccc(C(F)(F)F)cc2)=N[C@H]2NC(=O)NC(=O)[C@H]21,C39224154_decoy,TRY1,Decoy,0,-6.64113,-5.94,-1.8,-4.414406824270969
CC1(C)CC[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@]2(C)[C@@H]1CC[C@@](C)(O)[C@@H]2CO,C37538196_decoy,TRY1,Decoy,0,-6.29903,-6.83,-1.04,-5.287613284917104
Nc1nc2c(nc(SCC[NH3+])n2[C@@H]2O[C@@H]3CO[P@@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C42854005_decoy,TRY1,Decoy,0,-7.35317,-7.49,-1.45,-8.29644241836337
CNc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@H]1C2=O,C43328762_decoy,TRY1,Decoy,0,-6.64552,-6.56,-3.01,-4.5126922743049125
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C43465442_decoy,TRY1,Decoy,0,-8.04023,-7.96,-2.1,-6.706695802031836
C[C@H]1O[C@](O)(CO)[C@](C)(O)[C@@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@](C)(O)[C@]2(C)O)[C@]1(C)O,C43509399_decoy,TRY1,Decoy,0,-5.59647,-7.01,-3.93,-5.430649460898595
C[C@H]1O[C@](O)(CO)[C@@](C)(O)[C@@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@](C)(O)[C@]2(C)O)[C@]1(C)O,C43509405_decoy,TRY1,Decoy,0,-5.08463,-7.22,-4.72,-5.4483976566015535
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]1[C@H](O)C[C@]2(C)O,C43510151_decoy,TRY1,Decoy,0,-8.39714,-5.47,-2.29,-5.5719608667105645
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@](C)(O)[C@@H](O)C[C@@]12O,C43611834_decoy,TRY1,Decoy,0,-8.04972,-5.43,-1.2,-4.895231724139009
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C(CO)=CC[C@@]12O,C43781655_decoy,TRY1,Decoy,0,-7.51476,-5.38,-2.14,-5.319649374053713
CC(=O)O[C@]1(C)C[C@H](O)[C@]2(O)C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]21,C43867049_decoy,TRY1,Decoy,0,-6.7056,-5.65,-2.3,-5.045885511762368
Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2O)cc1,C44960164_decoy,TRY1,Decoy,0,-6.54844,-7.25,-2.2,-6.069906572949792
O=c1[nH]cnc2c1nc(N1CCN(C[C@@H](O)CO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C59369419_decoy,TRY1,Decoy,0,-9.53934,-7.47,-1.3,-10.619416694220092
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(O)cc2O)NC(=S)N1,C59385004_decoy,TRY1,Decoy,0,-9.82539,-8.41,-1.49,-12.99386226906871
NN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1cccc(Br)c1,C63225185_decoy,TRY1,Decoy,0,-8.18097,-6.97,-2.35,-6.026537551965743
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@H](SCc2c(F)cccc2Cl)O1,C63720228_decoy,TRY1,Decoy,0,-9.56766,-5.94,-1.61,-7.685180684267794
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C35423044_decoy2,TRY1,Decoy,0,-6.32486,-6.13,,-4.235773336561555
NC(=O)CC[C@@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]12,C04090827_decoy,TRY1,Decoy,0,-8.28502,-7.6,-0.77,-7.583942007768631
NC(=O)CC[C@@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@H]2C(=O)N(C[C@H]3CCCO3)C(=O)[C@@H]12,C04090828_decoy,TRY1,Decoy,0,-7.78875,-7.44,-2.64,-6.477288999220549
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)/C=C/c3ccccc3)c2C(N)=O)C1,C00902341_decoy,TRY1,Decoy,0,-9.59468,-5.2,-2.93,-6.066762610302116
NC(=O)CC[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccc4c(c3)OCCO4)C(=O)[C@H]12,C08789670_decoy,TRY1,Decoy,0,-9.0531,-7.1,-0.84,-6.001866924757061
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08790093_decoy,TRY1,Decoy,0,-8.88605,-7.42,-0.83,-6.522572035142204
NC(=O)C[C@@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]12,C08790563_decoy,TRY1,Decoy,0,-7.59243,-5.87,-3.19,-4.883817854760606
NC(=O)C[C@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@@H]21,C08790566_decoy,TRY1,Decoy,0,-8.20508,-6.77,-1.73,-6.1698609350755005
CCc1ccc2c(c1)[C@@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08790629_decoy,TRY1,Decoy,0,-9.84318,-6.38,-1.83,-7.139983198089402
O=C1[C@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@H]2C(=O)N1C[C@@H]1CCCO1,C08876671_decoy,TRY1,Decoy,0,-7.78883,-7.41,-1.16,-5.909917888502943
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1,C09155502_decoy,TRY1,Decoy,0,-7.94017,-7.72,-1.57,-6.061711246214875
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C12879872_decoy,TRY1,Decoy,0,-8.15969,-6.33,-1.38,-5.364107012183261
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C12879876_decoy,TRY1,Decoy,0,-9.21432,-7.21,-1.54,-6.350399366939948
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C08789672_decoy,TRY1,Decoy,0,-8.51945,-6.08,-2.66,-5.806206621740462
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C12879888_decoy,TRY1,Decoy,0,-8.58838,-6.04,-4.03,-5.459344160247876
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12883974_decoy,TRY1,Decoy,0,-8.40238,-7.24,-1.87,-6.352119902525734
O=C(NCC[NH+]1CCOCC1)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccc(Cl)cc3)[C@@H]21,C08636332_decoy,TRY1,Decoy,0,-9.02391,-7.41,-1.69,-7.519928082376399
CN(C)c1ccc(NC(=S)N[C@H]2C[C@H]3C(=O)NC[C@@H](CCC(=O)NCc4cccnc4)[NH+]3C2)cc1,C15707952_decoy,TRY1,Decoy,0,-7.93034,-7.27,-2.62,-6.492914692533177
CC(=O)/C(=C\c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1)C(=O)CC[NH+](C)C,C17142076_decoy,TRY1,Decoy,0,-6.23808,-6.98,-3.23,-4.895130986032895
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](NC(=O)Nc3ccc(F)cc3)[C@@H]2O)CC1,C20463924_decoy,TRY1,Decoy,0,-6.85298,-5.25,-1.83,-4.701352126859143
C/C(=N\Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1)c1ccncc1,C20835654_decoy,TRY1,Decoy,0,-9.61736,-8.18,-1.44,-10.933914419227053
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@H](C)O)[NH+](C)C1,C21985994_decoy,TRY1,Decoy,0,-7.16517,-5.22,-3.16,-5.163123594604222
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680382_decoy,TRY1,Decoy,0,-9.85178,-8.5,-1.54,-8.437822875984606
COc1cc(-c2c3c([nH+]c4sc(C(N)=O)c(N)c24)CCN(C)C3)cc(OC)c1OC,C26600034_decoy,TRY1,Decoy,0,-8.88997,-5.54,-0.28,-5.396447864093379
COCc1cc(C)nc2c1[C@@H]([NH3+])[C@@H](C(=O)NCCc1c(C)[nH]c3ccc(OC(F)(F)F)cc13)S2,C39211926_decoy,TRY1,Decoy,0,-8.27351,-7.42,-2.49,-5.609622341667825
C/C=C/C=C/C=C\C(=O)N[C@@H](C(=O)O[C@H](C1=C2C=CC(Cl)=C[C@@H]2N=C1)[C@H]1NC(=O)CNC1=O)[C@H](C)[NH3+],C39559757_decoy,TRY1,Decoy,0,-8.80749,-5.82,-4.9,-7.70548052505473
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39661768_decoy,TRY1,Decoy,0,-8.77715,-6.76,-2.99,-6.116561041473168
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39661769_decoy,TRY1,Decoy,0,-9.04325,-5.62,-1.78,-5.67339226040643
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39661851_decoy,TRY1,Decoy,0,-10.7294,-5.76,-2.06,-6.479752820037994
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)[C@H](C)ON1,C39676519_decoy,TRY1,Decoy,0,-10.3251,-7.67,-1.61,-7.282934326037115
COc1ccc(C2=NN(C3=NNC([NH3+])=Cc4nncn43)[C@](O)(C(F)(F)F)C2)cc1,C15226910_decoy,TRY1,Decoy,0,-9.3938,-5.7,-0.98,-5.672180961647412
COc1ccc(C2=NN(C3=NNC([NH3+])=Cc4nncn43)[C@@](O)(C(F)(F)F)C2)cc1,C15226908_decoy,TRY1,Decoy,0,-9.71368,-7.73,-1.39,-7.626139761556829
CC1(C)CC(Nc2ncnc(NNC(=O)Cc3ccccc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645238_decoy,TRY1,Decoy,0,-7.05641,-7.62,-3.09,-6.405117568986409
Cc1ccc(S(=O)(=O)NNc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40794779_decoy,TRY1,Decoy,0,-8.25405,-5.63,-2.24,-5.30207842381495
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OC3CC[NH2+]CC3)c21,C40956511_decoy,TRY1,Decoy,0,-8.98958,-5.17,-1.12,-5.097640180565566
Nc1ccc2cc3ccc(=[NH2+])cc-3n(CCCC(=O)NCCN3C(=O)C=CC3=O)c2c1,C43277621_decoy,TRY1,Decoy,0,-7.15313,-7.49,-1.78,-11.02450556703462
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@@]34/C=[NH+]/CCCO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43737419_decoy,TRY1,Decoy,0,-7.71844,-5.44,-4.44,-6.096468278465937
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@H]2O)[C@H](C)Cl)[NH+](C)C1,C44607958_decoy,TRY1,Decoy,0,-7.41305,-5.46,-2.04,-5.09315452924914
CO/N=C(\N)c1ccc2nc(-c3ccc(-c4ccc(C(=[NH2+])NOC)cc4)o3)cn2c1,C27194866_decoy,TRY1,Decoy,0,-10.1869,-7.71,-0.57,-7.707028114361717
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccc(OCCO)cc2Br)N1,C58489669_decoy,TRY1,Decoy,0,-8.67665,-6.96,-1.67,-7.380095712544047
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccc(OCCO)cc2Br)N1,C58489671_decoy,TRY1,Decoy,0,-9.42745,-5.02,-1.56,-4.608700837223918
NC1=[NH+]c2nc3cc4c(cc3n2[C@H](c2ccc(OCCO)cc2Br)N1)OCCCO4,C12507683_decoy,TRY1,Decoy,0,-9.49733,-5.49,-2.83,-5.083857112901495
O=C(C[C@@H]1NO[C@@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63818055_decoy,TRY1,Decoy,0,-9.84883,-6.84,-1.13,-6.247756449201117
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)C[NH+]1CCC(C(=O)NCC(F)(F)F)CC1,C64029261_decoy,TRY1,Decoy,0,-8.97017,-5.97,-1.42,-5.834542806628372
O=C(NCCCO)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64380698_decoy,TRY1,Decoy,0,-8.72585,-5.91,-1.48,-6.087693159930026
C[NH+]1CCN(c2ccc3nc(-c4c(N)c5c(F)cccc5[nH]c4=O)[nH]c3c2)CC1,C03816310_decoy,TRY1,Decoy,0,-8.26579,-7.58,-0.6,-7.320113990607886
[NH3+]CCc1c([C@@H](c2ccc(Cl)cc2)c2cc3ccccc3[nH]2)[nH]c2ccccc12,C05758595_decoy,TRY1,Decoy,0,-8.39943,-7.61,-1.62,-7.442349420111592
COc1cc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)cc(Br)c1O,C08565776_decoy,TRY1,Decoy,0,-8.79107,-5.77,-1.87,-4.461719231104571
O=c1c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)[nH]c(=S)n1-c1cccc2ccccc12,C02107583_decoy,TRY1,Decoy,0,-8.20035,-7.51,-2.7,-5.467174802953071
O=c1c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)[nH]c(=S)n1-c1cccc2ccccc12,C02107585_decoy,TRY1,Decoy,0,-7.60651,-7.83,-0.81,-4.700597373305754
Cc1cccc(-n2c(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c(=O)[nH]c2=S)c1,C05626116_decoy,TRY1,Decoy,0,-7.01497,-7.66,-1.16,-4.439686958263809
O=c1[nH]c(=S)n(-c2ccc(F)cc2)c(O)c1[C@H]1[NH2+]CCc2c1[nH]c1ccccc21,C05762742_decoy,TRY1,Decoy,0,-6.4942,-1.55,-2.69,-2.9030809426186552
Cc1ccccc1-n1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)[nH]c1=S,C05807375_decoy,TRY1,Decoy,0,-6.37784,-7.33,-1.74,-5.213194404631403
O=c1[nH]c(=S)n(-c2ccccc2)c(O)c1[C@@H]1[NH2+]CCc2c1[nH]c1ccccc21,C05807416_decoy,TRY1,Decoy,0,-6.97118,-7.8,-2.59,-8.115174973844814
O=c1[nH]c(=S)n(-c2ccccc2F)c(O)c1[C@H]1[NH2+]CCc2c1[nH]c1ccccc21,C05807422_decoy,TRY1,Decoy,0,-6.15878,-5.43,-3.41,-3.74318061453508
N#C[C@H]1C(=[NH2+])Nc2sc(C(=O)c3ccc(Br)cc3)c(N)c2C12CCCCC2,C02271860_decoy,TRY1,Decoy,0,-9.22333,-6.79,-3.23,-5.269656442870129
Cc1cc(C)cc(-n2c(O)nc(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)c1,C09330756_decoy,TRY1,Decoy,0,-8.31781,-6.38,-1.68,-4.505473141220767
O=c1c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)nc(O)n1-c1cccc(F)c1,C09088106_decoy,TRY1,Decoy,0,-7.27961,-8.57,-2.89,-5.8016751066234775
Oc1ccc2ccccc2c1CNCC[NH2+]Cc1c(O)ccc2ccccc12,C20436765_decoy,TRY1,Decoy,0,-7.19343,-7.78,-1.67,-6.405938334724917
[NH3+][C@H](c1ccc(I)cc1)c1ccc2[nH]c(=O)[nH]c2c1,C20480410_decoy,TRY1,Decoy,0,-6.4409,-5.21,-1.6,-3.3794968788862576
Nc1nc2c(c(-c3ccc(Cl)cc3Cl)c1C[NH3+])Cc1cc(Br)ccc1-2,C27212216_decoy,TRY1,Decoy,0,-8.04615,-6.76,-1.11,-4.337761610639517
Cc1[nH+][nH]c2c1[C@@H](c1ccc(Cl)cc1Cl)c1c([nH]c(=O)[nH]c1=O)N2,C31807288_decoy,TRY1,Decoy,0,-5.85274,-5.57,-1.09,-3.240432413530772
Cc1[nH+][nH]c2c1[C@H](c1ccc(Br)cc1)c1c([nH]c(=O)[nH]c1=O)N2,C31808957_decoy,TRY1,Decoy,0,-7.21219,-6.31,-1.3,-3.851000007902943
Cc1ccc([C@H]2c3c(ncn(N)c3=[NH2+])Oc3ccc4ccc(O)cc4c32)cc1,C07043225_decoy,TRY1,Decoy,0,-7.50478,-1.44,-2.96,-2.7519671661496496
Cc1ccc([C@@H]2c3c(ncn(N)c3=[NH2+])Oc3ccc4ccc(O)cc4c32)cc1,C07043241_decoy,TRY1,Decoy,0,-7.36582,-5.93,-2.55,-3.787811849039095
NC(=O)C1CCN(c2c(N)c[nH+]c3ccc(Br)cc23)CC1,C36812944_decoy,TRY1,Decoy,0,-6.76895,-6.15,-0.68,-3.926186032319764
[NH3+][C@@H](c1ccc2[nH]c(=O)[nH]c2c1)c1cc(Br)ccc1Cl,C37287739_decoy,TRY1,Decoy,0,-8.00849,-6.53,-0.7,-4.817457285069796
[NH3+][C@H](c1ccc2[nH]c(=O)[nH]c2c1)c1cc(Br)ccc1Cl,C37287740_decoy,TRY1,Decoy,0,-7.21912,-5.82,-1.17,-4.501280815168879
[NH3+][C@H](c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(Br)cc1Cl,C37365727_decoy,TRY1,Decoy,0,-7.29716,-6.81,-1.69,-7.568378040302448
CCO[C@@H]1C[NH+]([C@@H](CNO)c2ccc(-c3ccccc3O)cc2)CCN1,C39534161_decoy,TRY1,Decoy,0,-7.88948,-5.36,-1.71,-5.565546524158071
CCO[C@H]1C[NH+]([C@@H](CNO)c2ccc(-c3ccccc3O)cc2)CCN1,C39534162_decoy,TRY1,Decoy,0,-7.80428,-4.87,-0.8,-6.110468418882195
NC(=[NH2+])/N=C1/NC(=O)[C@H](Cc2cc(C(F)(F)F)ccc2Cl)S1,C39850868_decoy,TRY1,Decoy,0,-8.29013,-7.16,-1.28,-8.377786156764932
Cc1ccc2nc(Nc3ncnc(Nc4cc[nH+]cc4)c3N)sc2c1,C40687613_decoy,TRY1,Decoy,0,-7.15072,-6.07,-1.09,-5.171683402979861
Cc1cc(Cl)ccc1Nc1ncnc(NN2CC[NH+](C)CC2)c1N,C40703227_decoy,TRY1,Decoy,0,-8.76695,-6.17,-1.67,-5.090740686424098
Nc1c(Nc2ccc(Cl)cn2)nc[nH+]c1Nc1cccnc1Cl,C40779647_decoy,TRY1,Decoy,0,-8.55249,-7.12,-1.17,-6.833672294719176
CC1(C)CC(NC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)CC(C)(C)[NH2+]1,C42910637_decoy,TRY1,Decoy,0,-8.64671,-5.61,-3.56,-5.43481319777556
[NH3+][C@H](c1ccc(Br)c(F)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094262_decoy,TRY1,Decoy,0,-8.63938,-5.69,-0.96,-4.834163006232715
[NH3+][C@@H](c1cccc(I)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094331_decoy,TRY1,Decoy,0,-7.67949,-7.7,-0.76,-10.860940190333723
[NH3+][C@H](c1cccc(I)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094332_decoy,TRY1,Decoy,0,-9.33986,-4.99,-0.37,-5.333765783556824
[NH3+][C@@H](c1ccc(I)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094337_decoy,TRY1,Decoy,0,-8.04767,-7.76,-1.19,-9.492474502096613
COc1ccc([C@@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)cc1,C52094378_decoy,TRY1,Decoy,0,-6.02341,-6.73,-0.1,-6.840004706308986
COc1ccccc1[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094389_decoy,TRY1,Decoy,0,-7.2999,-5.6,-0.49,-4.441040738330691
[NH3+][C@@H](c1ccc(F)cc1F)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094415_decoy,TRY1,Decoy,0,-7.04996,-4.77,-1.36,-3.988628684117004
[NH3+][C@H](c1ccc(F)cc1Cl)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094418_decoy,TRY1,Decoy,0,-8.02544,-5.58,-0.37,-4.500093012869311
[NH3+][C@H](c1ccc(F)c(F)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094436_decoy,TRY1,Decoy,0,-8.74009,-7.11,-0.75,-5.539039251370577
CC(C)(C)c1[nH+]c(-c2cc(Br)c3c(c2)OCO3)c(N)n1N,C52839728_decoy,TRY1,Decoy,0,-7.88059,-5.12,-1.78,-3.763332408660724
CC(C)c1[nH+]c(-c2cc(Br)c3c(c2)OCCO3)c(N)n1N,C52840005_decoy,TRY1,Decoy,0,-7.76759,-5.81,-1.7,-4.656986768315946
Cc1ccc(F)c([C@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)c1,C52982875_decoy,TRY1,Decoy,0,-7.33642,-6.0,-1.18,-4.522956463896223
Cc1ccc(F)c([C@@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)c1,C52982877_decoy,TRY1,Decoy,0,-7.43765,-5.03,-0.19,-4.3557083709529065
Nc1c[nH+]c2ccc(Br)cc2c1NC1(CO)CCCCC1,C53114032_decoy,TRY1,Decoy,0,-7.68366,-4.86,-1.9,-4.292100815078603
[NH3+][C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)c1cccc(F)c1F,C54205712_decoy,TRY1,Decoy,0,-7.63452,-4.92,-1.5,-4.11941871588094
COc1ccc([C@H]2[NH+]=C(N)N=C(N)N2c2ccc(Cl)cc2)cc1OC,C06713544_decoy,TRY1,Decoy,0,-8.02713,-5.21,-1.56,-4.917818183143284
Oc1ccc(/C=N/c2cccc(/N=C/c3ccc(O)c(O)c3)[nH+]2)cc1O,C13208183_decoy,TRY1,Decoy,0,-9.39543,-7.16,-1.92,-5.819359909339908
[NH3+][C@H](c1ccccc1Cl)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094308_decoy,TRY1,Decoy,0,-7.05065,-5.03,-0.35,-3.870794978500461
Cc1cc([C@@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)ccc1F,C63056042_decoy,TRY1,Decoy,0,-7.76638,-5.66,-0.42,-4.349403094480586
C[C@@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@H]1C[C@H](O)[C@@H]2[NH3+],C05359847_decoy,TRY1,Decoy,0,-8.67389,-5.73,-2.03,-3.397727291299536
C[C@H]([NH2+][C@H](C)C12CC3CC(CC(C3)C1)C2)C(=O)NC(N)=O,C07091494_decoy,TRY1,Decoy,0,-7.01366,-6.85,-1.91,-5.310895188817009
Cc1cc(C)c([C@H]([NH3+])c2ccc3[nH]c(=O)[nH]c3c2)c(C)c1,C19842848_decoy,TRY1,Decoy,0,-5.83704,-6.45,-1.06,-4.23076012535773
CC[C@]1(C)Cc2c(sc3c2/C(=[NH+]/N)N[C@@H](SC)N3)CO1,C05907795_decoy,TRY1,Decoy,0,-8.73881,-5.09,-0.81,-4.863422353416253
[NH3+]CCSC1=C(c2ccccc2)Nc2ccccc2NC1=O,C20477549_decoy,TRY1,Decoy,0,-7.44864,-6.79,-2.08,-7.377240949665793
Cc1ccccc1[C@@H]([NH3+])c1ccc2c(c1)NC(=O)CC(=O)N2,C21305047_decoy,TRY1,Decoy,0,-8.30125,-7.46,-1.93,-5.0559328475007455
Cc1cccc([C@H]([NH3+])c2ccc3c(c2)NC(=O)CC(=O)N3)c1,C21305067_decoy,TRY1,Decoy,0,-6.58479,-6.42,-2.41,-4.007358968388807
N#Cc1c([C@@H]2CCC[NH2+]C2)cc(-c2ccccc2O)nc1N,C28347167_decoy,TRY1,Decoy,0,-6.28732,-5.52,-3.89,-4.324227751135561
N#Cc1c(N)nc(-c2ccccc2O)c(F)c1[C@H]1CCC[NH2+]C1,C28356869_decoy,TRY1,Decoy,0,-7.01093,-6.27,-1.79,-4.417786622891608
C[C@@H]([NH2+][C@H](C)c1ccc(Br)cc1)C(=O)NC(N)=O,C28878141_decoy,TRY1,Decoy,0,-7.60438,-6.58,-0.26,-7.392283809008274
[NH2+]=C1NC(=S)N[C@H](c2ccc(Br)cc2)N1,C34926987_decoy,TRY1,Decoy,0,-8.12964,-5.1,-0.35,-9.405325779079789
Nc1cc2c(cc1N[C@@H]1C[NH+]3CCC1CC3)CCC(=O)N2,C35341253_decoy,TRY1,Decoy,0,-6.85745,-5.79,-1.73,-4.3968731690099645
CC[NH+]1CCC[C@@H]1CNc1cc2c(cc1N)NC(=O)CC2,C35341265_decoy,TRY1,Decoy,0,-7.14676,-7.11,-0.81,-6.744910831498475
CC[NH+]1CCC[C@@H]1CNc1cc2c(cc1N)CCC(=O)N2,C35355855_decoy,TRY1,Decoy,0,-7.35296,-6.18,-1.14,-5.2093404422685445
Cc1[nH]c(=O)sc1S(=O)(=O)NCC1([NH3+])CCCCCC1,C36266761_decoy,TRY1,Decoy,0,-8.15588,-5.47,-1.01,-5.701704297620515
NS(=O)(=O)c1ccc(N[C@@H]2CC[NH2+]C3(CCC3)C2)cc1,C36268842_decoy,TRY1,Decoy,0,-7.33563,-6.88,-1.02,-4.651278082921735
Nc1c[nH+]c2ccc(Br)cc2c1NCCO,C36813020_decoy,TRY1,Decoy,0,-7.48601,-5.08,-0.58,-4.019625917577057
C[C@@H](O)CNc1c(N)c[nH+]c2ccc(Br)cc12,C36813138_decoy,TRY1,Decoy,0,-6.84038,-5.08,-2.37,-3.928509923217001
C[C@@H]([NH2+]Cc1ccc(O)cc1)c1ccc2[nH]c(=O)[nH]c2c1,C37163142_decoy,TRY1,Decoy,0,-7.05609,-7.65,-1.4,-6.707950429406397
CC[NH+]1CC[C@H](CNc2cc3c(cc2N)NC(=O)CC3)C1,C37643825_decoy,TRY1,Decoy,0,-7.76659,-4.58,-2.73,-4.158469248753029
CC1(C)CC(NS(=O)(=O)c2ccc(N)cn2)CC(C)(C)[NH2+]1,C40680499_decoy,TRY1,Decoy,0,-7.36489,-5.83,-2.83,-4.644479062977228
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1ccc(Cl)cc1,C40687599_decoy,TRY1,Decoy,0,-7.56333,-7.28,0.18,-6.71404825365348
CN(C)c1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40723473_decoy,TRY1,Decoy,0,-6.80587,-5.44,-1.98,-4.337427609243029
CC1(C)CC(Nc2ncnc(N3CCCC3)c2N)CC(C)(C)[NH2+]1,C40724337_decoy,TRY1,Decoy,0,-7.96002,-5.58,-1.65,-4.719963678588863
CN(C)Nc1[nH+]cnc(NC23CC4CC(CC(C4)C2)C3)c1N,C40755644_decoy,TRY1,Decoy,0,-7.87146,-6.48,-2.98,-7.941332280086729
CCOc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40760844_decoy,TRY1,Decoy,0,-7.44106,-4.57,-2.59,-4.313035593635727
C[NH2+][C@@H](C)c1cc(F)ccc1Sc1nc(N)cc(=O)[nH]1,C41027246_decoy,TRY1,Decoy,0,-6.94363,-6.74,-0.71,-8.594218297051523
C[C@@H]1CCc2c(sc3nc(CSC(N)=[NH2+])[nH]c(=O)c23)C1,C22364405_decoy,TRY1,Decoy,0,-8.67717,-7.54,-1.25,-11.432806717630347
Cc1cc(S(N)(=O)=O)cc(N[C@H]2CCC[NH2+]C2)c1C,C43326101_decoy,TRY1,Decoy,0,-8.16281,-5.97,-2.02,-5.309637504130406
CC[C@@H]([NH3+])Cc1cc(I)cnc1N,C44403068_decoy,TRY1,Decoy,0,-8.71721,-5.7,-3.52,-8.776465117199377
[NH3+]C1CC(NC(=O)c2ccc(Br)cc2O)C1,C44489889_decoy,TRY1,Decoy,0,-8.22394,-6.61,-0.45,-7.115602812500851
CC1(C)CCc2c([nH+]c(C(=O)NN)c3[nH]c4ccccc4c23)C1,C44606362_decoy,TRY1,Decoy,0,-7.43295,-7.85,-0.97,-7.914406634419221
C[C@@H](C[NH+]1CCCC1)Nc1cc2nc[nH]c(=O)c2cc1N,C49152414_decoy,TRY1,Decoy,0,-6.79809,-7.24,-2.64,-6.812879420371512
Nc1cc2c(cc1N[C@H]1CC[NH+]3CCCC[C@H]13)NC(=O)C2,C49564238_decoy,TRY1,Decoy,0,-7.55909,-5.66,-0.51,-4.202837075854905
CC(C)SCC1=N[NH+]=C(N)/C1=C1\NC(=O)c2ccccc2N1,C19721692_decoy,TRY1,Decoy,0,-9.06945,-6.5,-1.25,-5.467801722887539
C[C@H](Nc1ccc(S(N)(=O)=O)cc1)[C@H]1CCC[NH2+]C1,C50163835_decoy,TRY1,Decoy,0,-6.92203,-6.25,-1.3,-4.430633071629572
[NH3+][C@@H](c1ccoc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094231_decoy,TRY1,Decoy,0,-7.04667,-6.01,-1.61,-4.133055872895955
[NH3+][C@@H](c1ccc2[nH]c(=O)[nH]c2c1)c1c(Cl)cccc1Cl,C21799253_decoy,TRY1,Decoy,0,-7.11334,-6.62,-1.04,-4.990633085698888
CC(C)(C)c1[nH+]c(-c2cc(Cl)cc(Cl)c2)c(N)n1N,C52839737_decoy,TRY1,Decoy,0,-7.42592,-6.17,-1.5,-4.765299247664729
N#Cc1cccc(-c2[nH+]c(C3CCCCC3)n(N)c2N)c1,C52839810_decoy,TRY1,Decoy,0,-7.39406,-5.89,-2.32,-4.0033288644067895
Nc1c(-c2ccc(Cl)cc2)[nH+]c(C2CCCCC2)n1N,C52839817_decoy,TRY1,Decoy,0,-7.32534,-6.34,-3.48,-4.275426956336153
NC1=CC2=[NH+][C@@H](c3ccc(Br)cc3)NN2C(=S)N1,C40176446_decoy,TRY1,Decoy,0,-7.96985,-6.18,0.07,-7.325903115125482
Cc1cc(C)nc(/N=C(/N)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1,C33471772_decoy,TRY1,Decoy,0,-6.37126,-5.04,-1.13,-3.9083871196585616
NC1=[NH+]C(=S)N[C@H](c2cccc(Br)c2)N1,C34926985_decoy,TRY1,Decoy,0,-10.0124,-5.29,0.0,-8.677756174456084
CC1(C)CC(NC(=O)NC2CCC(O)CC2)CC(C)(C)[NH2+]1,C42908256_decoy,TRY1,Decoy,0,-7.14744,-5.23,-1.43,-4.605369256640208
Cc1ccc(C)c(/N=C2/NC3(CCCCC3)NC(N)=[NH+]2)c1,C00203729_decoy,TRY1,Decoy,0,-7.16094,-5.31,-1.27,-3.552067084125804
COc1ccc(NC2=[NH+]C3(CCCCC3)NC(N)=N2)cc1,C00203744_decoy,TRY1,Decoy,0,-6.50885,-6.85,-0.88,-4.239809568591114
C[C@H](C(=O)Nc1c(N)cc(Cl)cc1Cl)[NH+]1CC[C@H](O)C1,C61709618_decoy,TRY1,Decoy,0,-8.11186,-5.35,-1.55,-4.606035557881274
O=C1Nc2ccccc2[C@@]12CC[NH2+][C@@H]2c1ccc(O)c(O)c1,C62001420_decoy,TRY1,Decoy,0,-6.8867,-4.9,-2.68,-3.512078700032905
O=C1Nc2ccccc2[C@]12CC[NH2+][C@H]2c1ccc(O)c(O)c1,C62001423_decoy,TRY1,Decoy,0,-5.74152,-5.09,-1.96,-3.89646526624717
CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(OC)cc4)c32)cc([N+](=O)[O-])c1[O-],C08854900_decoy,TRY1,Decoy,0,-6.36889,-6.23,-2.23,-5.108918086337962
Cc1oc2cc3oc(=O)c(CCC(=O)N[C@@H](Cc4ccc(O)c(O)c4)C(=O)[O-])c(C)c3cc2c1C,C02111079_decoy,TRY1,Decoy,0,-8.03308,-8.7,-2.5,-5.95887879050495
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(C(=O)[O-])[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915621_decoy,TRY1,Decoy,0,-6.96581,-5.92,-1.51,-4.8715208415000335
C[C@@]1(Oc2c[nH]c3ccc(Br)cc23)O[C@](C)(C(=O)[O-])[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970432_decoy,TRY1,Decoy,0,-6.75468,-6.99,-1.16,-5.080661993667301
CC(C)[C@H](NC(=O)CNC(=O)CO/N=C1\C=C2CC[C@@H]3[C@@H](CC[C@]4(C)[C@H](O)CC[C@@H]34)[C@@]2(C)CC1)C(=O)[O-],C12659519_decoy,TRY1,Decoy,0,-7.51339,-7.41,-3.46,-6.384638517446746
N#Cc1c(N)sc2c1CCN(c1ccc(S(=O)(=O)Nc3ccc(C(=O)[O-])cc3)cc1[N+](=O)[O-])C2,C13272516_decoy,TRY1,Decoy,0,-7.92647,-5.87,-3.09,-5.335466471887939
O=C(CCSc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2[O-])n1)Nc1ccc([N+](=O)[O-])cc1,C21079756_decoy,TRY1,Decoy,0,-9.4705,-7.08,-2.44,-6.393739583399585
COc1cc(/C=N/Nc2nnc(SCc3ccccc3Cl)n2N)cc([N+](=O)[O-])c1[O-],C21326810_decoy,TRY1,Decoy,0,-8.41036,-8.31,-4.07,-7.410701715025271
C#C[C@@]1(O[C@@H]2O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@@]21C,C22058453_decoy,TRY1,Decoy,0,-8.2476,-6.28,-1.66,-5.93139528594996
CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2cc(Br)c([O-])c(Br)c2)NC(=O)N1,C27751464_decoy,TRY1,Decoy,0,-8.66567,-5.6,-3.38,-5.664277597874843
Cc1ccc(C)c(OCCCC(C)(C)C(=O)O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c1,C35644420_decoy,TRY1,Decoy,0,-4.83494,-7.16,-2.12,-4.669401280733631
Cc1n[nH]c([O-])c1[C@@H](c1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1c(C)[nH][nH]c1=O,C08972985_decoy,TRY1,Decoy,0,-7.8243,-7.02,-2.16,-5.705207201544527
CN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36530112_decoy,TRY1,Decoy,0,-7.96477,-6.05,-3.17,-5.886970393880449
CC(C)(C)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36585827_decoy,TRY1,Decoy,0,-4.002,-6.88,-2.17,-5.087394895273561
O=c1[nH]c(=O)c2c(-c3c(-n4cccc4)nc([O-])[nH]c3=O)c(-c3cccc(Cl)c3)[nH]c2[nH]1,C20896812_decoy,TRY1,Decoy,0,-6.9972,-5.56,-1.76,-4.93109131375361
COc1ccccc1N1C(=O)/C(=C/NNC(=S)Nc2ccccc2)C([O-])=NC1=S,C13687967_decoy,TRY1,Decoy,0,-8.26271,-7.43,-1.46,-6.28150728430159
COc1ccc(-c2ccc([C@@H](c3c(O)n[nH]c3C)c3c(C)n[nH]c3[O-])o2)c([N+](=O)[O-])c1,C33436889_decoy,TRY1,Decoy,0,-5.69529,-8.2,-2.39,-5.481244715191889
O=S(=O)(NCCC[C@H]1NN[C@@H](S(=O)(=O)Cc2ccccc2F)O1)c1ccc2nc([O-])oc2c1,C38794385_decoy,TRY1,Decoy,0,-8.87462,-8.08,-2.8,-6.354952940654937
O=S(=O)(NCCC[C@H]1NN[C@H](S(=O)(=O)Cc2ccccc2F)O1)c1ccc2nc([O-])oc2c1,C38794387_decoy,TRY1,Decoy,0,-9.31741,-8.38,-4.62,-7.499706739627618
O=S(=O)(NCCC[C@@H]1NN[C@@H](S(=O)(=O)Cc2ccc(F)cc2)O1)c1ccc2nc([O-])oc2c1,C38794407_decoy,TRY1,Decoy,0,-8.8097,-6.78,-3.66,-6.296475378142685
CC(C)[C@H](NS(=O)(=O)c1ccc2nc([O-])oc2c1)[C@@H]1NN[C@H](S(=O)(=O)Cc2ccc(F)cc2)O1,C38794630_decoy,TRY1,Decoy,0,-8.68794,-8.86,-3.99,-8.084579846588014
Cc1[nH]nc([O-])c1[C@H](C1=C(O)N=N[C@H]1C)c1cc(Br)c(O)c(Br)c1O,C39344333_decoy,TRY1,Decoy,0,-8.29748,-6.43,-1.46,-5.757266097672042
CC1=C([C@@H](c2cc(Br)c(O)c(Br)c2)c2c([O-])n[nH]c2C)[C@@H](O)N=N1,C39355863_decoy,TRY1,Decoy,0,-8.00884,-6.15,-1.35,-6.09653521245304
C[C@@H](Sc1nc2sc3c(c2c(=O)[nH]1)CCCC3)/C([O-])=C1/C(=O)N(C)C(=O)N(C)[C@H]1N,C39420007_decoy,TRY1,Decoy,0,-9.37826,-7.1,-2.54,-6.308943691863763
CCOC(=O)[C@@H]1C2=C(CCCCC2)S[C@H]1NC(=O)CSc1nc([O-])c(NC(C)=O)c(=O)[nH]1,C39432372_decoy,TRY1,Decoy,0,-9.37638,-6.98,-2.27,-6.826850565391724
O=C([O-])c1cc(S(=O)(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3)c2)ccc1O,C13346617_decoy,TRY1,Decoy,0,-8.52215,-8.15,-4.07,-7.418520600097766
[NH-]C1=NC(=O)C2=N[C@@H](SCc3ccc(Cl)c(Cl)c3)N([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39939264_decoy,TRY1,Decoy,0,-6.53847,-8.38,-1.29,-5.951392788856521
NC(=O)c1c(SCC(=O)Nc2ccc(Br)cc2)sc2c([O-])cc(=O)[nH]c12,C40286914_decoy,TRY1,Decoy,0,-10.8431,-7.75,-1.65,-7.557166818199821
NNc1ncc(Br)cc1S(=O)(=O)[N-]c1ccc(Br)cn1,C41070013_decoy,TRY1,Decoy,0,-8.12857,-6.56,-1.63,-6.697490501403832
C[C@@]12CC/C(=N/OCC(=O)[O-])C=C1CC[C@H]1[C@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C43736506_decoy,TRY1,Decoy,0,-9.34608,-5.41,-2.84,-5.281922382361779
CC(C)[C@H](NC(=O)CNC(=O)CO/N=C1\C=C2CC[C@H]3[C@H]4CC[C@@H](O)[C@]4(C)CC[C@@H]3[C@]2(C)CC1)C(=O)[O-],C43737030_decoy,TRY1,Decoy,0,-8.72099,-6.93,-4.38,-6.328886558524793
C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N/OCC(=O)NCC(=O)N[C@@H](C(=O)[O-])C(C)C)CC[C@@]4(C)[C@H]3CC[C@]21C,C43737449_decoy,TRY1,Decoy,0,-7.93645,-7.48,-3.72,-6.177848993602553
O=C([O-])c1ccccc1-c1c2ccc(=O)cc-2oc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc12,C44168653_decoy,TRY1,Decoy,0,-8.01763,-6.36,-4.08,-4.882445435234859
O=C1O[C@@](c2ccc(O)cc2)(c2ccc(O[C@@H]3O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]3O)cc2)c2ccccc21,C44171881_decoy,TRY1,Decoy,0,-7.04479,-6.88,-3.6,-5.37333224450946
CCOC(=O)NNC(=O)c1cc(=O)[nH]c2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)cc12,C45574460_decoy,TRY1,Decoy,0,-8.20879,-7.73,-2.37,-6.198915321183802
C[C@@H](C(=O)NCCCCCC(=O)[O-])N1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S,C15048164_decoy,TRY1,Decoy,0,-8.77799,-7.94,-4.29,-7.987851881672104
Cc1ccc(NC(=O)C[C@@H]2SC(NC3(c4c([O-])[nH]c(=O)[nH]c4=O)CCCC3)=NC2=O)cc1,C20135017_decoy,TRY1,Decoy,0,-8.01798,-7.77,-2.03,-6.909683467559179
Cc1c(/N=C([O-])/C(C#N)=N/Nc2ccc3[nH]c(=O)[nH]c3c2)c(=O)n(-c2ccccc2)n1C,C13145951_decoy,TRY1,Decoy,0,-9.2676,-10.44,-2.4,-8.809591676958576
Cc1c(N2CCC3=C(C2)/C(=N/O)[C@H](C)CS3)c(N)cc2c(=O)c(C(=O)[O-])cn(C3CC3)c12,C49778019_decoy,TRY1,Decoy,0,-8.21765,-6.11,,99.0
O=[N+]([O-])c1ccc(N/N=C/c2cccc(O)c2O)c(S(=O)(=O)[N-]c2ccccc2Cl)c1,C09097032_decoy,TRY1,Decoy,0,-7.75512,-6.43,-2.19,-5.6366254408187935
O=[N+]([O-])c1ccc(N/N=C/c2cccc(O)c2O)c(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1,C12564649_decoy,TRY1,Decoy,0,-8.24116,-6.56,-3.93,-5.942292793571089
CC1=C(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])[C@H](c2ccc(C(=O)[O-])cc2)NC(=S)N1,C59384565_decoy,TRY1,Decoy,0,-5.22766,-6.29,-2.86,-4.763285887251965
CC1=C(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)[C@@H](c2ccc(C(=O)[O-])cc2)NC(=S)N1,C59384594_decoy,TRY1,Decoy,0,-6.73181,-8.48,-0.87,-6.729711915041065
CC1=C(C(=O)N/N=C/c2ccc(C(=O)[O-])cc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1,C59385621_decoy,TRY1,Decoy,0,-7.60944,-6.32,-1.57,-7.066131436069635
COc1cc(/C=N/NC(=O)Cc2csc(N)n2)c(Br)cc1OCC(=O)[O-],C59644340_decoy,TRY1,Decoy,0,-9.08975,-6.28,-3.01,-6.716498210562904
COc1cc(/C=N/NC(=O)Cc2csc(N)n2)cc(Br)c1OCC(=O)[O-],C59645618_decoy,TRY1,Decoy,0,-10.0803,-6.05,-1.86,-7.201460864477463
COc1cc(N/C(N)=N\c2nc([O-])cc(CSc3nnc(C)s3)n2)cc(OC)c1,C13570627_decoy,TRY1,Decoy,0,-8.2178,-7.67,-1.66,-7.082593038019272
Cc1[nH]n(-c2ccccc2)c(=O)c1[C@@]1(C(F)(F)F)C(=O)N[C@H]2C1=C([O-])NC(=O)N2c1ccccc1,C38958841_decoy,TRY1,Decoy,0,-7.69058,-6.44,-1.11,-5.32195913646139
Cc1[nH]n(-c2ccccc2)c(=O)c1[C@@]1(C(F)(F)F)C(=O)N[C@@H]2C1=C([O-])NC(=O)N2Cc1ccc(F)cc1,C38959030_decoy,TRY1,Decoy,0,-8.37362,-7.16,-0.74,-5.92101487873471
CC(C)(C)c1ccc(NC(=O)CSC2=C(C(N)=O)C3=NC(=O)C=C([O-])[C@H]3S2)cc1,C40266513_decoy,TRY1,Decoy,0,-8.35161,-6.8,-3.61,-6.302834821646551
CCC[C@@H]1CCc2c(sc(NC(=O)[C@@H]3[C@@H]4CC[C@@H](C4)[C@@H]3C(=O)[O-])c2C(N)=O)C1,C04019447_decoy,TRY1,Decoy,0,-9.07554,-7.09,-2.21,-7.098796217146827
NC(=S)N/N=C\c1cn(CCC(=O)[O-])nc1-c1cccc(Br)c1,C04491863_decoy,TRY1,Decoy,0,-8.20256,-6.44,-1.62,-8.334557920916298
CC[C@@H]1CCc2c(sc(NC(=O)[C@H]3[C@@H]4CC[C@@H](C4)[C@@H]3C(=O)[O-])c2C(N)=O)C1,C05094759_decoy,TRY1,Decoy,0,-7.97088,-4.98,-3.11,-4.880348579078866
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@H]1C[C@@H](O)[C@@H]2[C@](C)(O)CC(=O)[O-],C05529958_decoy,TRY1,Decoy,0,-8.09679,-6.93,-2.16,-4.969457858928752
C[C@]12CC[C@H]3[C@H](CC=C4C[C@H](O)CC[C@@]43C)[C@H]1C[C@@H](O)[C@@H]2[C@](C)(O)CC(=O)[O-],C05530028_decoy,TRY1,Decoy,0,-7.43463,-6.93,-3.16,-4.712516747428633
C[C@H](CCC(=O)[O-])[C@H]1CC[C@H]2[C@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C,C08214947_decoy,TRY1,Decoy,0,-9.35726,-7.78,-3.04,-6.22967733285698
CC(C)(C)c1cc(CCC(=O)NNC(=O)/C=C/C(=O)[O-])cc(C(C)(C)C)c1O,C03199337_decoy,TRY1,Decoy,0,-6.65713,-5.77,-1.6,-5.50572277343586
O=C([O-])c1ccc(N2C(=O)/C(=C/c3ccc(O)c(O)c3)SC2=S)cc1O,C16929336_decoy,TRY1,Decoy,0,-8.78406,-6.19,-1.83,-5.828821879443995
Nc1nc2n(n1)[C@@H](c1ccc(C(=O)[O-])cc1)C1=C(C[C@@H](c3cccs3)CC1=O)N2,C18200605_decoy,TRY1,Decoy,0,-8.42401,-5.31,-1.77,-4.855850140081484
CCCc1cc([O-])nc(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1,C06313735_decoy,TRY1,Decoy,0,-10.0761,-7.66,-1.75,-7.054779810460371
O=C1N=C([O-])C2(C(=O)N1)[C@H](c1cccc(Cl)c1)NC(=S)N[C@H]2c1cccc(Cl)c1,C20117143_decoy,TRY1,Decoy,0,-8.65747,-5.46,-0.8,-4.927425710363217
Cc1cccc(-n2c([O-])c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c([O-])nc2=S)c1,C17196914_decoy,TRY1,Decoy,0,-7.56701,-8.8,-1.35,-12.069754578258028
[O-]c1nc(=S)n(-c2ccccc2)c([O-])c1[C@H]1[NH2+]CCc2c1[nH]c1ccccc21,C17198127_decoy,TRY1,Decoy,0,-6.42901,-6.93,-1.83,-4.643476177472316
O=C1N=C([O-])C2(C(=O)N1)[C@@H](c1ccc(Cl)cc1Cl)NC(=O)N[C@@H]2c1ccc(Cl)cc1Cl,C27838809_decoy,TRY1,Decoy,0,-9.98109,-6.3,-1.52,-6.310304894515945
Cc1ccc(C)c(-n2c([O-])c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c([O-])nc2=S)c1,C18213475_decoy,TRY1,Decoy,0,-7.40672,-8.78,-2.27,-8.369621291015772
N#CC1=C(N)Oc2nc([O-])[nH]c(=O)c2[C@@H]1c1ccc(-c2cc(Cl)ccc2Cl)o1,C34967322_decoy,TRY1,Decoy,0,-7.82906,-6.03,-2.17,-4.577276298125012
Cc1n[nH]c([O-])c1[C@H](c1ccc(I)cc1)c1c(C)[nH][nH]c1=O,C35103007_decoy,TRY1,Decoy,0,-6.67391,-5.48,-1.86,-4.7049423111914
O=C1N=C([O-])N(c2ccccc2Cl)C(=O)/C1=C\NNC(=O)c1ccccc1O,C02261896_decoy,TRY1,Decoy,0,-6.89575,-7.08,-2.27,-6.686021829690927
Cc1ccccc1N1C(=O)/C(=C/NNC(=O)c2ccccc2O)C([O-])=NC1=S,C17162366_decoy,TRY1,Decoy,0,-7.0919,-5.11,-1.59,-5.635751424511956
Cc1cc(/N=N/c2ccc(N/N=C3\C=CC(=O)C(C(=O)[O-])=C3)cc2)c(N)cc1N,C17303159_decoy,TRY1,Decoy,0,-7.43668,-6.93,-2.24,-6.102768099320515
Nc1nc(Nc2ccc(Br)cc2)nc(-c2cc(Cl)ccc2[O-])n1,C00626159_decoy,TRY1,Decoy,0,-7.82581,-5.31,-1.73,-3.6593649271811626
NC(=O)c1c(NC(=O)[C@@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])sc2c1CCCCC2,C17079671_decoy,TRY1,Decoy,0,-8.42549,-6.61,-1.63,-6.305265315853928
CC1=C([C@@H](c2ccccc2Cl)c2c(C)n[nH]c2[O-])[C@@H](O)N(c2ccccc2)N1,C39369137_decoy,TRY1,Decoy,0,-6.68945,-5.91,-1.94,-4.860529457307043
Cc1ccccc1[C@H]1NO[C@@H](CSc2nc(C)c(CCC(=O)[O-])c([O-])n2)[NH2+]1,C39668064_decoy,TRY1,Decoy,0,-6.98044,-6.66,-2.12,-7.488239261442244
C/C(=N\Nc1c(Cl)c(Cl)nc(C(=O)[O-])c1Cl)c1ccc(O)cc1O,C13352631_decoy,TRY1,Decoy,0,-8.18143,-6.6,-1.98,-5.736122120853596
O=C1c2n[nH]c(-c3cc(Cl)ccc3[O-])c2[C@H](c2cccc(O)c2)N1CCO,C39897982_decoy,TRY1,Decoy,0,-8.34275,-5.23,-1.02,-5.362594757930292
Nc1c(Nc2ccc(C(=O)[O-])cc2)ncnc1Nc1cc(Cl)ccc1Cl,C40778452_decoy,TRY1,Decoy,0,-9.3801,-6.28,-2.57,-5.378307817257039
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](C(=O)[O-])[C@@](C)(O)[C@](C)(O)[C@]1(C)O,C43509415_decoy,TRY1,Decoy,0,-7.0658,-7.6,-3.05,-4.842373052770201
C[C@@]12CC[C@H]3[C@@H](CC=C4C[C@H](O)CC[C@]43C)[C@H]1C[C@@H](O)[C@@H]2[C@](C)(O)CC(=O)[O-],C43737175_decoy,TRY1,Decoy,0,-8.12142,-7.17,-2.27,-5.47291894660278
Cc1c(C(=O)NNC(=O)c2ccc3c([O-])[nH]c(=S)nc3c2)oc2ccccc12,C46660001_decoy,TRY1,Decoy,0,-8.82956,-7.43,-1.42,-7.071890154542476
Nc1ccc(Nc2cc(Br)ccc2Br)cc1C(=O)[O-],C49124830_decoy,TRY1,Decoy,0,-7.75474,-4.93,-1.29,-4.661837087406102
Cc1ccc(C)c(NC(=O)[C@H]2[C@@H](c3cccc(F)c3)/C(=C(\[O-])Nc3cc(C)ccc3C)C(=O)C[C@]2(C)O)c1,C54622135_decoy,TRY1,Decoy,0,-9.10272,-9.39,-1.81,-8.350132175262017
Cc1ccsc1[C@H]1/C(=C(\[O-])Nc2cccc(C)c2C)C(=O)C[C@](C)(O)[C@H]1C(=O)Nc1cccc(C)c1C,C54622154_decoy,TRY1,Decoy,0,-7.07756,-6.24,-1.37,-4.904865419559094
Cc1ccc2c(c1)[C@]1(C(=O)N2)C(C#N)=C(N)Nc2nc(SCc3cccc(F)c3)nc([O-])c21,C12462571_decoy,TRY1,Decoy,0,-7.932,-6.61,-2.77,-5.128524312310917
CC1=C(C(=O)N/N=C/c2ccc(C(=O)[O-])cc2)[C@@H](c2ccc(O)cc2)NC(=S)N1,C59385093_decoy,TRY1,Decoy,0,-9.64671,-6.21,-1.83,-5.730310023177975
CC1=C(C(=O)N/N=C/c2ccc(O)cc2)[C@@H](c2ccc(C(=O)[O-])cc2)NC(=O)N1,C59385554_decoy,TRY1,Decoy,0,-8.69131,-1.84,-1.94,-3.934848387618155
Nc1nonc1/C(=N\OC(=O)Nc1ccc(Cl)cc1)[N-]c1ccc(Br)cc1,C59434808_decoy,TRY1,Decoy,0,-8.41932,-8.18,-1.7,-7.552409503701061
N/C(=N/c1nc([O-])cc(CSc2ccc(Cl)cc2)n1)Nc1ccc2c(c1)OCCO2,C13570488_decoy,TRY1,Decoy,0,-9.0842,-5.69,-4.1,-6.282137216097614
COc1ccccc1N/C(N)=N/c1nc([O-])cc(CSc2nnc(C)s2)n1,C13569388_decoy,TRY1,Decoy,0,-8.21592,-7.07,-1.81,-6.337788533479131
CCC(=O)Nc1ccc([C@@H](C)NC(=O)c2ccc3c([O-])[nH]c(=S)nc3c2)cc1,C60630085_decoy,TRY1,Decoy,0,-7.7691,-8.94,-1.83,-6.573337445173983
CC/C(C[C@@H](c1ccccc1)c1c([O-])c2ccccc2oc1=O)=N\NC(N)=S,C15919678_decoy,TRY1,Decoy,0,-7.3934,-7.1,-1.62,-7.581326765597072
O=C(Nc1ccc(I)cc1C(=O)[O-])c1ccc(O)cc1O,C62823977_decoy,TRY1,Decoy,0,-6.33236,-8.33,-0.72,-8.383866490018502
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(I)cc1C(=O)[O-],C62824705_decoy,TRY1,Decoy,0,-6.04502,-6.79,-1.91,-5.222235512015918
Nc1nonc1C(=O)Nc1c(Br)cc(Br)cc1C(=O)[O-],C62825401_decoy,TRY1,Decoy,0,-6.5745,-5.65,-2.32,-5.335640697773534
[H]/N=C(\N=C(/[O-])c1ccccc1)N/C(=N\c1ccccc1)Nc1nc(C)cc(C)n1,C05849207_decoy,TRY1,Decoy,0,-7.24051,-6.09,-2.61,-5.550325803497069
COc1ccc(N/C(N)=N/c2nc([O-])cc(CS[C@H]3NN=C(C)S3)n2)cc1,C38960024_decoy,TRY1,Decoy,0,-9.25069,-7.2,-2.28,-6.675189699001678
CSc1ccc([C@@H]2C3=C([O-])c4ccccc4C3=Nc3[nH]c(N)nc(=O)c32)cc1,C04385917_decoy,TRY1,Decoy,0,-6.69683,-7.48,-0.96,-4.260141248196062
CCOc1ccc([C@@H]2C3=C([O-])c4ccccc4C3=Nc3[nH]c(N)nc(=O)c32)cc1,C13152831_decoy,TRY1,Decoy,0,-7.27628,-6.42,-0.6,-4.813931316396109
CC/C(C[C@H](c1ccccc1)c1c([O-])oc2ccccc2c1=O)=N\NC(N)=S,C15919679_decoy,TRY1,Decoy,0,-8.69325,-6.86,-1.75,-6.327277112367599
O=C1N=C([O-])N(c2ccc(F)cc2)C(=O)/C1=C1/C[C@@H](c2c[nH]c3ccccc23)NN1,C08770508_decoy,TRY1,Decoy,0,-7.97304,-9.38,-0.19,-5.840541442932241
CC(C)(C)[NH2+][C@@H](NC(=O)N[C@@H]([NH2+]C(C)(C)C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,C02900813_decoy,TRY1,Decoy,0,-9.10353,-3.48,-2.63,-5.693351581606034
CC(C)(C)[NH2+][C@H](NC(=O)N[C@@H]([NH2+]C(C)(C)C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,C02900815_decoy,TRY1,Decoy,0,-9.03881,-4.24,-3.95,-5.51868525048233
CC(C)(C)[NH2+][C@@H](NC(=O)N[C@H]([NH2+]C(C)(C)C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,C02900814_decoy,TRY1,Decoy,0,-9.37345,-3.71,-2.03,-5.377784393250476
CC/C(Cc1ccccc1)=N\Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975189_decoy,TRY1,Decoy,0,-7.43716,-7.37,-1.7,-8.073814049944094
COc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C08740520_decoy,TRY1,Decoy,0,-7.91315,-8.1,-2.91,-8.958572102156097
O=C(N/N=C(\c1nc2cc(Cl)ccc2[nH]c1=O)[C@@H](O)[C@@H](O)CO)c1ccc(O)cc1,C15775259_decoy,TRY1,Decoy,0,-8.44659,-8.63,-1.69,-10.047163572975569
Cc1ccccc1OC[C@@H](O)C[NH2+]Cc1cccc(C[NH2+]C[C@H](O)COc2ccccc2C)c1,C16043572_decoy,TRY1,Decoy,0,-8.03505,-7.26,-3.66,-7.328645695489921
O[C@@H](C[NH2+]Cc1ccccc1Cl)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccccc2Cl)cc1,C27529518_decoy,TRY1,Decoy,0,-9.17111,-7.22,-1.86,-6.938885599781671
O=C(OCc1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)C=CCC[C@H]1O,C31165589_decoy,TRY1,Decoy,0,-7.23257,-6.29,-1.28,-6.2436572322602375
CC(C)(O)[C@@H](O)CC[C@@H](CO)[C@@H]1CC[C@@]2(C)C3=C(C[C@@H](O)[C@@]12C)[C@@]1(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]1CC3,C31169577_decoy,TRY1,Decoy,0,-10.6479,-6.44,-1.79,-6.989561370477576
Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C33682728_decoy,TRY1,Decoy,0,-7.05497,-8.62,-2.96,-7.60475764645633
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C33758759_decoy,TRY1,Decoy,0,-7.69932,-8.99,-2.21,-10.298218254136954
C=Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1,C31417264_decoy,TRY1,Decoy,0,-6.20607,-5.89,-1.3,-4.586446677874152
COc1cccc(/C=[NH+]/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1[O-],C09975162_decoy,TRY1,Decoy,0,-6.82207,-7.51,-0.79,-7.205382906879713
N#C/C(=C\c1ccc(O)c(O)c1)C(=O)N[C@@H]1CCC[C@@H](NC(=O)/C(C#N)=C/c2ccc(O)c(O)c2)C1,C05538340_decoy,TRY1,Decoy,0,-11.2085,-6.82,-3.43,-7.469211996174701
CC(C)(O)[C@@H](O)CC[C@@H](CO)[C@H]1CC[C@]2(C)C3=C(C[C@H](O)[C@@]12C)[C@@]1(C)C[C@H](O)[C@H](O)C(C)(C)[C@H]1CC3,C35271623_decoy,TRY1,Decoy,0,-10.3608,-7.58,-1.55,-6.448813423009868
COC(=O)[C@H]1[NH+]=c2ccccc2=C1NC(=O)C[NH+]1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C38688838_decoy,TRY1,Decoy,0,-8.33734,-5.63,-2.61,-6.70195296019945
COC(=O)[C@@H]1[NH+]=c2ccccc2=C1NC(=O)C[NH+]1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C38688839_decoy,TRY1,Decoy,0,-7.40646,-8.26,-2.24,-7.286761066269744
O[C@H](C[NH2+]CCC1=CCCCC1)COc1ccc(OC[C@H](O)C[NH2+]CCC2=CCCCC2)cc1,C38711162_decoy,TRY1,Decoy,0,-10.3645,-7.06,-1.55,-7.298391641330448
O[C@H](C[NH2+]CCC1=CCCCC1)COc1ccc(OC[C@@H](O)C[NH2+]CCC2=CCCCC2)cc1,C38711163_decoy,TRY1,Decoy,0,-9.81663,-7.21,-3.03,-7.917930438718574
O[C@@H](C[NH2+]CCC1=CCCCC1)COc1ccc(OC[C@@H](O)C[NH2+]CCC2=CCCCC2)cc1,C38711164_decoy,TRY1,Decoy,0,-10.5417,-7.08,-3.77,-7.208190120167295
CCCc1ccc([C@@H](CNc2ccccc2O)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39532634_decoy,TRY1,Decoy,0,-7.95664,-5.33,-1.22,-5.940423409648531
CC(C)Cc1ccc([C@@H](CNc2ccccc2O)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533328_decoy,TRY1,Decoy,0,-10.642,-8.31,-1.85,-8.258539391538545
CC(C)Cc1ccc([C@H](CNc2ccccc2O)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533329_decoy,TRY1,Decoy,0,-9.11102,-7.15,-1.48,-8.053210751423114
O=C(N/N=C(\[C@@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@@H](O)[C@H](O)CO)c1ccc(O)cc1,C40151310_decoy,TRY1,Decoy,0,-9.30044,-7.53,-2.89,-7.234085319110822
O=C(/C=C\c1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C40651531_decoy,TRY1,Decoy,0,-6.62997,-7.92,-4.09,-5.446162863372787
CC1(C)CC(Nc2nc[nH+]c(NN(c3ccccc3)c3ccccc3)c2N)CC(C)(C)[NH2+]1,C40760718_decoy,TRY1,Decoy,0,-8.4855,-6.34,-3.04,-6.713393401905696
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc(OC)c1O,C43465472_decoy,TRY1,Decoy,0,-8.54711,-8.25,-2.31,-8.561629426161652
Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1,C44135755_decoy,TRY1,Decoy,0,-7.04294,-7.93,-2.59,-6.833119064229671
Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1,C44135761_decoy,TRY1,Decoy,0,-7.76118,-7.75,-2.26,-6.159671770683072
CCCC[C@H](CC)Cn1c2ccc(C[C@H]([NH3+])CO)cc2c2cc(C[C@@H]([NH3+])CO)ccc21,C44467750_decoy,TRY1,Decoy,0,-10.7236,-7.48,-1.34,-13.822003475267332
Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C44960176_decoy,TRY1,Decoy,0,-7.70409,-8.35,-2.5,-7.530794726764768
NC(=O)c1cccc2c(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cccc12,C52627693_decoy,TRY1,Decoy,0,-9.57009,-7.74,-2.9,-6.350304018207932
O=C(N/N=C/c1ccc(O)cc1O)c1nonc1C(=O)N/N=C/c1ccc(O)cc1O,C59503390_decoy,TRY1,Decoy,0,-9.14305,-8.36,-1.86,-9.809802486643498
Cc1cccc(C)c1N1N[NH2+]N[C@H]1[C@H]([NH2+]CCC1=c2ccccc2=[NH+][C@@H]1C)c1ccccc1,C63513945_decoy,TRY1,Decoy,0,-7.44332,-7.16,-3.08,-7.141862613314612
CC[NH+](CC)CCNC(=O)c1ccc(N2CC(=O)C([C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)cc1,C63515081_decoy,TRY1,Decoy,0,-8.00264,-8.56,-3.59,-7.435429300295455
CC[NH+](CC)CCNC(=O)c1ccc(N2CC(=O)C([C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)cc1,C63515082_decoy,TRY1,Decoy,0,-8.12075,-6.03,-1.84,-7.412807077467802
Cc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1cccc(NC(=O)CS[C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)n1)[NH+]=2,C63562386_decoy,TRY1,Decoy,0,-9.29448,-8.44,-2.68,-8.6226683682998
O=C(CS[C@H]1N[C@@H](c2ccco2)Nc2cc(=O)[nH]n21)NCC1[NH+]=c2ccccc2=[NH+]1,C63648744_decoy,TRY1,Decoy,0,-6.90281,-7.54,-2.96,-6.143285126382598
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2ccc(Cl)c(Cl)c2)O1,C63720175_decoy,TRY1,Decoy,0,-7.96172,-5.94,-2.22,-5.0259878341846695
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@H](SCc2ccc(Cl)c(Cl)c2)O1,C63720176_decoy,TRY1,Decoy,0,-9.27438,-5.59,-2.62,-5.692399927022952
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@@H](SCc2ccc(Cl)c(Cl)c2)O1,C63720177_decoy,TRY1,Decoy,0,-9.71262,-5.33,-3.48,-5.901127034549958
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@@H](SCc2ccc(Cl)c(Cl)c2)O1,C63720178_decoy,TRY1,Decoy,0,-9.15982,-5.44,-0.61,-5.848163313533222
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2ccc(Cl)cc2Cl)O1,C63720223_decoy,TRY1,Decoy,0,-8.26203,-6.55,-2.58,-5.994431784205521
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@@H](SCc2ccc(Cl)cc2Cl)O1,C63720225_decoy,TRY1,Decoy,0,-9.21368,-6.39,-2.77,-5.808951031767441
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@@H](SCc2ccc(Cl)cc2Cl)O1,C63720226_decoy,TRY1,Decoy,0,-8.13931,-5.37,-1.98,-4.776937493383714
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2c(Cl)cccc2Cl)O1,C63761269_decoy,TRY1,Decoy,0,-8.42867,-6.61,-2.74,-5.924239888402973
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@H](SCc2c(Cl)cccc2Cl)O1,C63761270_decoy,TRY1,Decoy,0,-7.51483,-5.39,-1.17,-4.779889220189997
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@@H](SCc2c(Cl)cccc2Cl)O1,C63761271_decoy,TRY1,Decoy,0,-9.1905,-6.45,-2.11,-5.648998021809314
Cc1cccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64097844_decoy,TRY1,Decoy,0,-8.77568,-6.4,-3.17,-5.647284844603873
Nc1nc(N)nc(-c2ccc(Oc3ccc(Oc4ccc(-c5nc(N)nc(N)n5)cc4)cc3)cc2)n1,C02029934_decoy,TRY1,Decoy,0,-9.29496,-9.41,-1.5,-8.200440801568568
Nc1ncnc2[nH]c(SCc3ccc(CSc4nc5c(N)ncnc5[nH]4)c4nsnc34)nc12,C02030989_decoy,TRY1,Decoy,0,-8.79839,-9.11,-2.56,-6.967664196537083
CC(C)=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccc(O)cc1)[C@H](O)C2=O,C04273376_decoy,TRY1,Decoy,0,-8.97975,-6.41,-3.15,-5.70678849103429
CC(=O)OC[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C04349595_decoy,TRY1,Decoy,0,-9.538,-9.14,-4.28,-8.661861223837406
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C04349695_decoy,TRY1,Decoy,0,-8.79017,-9.03,-3.02,-7.972216688135723
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H]3O)ccc12,C04556903_decoy,TRY1,Decoy,0,-6.67186,-5.68,-1.11,-4.739686352862507
Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H]3O)ccc12,C04556904_decoy,TRY1,Decoy,0,-5.85604,-8.35,-1.41,-5.445555643552894
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@@H]3O)ccc12,C04556905_decoy,TRY1,Decoy,0,-6.43751,-6.45,-2.04,-4.787197923251533
COc1ccc(-c2oc3cc(O)c(OC)c(O)c3c(=O)c2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05812923_decoy,TRY1,Decoy,0,-8.2639,-8.4,-1.14,-8.850912608057246
Nc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(N)cc4N)cc3)cc2)c(N)c1,C01621263_decoy,TRY1,Decoy,0,-8.56634,-9.34,-1.93,-13.01497235607829
COCCNC(=O)[C@H](c1ccc(O)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06905087_decoy,TRY1,Decoy,0,-9.4375,-6.25,-1.02,-7.005649520282854
COc1cc(-c2cc(=O)c3c(O)c(OC)c(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3o2)ccc1O,C12419124_decoy,TRY1,Decoy,0,-8.40545,-8.19,-1.75,-7.7471854589389
Cc1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C,C12653053_decoy,TRY1,Decoy,0,-5.20715,-6.58,-1.56,-5.726236473514776
Cc1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C,C12653057_decoy,TRY1,Decoy,0,-6.49111,-7.24,-0.97,-6.509443549011709
Cc1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(N[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C,C12653062_decoy,TRY1,Decoy,0,-5.19098,-7.12,-2.76,-5.176790833352756
Cc1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(N[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C,C12653065_decoy,TRY1,Decoy,0,-6.72972,-7.34,-1.65,-5.563703462310784
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1Br,C16226553_decoy,TRY1,Decoy,0,-8.28595,-9.09,-3.24,-11.664400437440245
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1Br,C16226555_decoy,TRY1,Decoy,0,-7.77266,-9.19,-2.8,-8.335508457187183
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Br,C16226557_decoy,TRY1,Decoy,0,-7.65574,-7.1,-2.57,-7.919796566257088
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Br,C16226559_decoy,TRY1,Decoy,0,-8.57171,-7.76,-1.63,-7.298221424738152
Cc1[nH]c(C(=O)N/N=C/c2ccc(O)cc2O)c(C)c1C(=O)N/N=C/c1ccc(O)cc1O,C16249228_decoy,TRY1,Decoy,0,-9.84974,-7.99,-3.18,-7.332850481424662
CC(C)[NH2+]C[C@H](O)COc1ccc(O[C@H]2O[C@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]2O)c2ccccc12,C22061121_decoy,TRY1,Decoy,0,-7.00485,-5.97,-3.73,-5.458454980952243
NC(=[NH2+])N/N=C(/c1nc2ccc([N+](=O)[O-])cc2nc1[O-])[C@@H](O)c1ccc(Cl)c(Cl)c1,C25574314_decoy,TRY1,Decoy,0,-10.4601,-7.61,-1.9,-9.781701350519327
NC(=[NH2+])N/N=C(/c1nc2ccc([N+](=O)[O-])cc2nc1[O-])[C@H](O)c1ccc(Cl)c(Cl)c1,C25574317_decoy,TRY1,Decoy,0,-11.4225,-6.67,-1.66,-8.90443861330837
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCCOCC1,C32239411_decoy,TRY1,Decoy,0,-8.46451,-6.61,-3.55,-7.529316605021076
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])CC(C)C)CCOCCOCC1,C32239416_decoy,TRY1,Decoy,0,-7.92121,-4.96,-3.84,-5.136953027446875
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1Br,C35183222_decoy,TRY1,Decoy,0,-8.55884,-7.73,-3.26,-7.277973685206598
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1Br,C35183223_decoy,TRY1,Decoy,0,-9.07146,-9.08,-3.01,-9.961806882248007
Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H]3O)ccc12,C35395203_decoy,TRY1,Decoy,0,-7.09208,-8.27,-3.16,-5.513296773591137
Nc1nc(SCc2cc([N+](=O)[O-])ccc2O)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1,C35395377_decoy,TRY1,Decoy,0,-5.82166,-6.94,-3.2,-5.501783192147416
Nc1nc(SCc2cc([N+](=O)[O-])ccc2O)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C35395384_decoy,TRY1,Decoy,0,-6.54895,-7.28,-1.36,-5.544232273843872
CC(C)=CCc1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc2c(c1O)C(=O)[C@H](O)[C@H](c1ccc(O)cc1)O2,C35464232_decoy,TRY1,Decoy,0,-9.03766,-8.45,-3.57,-6.778080348573866
Cc1cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C,C08740320_decoy,TRY1,Decoy,0,-6.41471,-6.55,-1.14,-6.77670522291094
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500743_decoy,TRY1,Decoy,0,-8.70122,-5.23,-2.08,-6.4772668486360345
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1c(O)cccc1O,C36597476_decoy,TRY1,Decoy,0,-6.86848,-6.28,-4.26,-6.254027989029367
O=c1ccc2ccc(O[C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1,C31157867_decoy,TRY1,Decoy,0,-6.10967,-7.98,-2.39,-5.496167845030914
N#C/C(=C\c1ccc(O)c(O)c1)C(=O)NCCCCCNC(=O)/C(C#N)=C/c1ccc(O)c(O)c1,C01646734_decoy,TRY1,Decoy,0,-10.687,-7.77,-3.21,-8.484363552970185
[NH3+][C@@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@@H]1C(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C38999178_decoy1,TRY1,Decoy,0,-10.3391,-8.06,,-6.332868351588892
[NH3+][C@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@@H]1C(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C38999184_decoy,TRY1,Decoy,0,-9.90464,-8.07,-3.32,-6.895955428390969
CC(=O)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@@H]2O)cc1O,C06299010_decoy,TRY1,Decoy,0,-7.44133,-6.14,-2.92,-5.33898037825498
CC(=O)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@H](O)[C@@H]2O)cc1O,C39944862_decoy,TRY1,Decoy,0,-7.68933,-6.01,-2.04,-5.895962449362571
CC(=O)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@H](C)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C39944864_decoy,TRY1,Decoy,0,-7.38176,-6.21,-3.18,-5.681429277237603
CC(=O)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C39944866_decoy,TRY1,Decoy,0,-6.9458,-6.65,-2.63,-6.448886891116321
CC[C@@H](C)[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCCOCC1,C39988457_decoy,TRY1,Decoy,0,-8.98283,-5.18,-2.26,-6.394730216484425
CC[C@@H](C)[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCCOCC1,C39988459_decoy,TRY1,Decoy,0,-8.40981,-4.3,-3.39,-5.742102827277203
O=C(N/N=C(\[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C40151297_decoy,TRY1,Decoy,0,-9.29775,-8.91,-1.65,-8.398096822641637
O=C(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)c1ccccc1Cl,C40151330_decoy,TRY1,Decoy,0,-9.25202,-7.83,-1.48,-6.745401181921421
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](Oc3c[nH]c4cc(Cl)ccc34)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43179119_decoy,TRY1,Decoy,0,-6.22484,-5.84,-1.92,-4.855260968706815
CC1=C(C(=O)N/N=C/c2ccc(O)c(O)c2)[C@@H](C)C(C(=O)N/N=C/c2ccc(O)c(O)c2)=N1,C63770257_decoy,TRY1,Decoy,0,-11.2699,-8.76,-2.28,-7.68485554984412
O[C@@H](C[NH2+]CCNc1ccc(C(F)(F)F)c[nH+]1)Cn1ccc2ccccc21,C04299478_decoy,TRY1,Decoy,0,-7.11579,-7.56,-1.79,-6.736286754173459
O[C@@H](Cn1ccc2ccccc21)C[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2O)CC1,C04299561_decoy,TRY1,Decoy,0,-8.20569,-6.9,-1.54,-5.886656632792832
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCCC[NH2+]C[C@H](C)O)c2c1,C04428781_decoy,TRY1,Decoy,0,-8.62351,-5.91,-0.74,-5.426478226945113
C/C(CC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)=N\C1CC(C)(C)[NH2+]C(C)(C)C1,C04955045_decoy,TRY1,Decoy,0,-8.00796,-5.91,-2.36,-5.321411627265303
CC1(C)Cc2c(c(N3CCCC3)[nH+]c3sc4c(NCC[NH3+])ncnc4c23)CO1,C02366322_decoy,TRY1,Decoy,0,-9.90659,-5.48,-1.78,-5.598993215627883
C[NH2+]Cc1cn(C[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C(=O)N2CCC(C(N)=O)CC2)nn1,C08299759_decoy,TRY1,Decoy,0,-8.04321,-5.49,-1.75,-5.375583337290104
Nc1nc(C[NH+]2CCN(c3cccc[nH+]3)CC2)[nH]/c(=N\c2ccc(F)cc2)n1,C09361260_decoy,TRY1,Decoy,0,-6.9634,-6.96,-2.49,-5.199007749354441
OC1CC[NH+](C[C@@H](O)COc2cccc(C[NH2+]Cc3ccc(F)c(F)c3)c2)CC1,C11957599_decoy,TRY1,Decoy,0,-9.02761,-6.57,-2.05,-6.090058839035581
OC1CC[NH+](C[C@H](O)COc2cccc(C[NH2+]Cc3ccc(F)c(F)c3)c2)CC1,C11957607_decoy,TRY1,Decoy,0,-8.44066,-7.45,-2.06,-5.870258860473618
CC(=O)NCC[NH2+]Cc1ccccc1OC[C@H](O)C[NH+]1CCc2ccccc2C1,C12431511_decoy,TRY1,Decoy,0,-8.31237,-6.56,-2.83,-5.721489854881583
O[C@@H](COc1ccccc1C[NH2+]CC1(O)CCCCC1)C[NH+]1CCCCC1,C12592952_decoy,TRY1,Decoy,0,-8.1999,-7.04,-2.5,-5.698394455881862
Cc1cccnc1CC[NH2+]Cc1cccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c1,C12308368_decoy,TRY1,Decoy,0,-9.24508,-7.0,-2.03,-6.827723684351724
OC1CC[NH+](C[C@H](O)COc2cccc(C[NH2+]CCn3cccn3)c2)CC1,C14977614_decoy,TRY1,Decoy,0,-8.46712,-6.14,-3.41,-5.782869052767955
Cc1cc(C[NH+]2CCC3(CC2)c2ccccc2[C@@H]([NH+](C)CCO)[C@@H]3O)n[nH]1,C20322397_decoy,TRY1,Decoy,0,-7.85007,-5.78,-1.52,-5.647360057192135
OC[C@@H]1O[C@H](C[NH2+]C2CCOCC2)[C@H](N2CCN(c3cccc[nH+]3)CC2)[C@@H]1O,C20465654_decoy,TRY1,Decoy,0,-8.52489,-6.06,-1.37,-5.827093134477341
C[NH+](CCc1ccccn1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]Cc1ccccn1,C20465909_decoy,TRY1,Decoy,0,-6.25245,-5.0,-2.11,-4.974910064394243
C[NH2+]CCC[NH2+]Cc1cc(Br)ccc1OCC(=O)NC(C)(C)C,C20873268_decoy,TRY1,Decoy,0,-8.72869,-4.32,-3.93,-5.39849113619796
OC1CCN(CC[NH2+]Cc2ccccc2OC[C@H](O)C[NH+]2CCSCC2)CC1,C20999165_decoy,TRY1,Decoy,0,-7.73038,-4.56,-2.9,-4.90569105677286
CC1(C)CCc2cc3c4c(/c(=[NH+]\NC(=O)CCC[NH3+])oc3cc2O1)CCCC4,C32046731_decoy,TRY1,Decoy,0,-9.52545,-8.64,-2.3,-11.279700331358727
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)N2CCCN3CCC[NH+]=C32)co1,C34387819_decoy,TRY1,Decoy,0,-4.8755,-8.78,-1.47,-4.744096006286348
CC[NH+]1CCN(c2[nH]/c(=[NH+]/c3ccc(Cl)cc3)nc(N)c2[N+](=O)[O-])CC1,C17206905_decoy,TRY1,Decoy,0,-6.81154,-5.15,-1.27,-4.700842948720007
Cc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3cccc[nH+]3)CC2)n1,C01070805_decoy,TRY1,Decoy,0,-7.443,-7.04,-1.05,-5.336094706534254
CCCC1=C[C@H](CN(C)C(=O)CN2N[NH2+]N[C@H]2C[NH+]2CCC(C)CC2)N=N1,C39362505_decoy,TRY1,Decoy,0,-7.39016,-7.01,-1.88,-6.157262711093016
CC1=N[C@@H](CN(C)C(=O)CN2N[NH2+]N[C@H]2C[NH+]2CCc3ccccc3C2)N=C1,C39406541_decoy,TRY1,Decoy,0,-7.06533,-6.26,-1.96,-5.688314807588712
O=C(CN1N[NH2+]N[C@@H]1C[NH+]1CCc2ccccc2C1)N1CCC2=C(CN=N2)C1,C39537399_decoy,TRY1,Decoy,0,-7.57952,-5.75,-1.61,-4.455568981526206
NS(=O)(=O)c1ccc(N/N=C(/C=O)[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1,C40151145_decoy,TRY1,Decoy,0,-7.96187,-6.35,-1.65,-4.897049936953836
Nc1c(N2CCN(c3cccc[nH+]3)CC2)nc[nH+]c1Nc1cccnc1Cl,C40799329_decoy,TRY1,Decoy,0,-9.12603,-6.06,-0.44,-5.712524742269993
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)CC(=O)NCCOC,C43287276_decoy,TRY1,Decoy,0,-8.05241,-4.86,-1.07,-5.231515050386407
C[NH+](C)CC[NH+](C)[C@H]1[C@@H]2OC[C@@H](O2)[C@@H](NC(=O)Nc2cccc(C#N)c2)[C@@H]1O,C20463972_decoy,TRY1,Decoy,0,-6.55718,-6.38,-1.44,-6.0916244537543465
C#CCNC(=O)CC[C@H]1CNC(=O)[C@@H]2[C@@H](CC[NH+]2Cc2ccc(CO)o2)[NH+]1C,C35442533_decoy,TRY1,Decoy,0,-7.6774,-4.61,-1.71,-4.947953796768121
C[NH+]1CCC([NH2+]C[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2N2CCN(c3ncccn3)CC2)CC1,C20465087_decoy,TRY1,Decoy,0,-8.87253,-5.51,-1.7,-5.524955670017159
Cc1cc(Br)c(NC(=O)C[NH+]2CC[C@H](C[NH3+])C2)c(Br)c1,C50248526_decoy,TRY1,Decoy,0,-9.96929,-6.51,-1.8,-11.251426578000494
COc1c(Br)cc(Br)cc1C[NH2+]C1CCC([NH3+])CC1,C51694092_decoy,TRY1,Decoy,0,-8.76923,-6.8,-1.77,-9.910676595950925
COc1c(Br)cc(C[NH2+]C2CCC([NH3+])CC2)cc1Br,C51694183_decoy,TRY1,Decoy,0,-8.82942,-6.54,-0.83,-7.852495597946974
C[NH+]1CCN(CCCOc2ccccc2C[NH2+]Cc2csc(N)n2)CC1,C55270704_decoy,TRY1,Decoy,0,-7.90563,-6.67,-5.13,-6.282992784331332
C[C@H](O)C[NH2+]CC[NH2+]Cc1ccccc1OCc1ccc(Cl)cc1Cl,C22075032_decoy,TRY1,Decoy,0,-7.59601,-5.06,-2.56,-5.1443538094934524
CCCNC(=O)C[NH+]1CCC(NC(=O)NCC(C)(C)[NH+]2CCCCC2)CC1,C47911442_decoy,TRY1,Decoy,0,-8.95115,-6.08,-2.34,-6.292054070510223
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1c1ccc(Nc2ccccc2)cc1,C63515093_decoy,TRY1,Decoy,0,-7.35821,-8.35,-2.0,-6.726587290105195
NC(=O)[C@@H]1C=CS[C@H]1NC(=O)CS[C@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1,C63730946_decoy,TRY1,Decoy,0,-8.58057,-6.9,-1.8,-6.637055587296911
NC(=O)C1([NH+]2CCCCC2)CCN(C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)CC1,C63857432_decoy,TRY1,Decoy,0,-8.71917,-6.25,-1.62,-5.827016184576865
COc1ccc2c(c1)=C[C@@H](C[NH2+]C[C@@H]1c3ccccc3N(CC(N)=O)[C@@H]1C)[NH+]=2,C63868598_decoy,TRY1,Decoy,0,-8.38806,-5.73,-2.12,-4.873402249565588
C1=c2ccccc2=[NH+][C@H]1c1cccc(N2CCC([NH2+]C[C@H]3N=NNN3)CC2)c1,C64015599_decoy,TRY1,Decoy,0,-9.04992,-6.98,-0.19,-5.865049913696262
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNc1nc(CC[NH3+])nc2ccccc12,C65381219_decoy,TRY1,Decoy,0,-7.70401,-7.45,-1.58,-6.869016257836504
Cc1[nH]c[nH+]c1[C@H]1C(c2ccccc2)=NCN1CCC[NH+](CCO)CCO,C65386665_decoy,TRY1,Decoy,0,-7.33462,-4.66,-2.9,-4.715948810551359
N/C(NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1)=[NH+]\C[C@@H]1CCCO1,C66243010_decoy,TRY1,Decoy,0,-8.33283,-6.12,-1.31,-6.012003406231991
N/C(NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1)=[NH+]\C[C@H]1CCCO1,C66243012_decoy,TRY1,Decoy,0,-8.73473,-6.38,-1.19,-6.050181750780402
N/C(NCCS(=O)(=O)N1CCN(c2cccc[nH+]2)CC1)=[NH+]/Cc1ccco1,C66243086_decoy,TRY1,Decoy,0,-7.9165,-6.86,-1.59,-5.321226590954991
CC1CC[NH+](C[C@H](O)CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1,C67637433_decoy,TRY1,Decoy,0,-9.23213,-7.39,-1.54,-7.846560442705441
CNC(=O)[C@@H]1C[C@H](n2cc(-c3ccc(C[NH+]4CCC(O)CC4)cc3)nn2)C[NH2+]1,C67649455_decoy,TRY1,Decoy,0,-7.88648,-5.28,-2.67,-4.83624252728354
CNC(=O)[C@@H]1C[C@@H](n2cc(-c3ccc(C[NH+]4CC[C@@H](O)C4)cc3)nn2)C[NH2+]1,C67649472_decoy,TRY1,Decoy,0,-8.73311,-7.44,-1.32,-5.994458865289063
CC1([NH2+]C[C@H](O)COc2cccc3[nH]ccc23)CCC(C(C)(C)NC(=O)CBr)CC1,C03870330_decoy,TRY1,Decoy,0,-8.19005,-7.59,-1.13,-6.663850228664162
Nc1cc(C(F)(F)F)ccc1NCCNc1[nH+]cc(C(F)(F)F)cc1Cl,C02388245_decoy,TRY1,Decoy,0,-7.48848,-6.09,-2.26,-6.254731065982436
CNC(=S)NNC(=O)C1=NO[C@H](CNc2[nH+]cc(C(F)(F)F)cc2Cl)C1,C05209254_decoy,TRY1,Decoy,0,-9.7774,-5.86,-2.11,-5.540778698234316
Nc1nonc1C(=O)NCC[NH2+]Cc1ccccc1OCc1ccc(Cl)cc1,C05324136_decoy,TRY1,Decoy,0,-8.68817,-6.74,-2.34,-7.279790858672246
COc1ccc(O)cc1OCC[NH2+]C[C@H](O)COc1cccc2[nH]c3ccccc3c12,C02528510_decoy,TRY1,Decoy,0,-7.8402,-8.49,-3.44,-6.812449179650431
C[C@@H](O)c1ccc(-c2ccc(C[NH2+]CCc3ccc(S(N)(=O)=O)cc3)o2)cc1,C07541052_decoy,TRY1,Decoy,0,-8.73607,-8.14,-2.6,-7.312270355698342
OCC(CO)(CO)[NH2+]C[C@@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C10384381_decoy,TRY1,Decoy,0,-8.85824,-6.63,-1.33,-6.477152957872104
CC[NH+](CC(=O)Nc1sccc1C(N)=O)CC(=O)Nc1c(F)cccc1F,C12756028_decoy,TRY1,Decoy,0,-8.45527,-6.84,-1.21,-8.060479271761311
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(Cl)cc3)C[NH+]12)NCc1cccs1,C15708033_decoy,TRY1,Decoy,0,-9.71545,-7.99,-1.5,-7.8237828982931985
Cc1nnc(SCc2cc(=O)nc(NC(=[NH2+])Nc3cccc(Cl)c3C)[nH]2)s1,C20503603_decoy,TRY1,Decoy,0,-10.2794,-7.04,-2.94,-6.441475656392187
CCC[NH+](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)CC(=O)Nc1ccc(F)c(F)c1F,C21920359_decoy,TRY1,Decoy,0,-8.12847,-7.38,-3.54,-6.546083229149847
Oc1ccc(Br)cc1CNCC[NH2+]Cc1cc(Br)ccc1O,C22937618_decoy,TRY1,Decoy,0,-9.23581,-6.51,-1.25,-6.014772659592553
Cc1ccccc1[C@H](OC[C@H](O)C[NH2+][C@@H](C)[C@H](O)c1ccc(O)cc1)c1ccccc1,C37308270_decoy,TRY1,Decoy,0,-9.10238,-7.65,-3.01,-8.076932335767983
CC1=NN[C@@H](SCc2cc(=O)nc(NC(=[NH2+])Nc3cccc(Cl)c3)[nH]2)S1,C38964318_decoy,TRY1,Decoy,0,-10.2946,-5.82,-1.98,-5.872840627526994
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@H]1NN[C@@H](SCc2ccc(Cl)c(Cl)c2)O1,C38965851_decoy,TRY1,Decoy,0,-8.48527,-5.03,-2.02,-5.407231704755056
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@H]1NN[C@@H](SCc2c(F)cccc2Cl)O1,C38966459_decoy,TRY1,Decoy,0,-8.70029,-5.9,-1.92,-6.351043032080404
COc1ccc2c(CCNC(=O)CS[C@H]3N[NH2+]NN3c3cc(Cl)ccc3C)c[nH]c2c1,C39024776_decoy,TRY1,Decoy,0,-9.94505,-6.99,-2.15,-7.0701183630095645
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@H](C)ON1,C39597941_decoy,TRY1,Decoy,0,-7.54003,-6.91,-1.57,-5.809599875013828
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39661748_decoy,TRY1,Decoy,0,-7.58802,-9.19,-1.63,-7.430794538047395
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39661802_decoy,TRY1,Decoy,0,-9.2558,-7.4,-2.96,-6.472668319228057
O=c1cc(CS[C@H]2N[NH2+]NN2c2ccc3c(c2)OCCO3)c2ccccc2[nH]1,C39697698_decoy,TRY1,Decoy,0,-8.25149,-8.48,-2.15,-7.000885749162705
CC(C)[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(C(C)(C)C)cc1,C40002679_decoy,TRY1,Decoy,0,-7.8408,-6.37,-1.12,-4.921627600526852
CC1(C)CC(Nc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2N)CC(C)(C)[NH2+]1,C40704089_decoy,TRY1,Decoy,0,-9.66415,-6.07,-2.77,-5.511802857399879
CC(C)Oc1c(Br)cc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C40744468_decoy,TRY1,Decoy,0,-9.07927,-6.95,-1.51,-8.496082516869471
Nc1nonc1C(=O)NCC[NH2+]Cc1cc(Br)ccc1OCc1ccc(F)cc1Cl,C40744519_decoy,TRY1,Decoy,0,-8.80607,-7.52,-3.18,-7.752950472214372
Nc1nonc1C(=O)NCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(F)cc1Cl,C40744545_decoy,TRY1,Decoy,0,-9.25183,-8.06,-2.72,-8.57460037897489
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1ccc(Oc2ccccc2)cc1,C40756482_decoy,TRY1,Decoy,0,-8.72922,-6.32,-1.24,-4.692761624280618
CC1(C)CC(Nc2ncnc(Nc3ccc(Cl)cc3Cl)c2N)CC(C)(C)[NH2+]1,C40760776_decoy,TRY1,Decoy,0,-9.73561,-6.62,-2.8,-5.661665357896014
Cc1ccc2c(Nc3ncnc(Nc4nc5ccccc5s4)c3N)cccc2[nH+]1,C40761227_decoy,TRY1,Decoy,0,-7.74842,-8.54,-3.31,-8.043345864803799
Cc1ccc(CNc2nc[nH+]c(NN(c3ccccc3)c3ccccc3)c2N)cc1,C40777814_decoy,TRY1,Decoy,0,-8.1007,-5.88,-1.31,-5.181530652622599
CC1(C)C[C@H]([NH2+]C2CCC2)[C@@]2(CCC(=O)NCCc3c[nH]c4ccccc34)CC[C@](C)(O)C[C@@H]12,C12531503_decoy,TRY1,Decoy,0,-9.32379,-8.54,-1.75,-8.36516434181749
CC1(C)C[C@H]([NH2+]C2CCC2)[C@]2(CCC(=O)NCCc3c[nH]c4ccccc34)CC[C@](C)(O)C[C@@H]12,C43547783_decoy,TRY1,Decoy,0,-9.73664,-8.38,-3.4,-8.101902748778512
CCOc1ccc(Nc2c(C)c(N[C@H]3CCC[C@H]([NH3+])C3)c(C#N)c3ccnn23)cc1,C45254349_decoy,TRY1,Decoy,0,-8.90169,-6.46,-1.44,-6.568243149688704
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NC1CC[NH+](CC(N)=O)CC1,C45891039_decoy,TRY1,Decoy,0,-8.94546,-7.08,-1.85,-6.080455803073616
CC(C)([NH2+]CC(=O)Nc1sccc1C(N)=O)c1ccc(Br)cc1,C47258130_decoy,TRY1,Decoy,0,-8.38505,-7.11,-0.79,-9.998638963990908
Cc1cc(C2=[NH+][C@H](C)CN2)cc2[nH]c([C@H]3C(=O)N=CC=C3NC[C@H](O)c3cccc(Cl)c3)nc12,C52634750_decoy,TRY1,Decoy,0,-8.74793,-7.35,-3.58,-8.92803365462265
NC(=O)CCn1cc(C[NH2+]CCNC(=O)c2ccccc2Cl)c2ccccc21,C55393568_decoy,TRY1,Decoy,0,-8.22787,-7.64,-2.67,-7.417297149198033
C[C@H](CNC(=O)Nc1ccccc1SCC(N)=O)[NH+]1CCc2ccccc2C1,C45694765_decoy,TRY1,Decoy,0,-8.23974,-7.81,-1.76,-5.911181621219357
C[NH+](C)[C@@H](CNC(=O)NCCc1ccc(S(N)(=O)=O)s1)c1cccs1,C43145400_decoy,TRY1,Decoy,0,-9.68156,-6.03,-3.03,-5.931905906473769
CSCC[C@@H](NC(N)=O)C(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C41399602_decoy,TRY1,Decoy,0,-8.41496,-6.67,-1.66,-7.883621147310955
Nc1nc(SCC(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2ccc(Cl)cc2Cl)n[nH]1,C63234346_decoy,TRY1,Decoy,0,-9.61293,-7.13,-1.58,-7.740614901455026
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)NC(N)=O,C64055454_decoy,TRY1,Decoy,0,-9.48051,-8.19,-2.37,-12.296320483707158
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C67380624_decoy,TRY1,Decoy,0,-8.46143,-6.03,-2.53,-5.478636644009288
CC(=O)Nc1ccc(NC(=O)/C=C(\C)NNC(=O)C(=O)Nc2cccc(Cl)c2C)cc1,C03088339_decoy,TRY1,Decoy,0,-9.82067,-6.11,-2.42,-5.505583382441129
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C04252701_decoy,TRY1,Decoy,0,-7.48495,-8.27,-2.26,-8.968527069570884
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@H]1CCCO1)c1ccc(F)cc1,C06860599_decoy,TRY1,Decoy,0,-7.91621,-6.83,-1.33,-6.839487738602628
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O,C08602675_decoy,TRY1,Decoy,0,-7.23304,-8.44,-3.52,-9.81392769543385
[NH3+][C@@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@@H]12)c1ccc(O)cc1,C11616776_decoy,TRY1,Decoy,0,-8.01222,-6.86,-1.3,-5.116998651168036
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1,C12473256_decoy,TRY1,Decoy,0,-8.41481,-7.43,-2.15,-7.760955987694137
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1,C12477086_decoy,TRY1,Decoy,0,-7.10943,-6.81,-1.78,-7.227936593106388
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccco2)c1,C12478000_decoy,TRY1,Decoy,0,-8.41927,-5.86,-2.01,-6.761423314044261
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(Cl)cc2)o1,C12704038_decoy,TRY1,Decoy,0,-8.29737,-5.35,-3.81,-5.77448917010289
C[C@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C12715222_decoy,TRY1,Decoy,0,-7.90718,-7.17,-2.27,-9.514456035331811
C[C@@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C12715228_decoy,TRY1,Decoy,0,-7.52503,-6.98,-0.09,-7.990172607628387
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1,C12716060_decoy,TRY1,Decoy,0,-8.02455,-8.61,-3.58,-8.589786476151797
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(=O)oc2c1C,C12896810_decoy,TRY1,Decoy,0,-7.84965,-5.69,-3.21,-5.246055903651434
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C13521018_decoy,TRY1,Decoy,0,-8.14557,-8.49,-1.43,-9.451961418438527
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C13521027_decoy,TRY1,Decoy,0,-7.93605,-8.17,-3.85,-10.647809690486046
O=C1c2cccc3c(NC(CO)(CO)CO)ccc(c23)C(=O)N1/N=C\c1ccccc1O,C16449496_decoy,TRY1,Decoy,0,-7.57336,-6.01,-2.59,-5.041868798294385
COc1ccccc1-c1nnc(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)n1N,C16622178_decoy,TRY1,Decoy,0,-7.9899,-6.79,-1.92,-6.34215413143513
COc1ccc(-c2nnc(SCc3nc(N)nc(Nc4ccc(F)cc4)n3)n2N)cc1,C16630177_decoy,TRY1,Decoy,0,-8.37821,-6.85,-1.74,-5.680176351065839
CC(=O)N[C@@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177622_decoy,TRY1,Decoy,0,-11.2904,-5.51,-1.62,-8.026755548331568
Nn1c(N/N=C/c2ccc(O)cc2)nnc1SCC(=O)Nc1cc(Cl)ccc1Cl,C20528352_decoy,TRY1,Decoy,0,-10.2971,-8.91,-2.85,-9.7741002752626
COc1ccc(O[C@H]2O[C@@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1OC,C31155362_decoy,TRY1,Decoy,0,-6.26836,-8.1,-2.16,-6.601177200544456
COc1ccc(O[C@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1OC,C31155372_decoy,TRY1,Decoy,0,-6.12349,-7.3,-3.54,-5.221542333388958
O=C(OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1)c1ccc(O)c(O)c1,C31165201_decoy,TRY1,Decoy,0,-7.73313,-8.15,-4.8,-6.269472296493779
COc1cc2oc(=O)ccc2cc1[C@@H](O)[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31167994_decoy,TRY1,Decoy,0,-6.58276,-8.08,-3.2,-5.582372892394466
Cc1ccc(C)c([C@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(C(C)(C)C)C(=O)[C@@H]23)c1,C33703758_decoy,TRY1,Decoy,0,-6.71611,-6.97,-1.05,-6.552297495303322
COc1cc(O)c2c(=O)c(-c3ccc(O[C@H](OCCO)[C@@H](O)[C@H](O)[C@H](C)O)cc3)coc2c1,C34898308_decoy,TRY1,Decoy,0,-8.60125,-7.95,-2.53,-6.3174748984785225
COc1ccc(O[C@@H]2O[C@@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@@H]2O)cc1OC,C35454769_decoy,TRY1,Decoy,0,-6.04925,-7.77,-1.71,-6.447194634482624
COc1ccc(O[C@@H]2O[C@@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1OC,C35454777_decoy,TRY1,Decoy,0,-6.8946,-6.59,-3.2,-6.132943977159973
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)[C@H]([NH3+])CCC(=O)[O-],C35806146_decoy,TRY1,Decoy,0,-8.76489,-5.92,-3.04,-5.517811847983462
O=C(CCc1ccc(O)c(O)c1)NNC(=S)Nc1ccc(Br)cc1Cl,C13544957_decoy,TRY1,Decoy,0,-8.71178,-8.06,-1.98,-7.279977062979146
O=C(CCc1ccc(O)cc1)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C31166407_decoy,TRY1,Decoy,0,-8.49929,-8.51,-3.08,-9.799238573463953
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C03875408_decoy,TRY1,Decoy,0,-7.76371,-7.62,-2.62,-7.930819391121574
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C03874669_decoy,TRY1,Decoy,0,-7.25084,-8.0,-3.57,-7.728314407658363
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C08681548_decoy,TRY1,Decoy,0,-7.94447,-8.15,-0.82,-7.197323256159847
CC(C)c1ccccc1NC(=O)CS[C@H]1NN[C@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C38990026_decoy,TRY1,Decoy,0,-8.54169,-9.58,-1.85,-7.471576833287759
COc1ccc(C)cc1NC(=O)CS[C@H]1NN[C@@H]([C@@H]2C=C(c3ccc(C)cc3)N=N2)N1N,C39016558_decoy,TRY1,Decoy,0,-9.55765,-9.0,-1.47,-8.225911110979958
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC2CCCC2)cc1,C06190830_decoy,TRY1,Decoy,0,-9.01361,-5.63,-0.77,-6.404851433915438
NC(=O)c1c(Nc2nc(NCCO)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026342_decoy,TRY1,Decoy,0,-9.12137,-7.44,-3.56,-8.000138132819588
Cc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cc2ccccc2o1,C43221926_decoy,TRY1,Decoy,0,-8.08436,-7.57,-1.49,-7.517288543750484
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C43465394_decoy,TRY1,Decoy,0,-5.79763,-8.07,-1.24,-9.06919967366197
COC(=O)[C@H](NC(=O)[C@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(C)cc2)C1)C(C)C,C43537163_decoy,TRY1,Decoy,0,-8.76505,-6.44,-2.45,-6.852501144926559
CCCCCCNc1nc2c(N)ncnc2n1[C@@H]1O[C@@H]2CO[P@@](O)(=S)O[C@H]2[C@H]1O,C43764011_decoy,TRY1,Decoy,0,-7.51436,-8.37,-3.68,-8.719909404490043
CCCCCCNc1nc2c(N)ncnc2n1[C@@H]1O[C@@H]2CO[P@](O)(=S)O[C@H]2[C@H]1O,C43764012_decoy,TRY1,Decoy,0,-7.80848,-8.26,-1.49,-9.88175620601188
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](O[C@H]2CCCC[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C49601728_decoy,TRY1,Decoy,0,-8.98406,-6.95,-1.57,-6.457607982027991
NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1,C16218234_decoy,TRY1,Decoy,0,-9.32446,-7.56,-2.26,-6.633031982893402
COc1cc(N)c(Cl)cc1C(=O)O[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C58154023_decoy,TRY1,Decoy,0,-10.4048,-7.89,-2.62,-7.852824101032261
CC1=C2C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)S[C@@H]2N(Cc2ccc(C)cc2)N1,C39937700_decoy,TRY1,Decoy,0,-9.30715,-8.71,-1.55,-8.612446948330055
O=C([O-])[C@H](CO)NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64020235_decoy,TRY1,Decoy,0,-6.95917,-7.46,-1.81,-7.363242139000379
O=C([O-])[C@H](CO)NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64137026_decoy,TRY1,Decoy,0,-6.78912,-6.84,-2.58,-5.587108536117043
CC1(C)CC([NH2+][C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)=CC(=[N+]2CCCCC2)C1,C03171299_decoy,TRY1,Decoy,0,-7.67823,-5.43,-1.21,-5.84839815573054
COc1ccc(OC[C@H](O)C[NH+](C)C)c(C[NH2+]CCc2ccccc2Cl)c1,C11813412_decoy,TRY1,Decoy,0,-7.7245,-4.37,-1.92,-5.141695199213827
COc1ccc(C[NH2+]CCCSC)c(OC[C@H](O)C[NH+]2CCCC2)c1,C11842381_decoy,TRY1,Decoy,0,-8.78158,-5.63,-2.71,-7.3887571462784765
COc1cccc(C[NH2+]CCCSC)c1OC[C@@H](O)C[NH+]1CCOCC1,C11842725_decoy,TRY1,Decoy,0,-7.82752,-5.52,-2.11,-7.740804077121979
O[C@H](COc1ccccc1C[NH2+]CCOc1cccnc1)C[NH+]1CCCCC1,C11843962_decoy,TRY1,Decoy,0,-6.94814,-6.86,-1.44,-7.69205349877965
O[C@@H](COc1ccc(C[NH2+]CCCn2cccn2)cc1)C[NH+]1CCCCC1,C11874894_decoy,TRY1,Decoy,0,-8.12975,-5.5,-3.34,-5.348565878393074
O=C1CCCN1CCC[NH2+]Cc1ccccc1OC[C@H](O)C[NH+]1CCCCC1,C11934172_decoy,TRY1,Decoy,0,-8.35491,-5.13,-2.6,-5.522371162493559
C[NH+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH2+]CCn2cccn2)cc1,C12054360_decoy,TRY1,Decoy,0,-7.27379,-6.84,-2.95,-6.054845376647135
O[C@@H](COc1ccccc1C[NH2+]CCOc1ccccc1)C[NH+]1CCSCC1,C12073406_decoy,TRY1,Decoy,0,-6.32524,-6.13,-1.55,-5.949210558408576
CSCCC[NH2+]Cc1cccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)c1,C12386562_decoy,TRY1,Decoy,0,-9.44804,-5.22,-2.32,-6.094033070435677
COc1ccc(OC[C@@H](O)C[NH+](C)C)c(C[NH2+]CCc2cccc(F)c2)c1,C12430624_decoy,TRY1,Decoy,0,-8.30161,-6.0,-1.83,-8.736436970131258
O[C@H](COc1ccccc1C[NH2+]CCCOc1cccnc1)C[NH+]1CCCCC1,C12431982_decoy,TRY1,Decoy,0,-8.41537,-6.39,-5.37,-8.090069852800127
COc1ccc(C[NH2+]CCOc2ccccc2)c(OC[C@@H](O)C[NH+]2CCCC2)c1,C12432646_decoy,TRY1,Decoy,0,-8.17396,-5.83,-4.7,-7.032616550374851
C[NH+](C[C@H](O)COc1ccccc1C[NH2+]CCc1ccncc1)C1CCCCC1,C12318078_decoy,TRY1,Decoy,0,-8.073,-7.39,-1.88,-6.771177957495431
CSCCC[NH2+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCc2ccccc2C1,C12458915_decoy,TRY1,Decoy,0,-8.28794,-6.66,-3.72,-7.299064635649661
O[C@H](COc1ccccc1C[NH2+]CCCc1ccccc1)C[NH+]1CCSCC1,C12575432_decoy,TRY1,Decoy,0,-8.09199,-5.74,-2.04,-5.393938244509539
COc1ccccc1CC[NH2+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCCCC1,C12752889_decoy,TRY1,Decoy,0,-8.33005,-5.53,-3.85,-6.462127899564349
Cc1nccn1CCC[NH2+]Cc1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1,C12317140_decoy,TRY1,Decoy,0,-8.32377,-5.1,-2.17,-4.821820074899054
CSCCC[NH2+]Cc1ccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)cc1,C11662823_decoy,TRY1,Decoy,0,-8.72849,-5.23,-2.18,-5.870565785736519
O[C@@H](COc1ccccc1C[NH2+]CCCc1cccnc1)C[NH+]1CCSCC1,C15065304_decoy,TRY1,Decoy,0,-8.84326,-6.04,-3.41,-6.419143310244742
O[C@H](COc1ccccc1C[NH2+]CCCc1cccnc1)C[NH+]1CCSCC1,C15065305_decoy,TRY1,Decoy,0,-9.58807,-5.4,-2.23,-6.596969191298751
COc1ccc(C[NH2+]CCSC)c(OC[C@H](O)C[NH+]2CCCCCCC2)c1,C15066580_decoy,TRY1,Decoy,0,-9.06968,-6.54,-3.61,-7.514975276688149
CSCCC[NH2+]Cc1cccc(OC[C@@H](O)C[NH+](C)C2CCCCC2)c1,C15069372_decoy,TRY1,Decoy,0,-9.73179,-6.02,-1.37,-6.046187857224719
C[NH+](C)CC(C)(C)C[NH2+]Cc1cccc(OC[C@@H](O)CN2CCOCC2)c1,C20600992_decoy,TRY1,Decoy,0,-7.66035,-5.58,-1.38,-5.236757504854774
CC[NH+](CC)CCC[n+]1cnc2c(c1N)[C@@H](c1ccco1)c1ccc(O)cc1O2,C35392062_decoy,TRY1,Decoy,0,-7.27291,-6.95,-2.87,-5.992090661526936
COc1ccc([C@H]2c3ccc(O)cc3Oc3nc[n+](CCC[NH+](C)C)c(N)c32)cc1,C35392229_decoy,TRY1,Decoy,0,-7.44005,-5.76,-1.44,-5.542465402183265
CC[NH+](CC)CC[n+]1cnc2c(c1N)[C@H](c1ccccc1)c1ccc(O)cc1O2,C35769684_decoy,TRY1,Decoy,0,-6.59977,-6.33,-1.5,-6.528752897477458
C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]Cc2cccnc2)cc1,C12297317_decoy,TRY1,Decoy,0,-8.34353,-5.64,-2.68,-5.128420874322731
CC[NH+](CC)CC[n+]1c(N)n(C[C@H](O)COc2ccccc2C)c2ccccc21,C36013460_decoy,TRY1,Decoy,0,-8.19978,-6.21,-1.86,-6.158560023915869
COc1ccccc1[C@H](C[NH2+]C[C@H](O)COc1ccc(C#N)cc1)[NH+](C)C,C23248960_decoy,TRY1,Decoy,0,-7.3443,-6.58,-1.44,-6.234870309154705
COc1ccc(C[NH2+]CCCSC)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C23359684_decoy,TRY1,Decoy,0,-8.60562,-6.16,-2.85,-7.14949161137232
COc1ccc([C@H](C[NH2+]C[C@@H](O)COCC2=CC[C@@H]3C[C@H]2C3(C)C)[NH+](C)C)cc1,C22041663_decoy,TRY1,Decoy,0,-8.89773,-2.48,-2.24,-5.286966015213978
Nc1n(C[C@H](O)COc2ccc(Cl)cc2)c2ccccc2[n+]1CC[NH+]1CCCC1,C40151075_decoy,TRY1,Decoy,0,-8.54859,-5.97,-0.96,-5.9633833909106615
C[NH+](C)Cc1ccccc1CNC(=O)C(=O)Nc1ccccc1C[NH+]1CCCC1,C49269430_decoy,TRY1,Decoy,0,-8.10715,-7.67,-3.71,-7.021889143135857
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H]([NH2+]Cc3cccs3)C[NH+]12,C22936962_decoy,TRY1,Decoy,0,-7.1883,-5.75,-3.83,-5.044603821292218
CC(=O)NCC1CC[NH+](CC(=O)NC[C@@H]2CC[NH+](CC(F)(F)F)C2)CC1,C51856583_decoy,TRY1,Decoy,0,-8.19384,-5.71,-3.14,-6.108841119007958
CC(=O)NCC1CC[NH+](CC(=O)NC[C@H]2CC[NH+](CC(F)(F)F)C2)CC1,C51856584_decoy,TRY1,Decoy,0,-8.28796,-5.79,-3.66,-6.39041593890437
CC[NH+]1CCN(C[C@@H](O)COc2cccc(CNCC(C)(C)C[NH+](C)C)c2)CC1,C20600790_decoy,TRY1,Decoy,0,-8.53122,-6.03,-3.73,-6.180625373821001
CCN(CC)c1ccc(C(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)c(O)c1,C65060382_decoy,TRY1,Decoy,0,-9.057,-5.87,-1.74,-6.18520289192133
FC(F)(F)c1cccc(N2CC[NH+](CCCCNC3=[NH+]CCCN3)CC2)c1,C66242912_decoy,TRY1,Decoy,0,-7.74535,-5.44,-2.46,-4.402452891976836
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NCCCC[NH+]1CCN(CC)CC1,C66597631_decoy,TRY1,Decoy,0,-8.61588,-6.32,-2.93,-7.062832539401773
COc1ccc(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)cc1OCCCC#N,C67122125_decoy,TRY1,Decoy,0,-7.77364,-4.96,-3.38,-5.189704621251286
CCOc1c(OC)cc(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)cc1OC,C67122364_decoy,TRY1,Decoy,0,-7.3795,-5.88,-2.14,-6.375450825397544
Cc1nc(COc2ccc(C[NH2+]C[C@@H](O)C[NH+]3CCC(C)CC3)cc2)cs1,C67122401_decoy,TRY1,Decoy,0,-8.86258,-6.4,-4.24,-5.459749763406569
Cc1nn(CCO)c(C)c1C[NH2+]Cc1ccc(C[NH+]2CCC[C@@H](C)C2)cc1,C67188319_decoy,TRY1,Decoy,0,-6.83592,-6.45,-3.74,-4.909325048746018
CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1c(C)nn(CCO)c1C,C67189291_decoy,TRY1,Decoy,0,-7.67115,-6.19,-4.55,-7.978876466607661
O[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)COc1cccc(F)c1,C67224424_decoy,TRY1,Decoy,0,-7.39686,-6.98,-2.18,-6.095255542137866
O[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)COc1cccc(F)c1,C67224426_decoy,TRY1,Decoy,0,-7.664,-6.8,-1.4,-6.808321540618253
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NC[C@@H](C)[NH+]3CCC(C)CC3)c2C1,C67557543_decoy,TRY1,Decoy,0,-8.93356,-7.16,-2.72,-6.106673524821302
CC[NH+](CC)[C@H](C)CNC(=O)[C@H]1CCC[C@H](C(=O)NC[C@H](C)[NH+](CC)CC)C1,C67573692_decoy,TRY1,Decoy,0,-8.80683,-5.32,-1.71,-7.223351980984204
COc1ccc([C@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2CC[NH2+]CCO)cc1,C06621650_decoy,TRY1,Decoy,0,-7.64586,-5.63,-1.01,-5.622037009373009
CCCn1c(N)c(C(=O)C[NH+](CC)C[C@H]2COc3ccccc3O2)c(=O)[nH]c1=O,C16628219_decoy,TRY1,Decoy,0,-6.87319,-7.19,-2.82,-5.869308155505288
C[C@@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)C[C@@H](O)COc1ccc(Cl)cc1,C21307544_decoy,TRY1,Decoy,0,-7.52084,-5.38,-1.47,-5.113034824796711
CCc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(C[C@@H]3CCCO3)CC2)n1,C22786387_decoy,TRY1,Decoy,0,-7.92835,-7.7,-1.68,-8.085899211335922
CCc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(C[C@H]3CCCO3)CC2)n1,C22786395_decoy,TRY1,Decoy,0,-7.12389,-6.36,-1.48,-7.286274271112159
CSCC[C@H]([NH3+])c1nc(C(=O)N[C@@H](C)c2ccc(Br)cc2)co1,C33716662_decoy,TRY1,Decoy,0,-8.75073,-6.53,-1.34,-6.766983745477403
COc1cc(C[NH+]2CCC(NC(=O)c3nccnc3NC(=O)C3CCCCC3)CC2)ccc1O,C35896883_decoy,TRY1,Decoy,0,-8.18087,-8.32,-2.34,-6.706214160495095
O=C1c2ccccc2-c2c1cccc2C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601583_decoy,TRY1,Decoy,0,-7.46843,-5.96,-2.02,-5.2500574625405525
O=C1c2ccccc2-c2c1cccc2C(=O)N1C[C@@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601585_decoy,TRY1,Decoy,0,-8.60238,-8.51,-1.76,-6.935475481364127
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1,C39631124_decoy,TRY1,Decoy,0,-8.10982,-7.01,-1.7,-7.074045780458039
CCCCC(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631208_decoy,TRY1,Decoy,0,-8.96155,-5.6,-1.96,-6.574663643423741
CCCCC(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631212_decoy,TRY1,Decoy,0,-9.30546,-6.45,-3.05,-6.78698339715478
CC[C@@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631474_decoy,TRY1,Decoy,0,-8.20458,-6.09,-1.27,-6.054957459126743
CC[C@@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631478_decoy,TRY1,Decoy,0,-8.81289,-6.42,-2.25,-6.41545414186592
Cn1c(=O)n(C)c2cc([C@H](O)COc3ccc(C[NH2+]CCCCO)cc3)ccc21,C40744147_decoy,TRY1,Decoy,0,-7.61938,-6.6,-3.52,-5.154139499382116
CC(C)CCNc1ncnc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1N,C40797803_decoy,TRY1,Decoy,0,-8.38368,-5.72,-2.21,-5.2457116821849645
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NCc2cc[nH+]c(N(C)C)c2)cc1,C41607704_decoy,TRY1,Decoy,0,-8.59094,-8.04,-4.28,-7.545486164062912
NC(=O)COc1ccc(/C=C/C(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cc1,C53373730_decoy,TRY1,Decoy,0,-9.63548,-6.82,-1.74,-5.786376104915975
C[C@@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)C[C@H](O)COc1ccc(Cl)cc1,C53400634_decoy,TRY1,Decoy,0,-8.8832,-7.31,-1.83,-5.813553835693158
COc1ccccc1[C@H](CNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[NH+](C)C,C54042196_decoy,TRY1,Decoy,0,-8.05236,-5.11,-2.62,-6.016118111619448
COc1ccccc1[C@@H](CNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[NH+](C)C,C54042198_decoy,TRY1,Decoy,0,-7.38877,-5.92,-1.22,-5.747619852293987
COc1ccccc1[C@H](CNC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)[NH+](C)C,C54042200_decoy,TRY1,Decoy,0,-8.08948,-5.29,-3.12,-5.6484286462337625
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NCC[NH+]2C[C@H](C)C[C@H](C)C2)cc1,C54581427_decoy,TRY1,Decoy,0,-7.46161,-6.31,-1.49,-5.511980786216164
COc1ccccc1CC(=O)NNC(=O)NCc1ccccc1C[NH+]1CCCC1,C56578563_decoy,TRY1,Decoy,0,-7.76228,-7.33,-3.14,-6.260267362482746
NS(=O)(=O)c1ccc(CC[NH2+][C@H]2CC(=O)N(Cc3ccc4c(c3)OCO4)C2=O)cc1,C58951336_decoy,TRY1,Decoy,0,-8.2174,-5.64,-2.56,-5.316668641585908
NS(=O)(=O)c1ccc(NC(=O)C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1,C59386639_decoy,TRY1,Decoy,0,-8.17318,-5.85,-2.94,-4.91906209413687
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)C1,C53404576_decoy,TRY1,Decoy,0,-8.25086,-5.82,-2.65,-5.366996864727344
Cc1ccc([C@@H](CNC(=O)c2ccccc2SCC(N)=O)[NH+]2CCCC2)cc1,C61503064_decoy,TRY1,Decoy,0,-8.53056,-5.52,-1.21,-5.503737826937034
CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)c[nH+]1,C62062423_decoy,TRY1,Decoy,0,-9.0982,-6.6,-1.54,-6.932756092190175
COc1cc(C[NH2+]Cc2ccccc2-n2cccn2)cc(OC)c1OCC(N)=O,C62425903_decoy,TRY1,Decoy,0,-8.56576,-6.16,-3.89,-5.906077702393262
Cc1nc(SCC(=O)NCCC2=c3ccccc3=[NH+]C2)c(C(N)=O)c(C)c1C,C63069311_decoy,TRY1,Decoy,0,-7.39031,-8.11,-2.86,-7.387029668929896
COc1ccc2c(c1)=C(CCNC(=O)CCC1=C(C)Nc3ncnn3[C@@H]1O)C[NH+]=2,C63329005_decoy,TRY1,Decoy,0,-8.81436,-7.72,-1.81,-6.957012487439887
CCOc1ccc(OCC)c(/[NH+]=c2\oc3c(C)ncc(CO)c3cc2C(N)=O)c1,C13147521_decoy,TRY1,Decoy,0,-7.6321,-6.64,-3.2,-5.993953237194017
CC[NH+](CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)[C@H](C)c1cc2ccccc2o1,C64348882_decoy,TRY1,Decoy,0,-7.55255,-7.06,-1.73,-5.982956515979771
C[C@@H](CC(=O)NNC(=O)NCCCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1,C64885707_decoy,TRY1,Decoy,0,-6.84819,-7.57,-1.56,-5.692531211014826
O=C(CCCc1ccc(Cl)c(Cl)c1)NNC(=O)NCCCn1cc[nH+]c1,C64885857_decoy,TRY1,Decoy,0,-9.15149,-6.94,-1.7,-6.944543958838797
CCOc1c(Cl)cc(C(=O)NNC(=O)NCCCn2cc[nH+]c2)cc1OC,C64886903_decoy,TRY1,Decoy,0,-7.05212,-6.62,-3.94,-5.651261971313879
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NC[C@H](C)C[NH+]2CCCCC2)cc1,C54579763_decoy,TRY1,Decoy,0,-8.55065,-6.26,-3.49,-5.949560994817503
CC[NH+](CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)[C@@H](C)c1cc2ccccc2o1,C66434210_decoy,TRY1,Decoy,0,-6.70871,-7.82,-0.91,-6.880522865462351
CCCOc1c(Cl)cc(C(=O)N[C@H]2CCC[NH+](CC(N)=O)C2)cc1OCC,C66450243_decoy,TRY1,Decoy,0,-8.57015,-5.93,-1.27,-5.628157145273372
NS(=O)(=O)c1cnc(NCCC[NH+]2CCN(c3ccccc3F)CC2)s1,C66468262_decoy,TRY1,Decoy,0,-8.87768,-7.04,-2.76,-6.0790152888437765
C=CC[NH+](CC(=O)Nc1ccccc1SCC(N)=O)[C@@H]1CCS(=O)(=O)C1,C66559493_decoy,TRY1,Decoy,0,-7.41346,-6.64,-2.08,-7.585105862681903
C[NH+]1CCN(c2ncccc2CNC(=O)NC[C@@H](O)COc2ccccc2)CC1,C66986393_decoy,TRY1,Decoy,0,-6.7614,-6.22,-1.65,-5.168150311983588
C[NH+](C)[C@@H](CNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)c1ccsc1,C67160994_decoy,TRY1,Decoy,0,-10.0212,-5.49,-1.42,-6.126720965601779
C[NH+](CCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)CC(F)(F)F,C67164492_decoy,TRY1,Decoy,0,-8.62015,-5.47,-2.46,-5.613494453838404
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)C1,C67165571_decoy,TRY1,Decoy,0,-8.2509,-6.33,-2.64,-5.656988843595955
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)C1,C67233019_decoy,TRY1,Decoy,0,-8.58423,-6.5,-1.9,-5.956796179822113
COc1cc(CN[C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)cc(Cl)c1OCC(N)=O,C67251450_decoy,TRY1,Decoy,0,-8.54614,-6.5,-2.51,-5.980920365175772
COCCOc1c(Cl)cccc1NC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67550334_decoy,TRY1,Decoy,0,-9.21309,-6.52,-1.86,-7.439407781641557
C[C@H]1CCC[C@](CNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)([NH+](C)C)C1,C67612890_decoy,TRY1,Decoy,0,-9.8608,-5.82,-2.07,-6.201599642672151
CCOc1ccc2[nH]c(=O)c(CN(CCCO)C(=S)Nc3ccc(C)cc3)cc2c1,C04127696_decoy,TRY1,Decoy,0,-8.76382,-7.15,-2.03,-6.511183637793352
COc1ccc2cc(CN(CCO)C(=S)NCCc3ccccc3)c(=O)[nH]c2c1,C04133113_decoy,TRY1,Decoy,0,-8.55605,-7.58,-2.08,-6.601847290647104
COc1ccc2cc(CN(CCCO)C(=S)Nc3ccc(C)cc3)c(=O)[nH]c2c1,C04127714_decoy,TRY1,Decoy,0,-8.80788,-6.65,-0.97,-6.187136453164983
COc1ccc2[nH]c(=O)c(CN(CCCO)C(=S)Nc3ccc(F)cc3)cc2c1,C04133230_decoy,TRY1,Decoy,0,-7.87804,-6.32,-1.22,-5.738192820990336
C[C@@H](NC(=S)NNC(=O)Cn1ncc2ccccc2c1=O)c1ccc(F)cc1,C04593391_decoy,TRY1,Decoy,0,-6.60423,-8.03,-1.95,-6.142215821061211
O=C(CF)N[C@H](NC(=S)Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl,C05127443_decoy,TRY1,Decoy,0,-6.67576,-5.88,-1.35,-5.190104544610733
NC(=O)c1ccsc1NC(=O)COC(=O)c1ccc(C2SCCS2)cc1,C05584660_decoy,TRY1,Decoy,0,-8.99629,-6.33,-1.46,-6.875643079475491
CCOc1ccc2[nH]c(=O)c(CN(CCCO)C(=S)Nc3ccc(F)cc3)cc2c1,C06196600_decoy,TRY1,Decoy,0,-8.08132,-7.36,-1.34,-8.11162655683532
O=C(CNc1ccccc1C(=O)NCc1ccccc1)N[C@H]1CCS(=O)(=O)C1,C08160741_decoy,TRY1,Decoy,0,-7.41609,-7.07,-2.0,-7.390661535472151
NC(=O)COC(=O)CNS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C11307225_decoy,TRY1,Decoy,0,-7.05623,-5.8,-3.36,-5.340067245930168
CC(C)[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1ccc(Cl)cc1,C12871868_decoy,TRY1,Decoy,0,-8.14715,-6.55,-1.16,-7.3199009783285565
CNS(=O)(=O)Cc1ccccc1CNC(=O)c1c[nH]nc1-c1ccc(F)cc1,C10126519_decoy,TRY1,Decoy,0,-6.13167,-6.72,-3.58,-5.040680398459291
[NH3+][C@@H](CC(=O)[O-])[C@H](C(=O)OCC1c2ccccc2-c2ccccc21)c1cccs1,C21302020_decoy,TRY1,Decoy,0,-6.24859,-7.65,-2.2,-5.672628922211514
CC(=O)Nc1ccc(NC(=O)CCCNC(=O)c2cccs2)c(C(F)(F)F)c1,C22311816_decoy,TRY1,Decoy,0,-8.67296,-6.88,-2.03,-5.81347559061264
Cc1nc2c(C(N)=O)ncn2c(C)c1CCC(=O)N[C@H](c1cccs1)C(C)C,C25964611_decoy,TRY1,Decoy,0,-8.07882,-6.9,-2.44,-5.560779266852628
CC(=O)NCCNC(=O)c1sc2[nH]c(CSc3cc(C)ccc3C)nc(=O)c2c1C,C27672025_decoy,TRY1,Decoy,0,-8.30576,-7.09,-3.96,-6.2494572165864914
C[C@H](NC(=O)/C=C/c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1,C08029669_decoy,TRY1,Decoy,0,-7.12174,-8.38,-2.11,-6.531792701679955
CCN(Cc1ccc(Br)s1)C(=O)C[C@@H](NC(N)=O)c1ccccc1,C32901215_decoy,TRY1,Decoy,0,-6.91895,-6.74,-3.03,-5.512175730509391
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)C[C@H](NC(N)=O)c2ccccc2Cl)C1,C35513175_decoy,TRY1,Decoy,0,-7.75758,-7.37,-2.49,-6.366635594363364
O=C(CC[C@H]1NN[C@H](C2(c3ccc(Cl)cc3)CCC2)O1)NCCC1=CN=NC1,C39466872_decoy,TRY1,Decoy,0,-9.11572,-6.43,-1.64,-6.355556887325249
CCN(Cc1ccc(Br)s1)C(=O)C[C@H](NC(N)=O)c1ccccc1C,C40069644_decoy,TRY1,Decoy,0,-7.44033,-3.99,-3.17,-4.557570327535597
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=S)NC1CCCCC1,C42080252_decoy,TRY1,Decoy,0,-8.39072,-6.33,-2.2,-5.918443825552389
CCc1c(-c2c(C)n(C)n(-c3ccccc3)c2=O)c(C(N)=O)c(C)n1CCCO,C43225587_decoy,TRY1,Decoy,0,-8.30112,-5.52,-2.92,-5.726013219671346
CCC[C@@H](C(=O)NC[C@@H]1CCCO1)n1c(-c2ccc(F)cc2)cc(C(N)=O)c1C,C44145112_decoy,TRY1,Decoy,0,-8.31277,-7.36,-3.16,-7.990715375673196
O=C(/C=C/c1ccc(C(=O)NC2CC2)cc1)NNC(=O)COc1ccc(F)cc1,C44669330_decoy,TRY1,Decoy,0,-8.30828,-7.57,-1.41,-7.084406963174097
Cc1ccc(-n2cnnc2SCC(=O)NNC(=S)NC2CC2)cc1Cl,C45144693_decoy,TRY1,Decoy,0,-8.77033,-7.1,-1.44,-8.55765237873382
C[C@H](Sc1nnc(NCCc2cccs2)s1)C(=O)NC(=O)NC1CC1,C45619542_decoy,TRY1,Decoy,0,-9.47164,-5.49,-2.77,-6.047720338621536
CNC(=O)NC(=O)[C@H](C)OC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12,C10636481_decoy,TRY1,Decoy,0,-7.95403,-7.43,-1.48,-7.932101777328045
COc1ccc(N2C[C@H](C(=O)Nc3ccccc3SCC(N)=O)CC2=O)cc1,C46571206_decoy,TRY1,Decoy,0,-7.85783,-7.08,-1.41,-7.286217537331546
C=CCNC(=S)NNC(=O)CN1C(=O)COc2cc(Br)ccc21,C46572675_decoy,TRY1,Decoy,0,-8.50223,-6.01,-2.24,-6.464455966570471
O=C(NCCSCc1ccccc1)C(=O)Nc1ccc(N2CCNC2=O)cc1,C49043804_decoy,TRY1,Decoy,0,-7.97635,-7.58,-2.67,-6.698327513918923
COc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1F,C49251603_decoy,TRY1,Decoy,0,-7.81453,-7.76,-3.14,-5.925843806610297
Cc1cc([C@@H](C)NC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c(C)o1,C51788693_decoy,TRY1,Decoy,0,-7.23984,-7.02,-4.67,-5.293695099973843
Cc1cc(C)cc(NC(=O)C(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1,C54940434_decoy,TRY1,Decoy,0,-7.48922,-6.3,-2.51,-5.190169448213683
COc1ccc(Cl)cc1/C=C/C(=O)Nc1nc(C)c(SCC(N)=O)s1,C55192217_decoy,TRY1,Decoy,0,-10.4018,-5.51,-1.61,-6.1546076183757945
CCCCn1c(N)c(N(C)C(=O)CSc2ccc(F)cc2F)c(=O)[nH]c1=O,C17344299_decoy,TRY1,Decoy,0,-7.79723,-6.99,-2.21,-5.71653701511748
O=C(CNC(=O)NCc1ccccc1CN1CCOCC1)Nc1ccc(F)cc1,C60244637_decoy,TRY1,Decoy,0,-8.43389,-7.61,-1.14,-6.132561781966206
NS(=O)(=O)c1ccc2c(c1)CCN2C[C@@H](O)COCc1ccc(Cl)cc1,C60466362_decoy,TRY1,Decoy,0,-9.14248,-6.17,-1.2,-6.313588214455397
CCNC(=O)CNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F,C61924452_decoy,TRY1,Decoy,0,-7.60323,-6.46,-3.1,-6.031701552271653
COc1cc(OC)c(NC(=O)C(=O)NC[C@H](O)c2ccc(F)cc2)cc1Cl,C62131647_decoy,TRY1,Decoy,0,-9.46999,-6.02,-2.47,-6.3771648443593065
C[C@@H](NC(=O)CCC1=N[C@@H](NC(=O)c2ccc[nH]c2=O)SC1)c1ccccc1,C64409287_decoy,TRY1,Decoy,0,-7.47201,-8.76,-1.73,-7.327223162340759
O=C(NCC1=N[C@@H](c2ccccc2)SC1)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C64683260_decoy,TRY1,Decoy,0,-7.46017,-8.12,-1.17,-6.0609733147768345
CC(=O)Nc1ccc(F)c(C(=O)NCCCNc2ccc(C(F)(F)F)cn2)c1,C53513090_decoy,TRY1,Decoy,0,-7.60255,-7.16,-2.37,-5.563052726277754
COCCCNC(=S)NNC(=O)Cc1csc(Cc2ccc(F)cc2)n1,C65621467_decoy,TRY1,Decoy,0,-9.25929,-6.61,-2.2,-6.295233722430818
CCN(Cc1ccccc1)C(=O)CNC(=O)N[C@H](C)c1cccc(NC(C)=O)c1,C66356978_decoy,TRY1,Decoy,0,-6.89241,-6.87,-4.33,-5.645122763528921
CCNC(=O)NC1CCC(OC(=O)CCNC(=O)c2ccc(F)cc2F)CC1,C66536744_decoy,TRY1,Decoy,0,-7.60991,-7.9,-1.27,-6.931859988892749
Cc1cc(NC(=O)NCCCCn2c(C)cccc2=O)ccc1C(=O)NC(C)C,C66681967_decoy,TRY1,Decoy,0,-7.36715,-7.09,-1.76,-6.480939044345755
O=C(NCC1(c2ccc(F)cc2)CC1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1,C66996380_decoy,TRY1,Decoy,0,-8.60963,-6.54,-4.11,-5.900280676634157
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)Nc1ccccc1CC(=O)N(C)C,C67327766_decoy,TRY1,Decoy,0,-7.68118,-8.4,-3.57,-7.048197873147634
CCOc1cc2c(cc1NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1)O[C@H](C)C2,C67396391_decoy,TRY1,Decoy,0,-9.18817,-8.68,-1.66,-7.951522453576419
NC(=O)CNc1cnn([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)n1,C01662918_decoy,TRY1,Decoy,0,-5.46565,-6.66,-3.07,-5.967718953987316
C=C1CCO[C@]2([C@H](O)[C@@](C)(O)CO)NC(=O)[C@@]1(O)NC2=O,C04099040_decoy,TRY1,Decoy,0,-6.19835,-5.2,-1.56,-3.6832767344940622
CNc1nc(N)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C01669642_decoy,TRY1,Decoy,0,-6.23339,-4.43,-1.16,-3.470311155163075
Nc1ncnc2c1ncn2[C@@]1(CO)OC[C@@H](O)[C@@H](O)[C@@H]1O,C04522731_decoy,TRY1,Decoy,0,-6.74007,-6.26,-0.54,-4.535156577741231
Nc1ncnc2c1ncn2[C@]1(CO)OC[C@@H](O)[C@@H](O)[C@@H]1O,C04522732_decoy,TRY1,Decoy,0,-6.24092,-6.97,-0.89,-7.206069974612141
Nc1nc(=S)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C04557083_decoy,TRY1,Decoy,0,-8.17308,-6.08,-1.19,-7.076891297114526
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04188103_decoy,TRY1,Decoy,0,-6.30196,-6.84,-2.22,-6.010052059141142
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C04188112_decoy,TRY1,Decoy,0,-5.9471,-7.1,-0.96,-7.286616569595538
CNc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04718460_decoy,TRY1,Decoy,0,-6.52645,-7.84,-0.86,-8.184845692976848
CC[C@]1(C)Cc2c(sc3nc(NN)nc(NN)c23)CO1,C00506932_decoy,TRY1,Decoy,0,-9.16471,-4.43,-3.56,-4.783789841487465
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)c1nnc(Nc2ccccc2)s1,C05331868_decoy,TRY1,Decoy,0,-8.57979,-6.45,-1.89,-7.262839565157644
Cc1c(N)c(S(N)(=O)=O)cc(S(N)(=O)=O)c1Cl,C01628084_decoy,TRY1,Decoy,0,-8.0488,-5.06,-1.54,-4.9246846604138605
OC[C@H]1O[C@H](O[C@H]2[C@H](O)C=CO[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,C12953224_decoy,TRY1,Decoy,0,-6.57347,-5.7,-3.02,-5.469905921449516
Nc1ncnc2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c12,C05386526_decoy,TRY1,Decoy,0,-6.53197,-5.16,-1.01,-4.096338051980228
Nc1nc(N)c(CCCOc2ccccc2Cl)c(N)n1,C04771653_decoy,TRY1,Decoy,0,-6.9879,-7.43,-0.51,-11.910533701753202
Nc1ncnc(N2C(=S)O[C@H]3[C@H](O)[C@H](CO)O[C@@H]32)c1N,C04773816_decoy,TRY1,Decoy,0,-7.21633,-6.39,-2.6,-7.262805543706522
Nc1ncnc2c1ncn2[C@]1(CO)O[C@H](CO)[C@@H](O)[C@@H]1O,C13521786_decoy,TRY1,Decoy,0,-5.35499,-7.53,-0.83,-9.195687178940046
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21,C13560595_decoy,TRY1,Decoy,0,-6.9351,-7.72,-1.18,-8.123632399433404
NNC(=O)CSc1nnc(SCC(=O)NN)s1,C02268238_decoy,TRY1,Decoy,0,-7.7867,-5.4,-1.31,-6.981363904941156
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C15260378_decoy,TRY1,Decoy,0,-6.87567,-6.74,-0.64,-6.995498131903767
Cn1c(=O)cc(N[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[nH]c1=O,C16952322_decoy,TRY1,Decoy,0,-6.01871,-5.04,-2.56,-4.0495528198922095
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C17021264_decoy,TRY1,Decoy,0,-6.77887,-7.43,-1.65,-6.635714687063986
C[C@@]1(O)[C@@H](O)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21,C22063174_decoy,TRY1,Decoy,0,-5.72949,-8.18,-1.85,-8.043987186719246
NC(=S)N/N=C1/CC[C@H]2C[C@@H]1CC/C2=N\NC(N)=S,C25627498_decoy,TRY1,Decoy,0,-9.29022,-6.25,-3.31,-10.26715857602893
Nc1nc(Nc2ccc(Br)cc2)c(N)c(=O)[nH]1,C08615071_decoy,TRY1,Decoy,0,-7.30193,-7.46,-3.28,-7.567644605772524
Nc1ncnc2c1[nH]c(=S)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04823537_decoy,TRY1,Decoy,0,-6.3266,-7.96,-0.44,-10.899803422565318
Nc1ncnc2c1[nH]c(=S)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04823535_decoy,TRY1,Decoy,0,-7.00457,-7.81,-0.07,-10.367883654567535
OC[C@@H]1O[C@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@@H]1O,C34165723_decoy,TRY1,Decoy,0,-6.01153,-7.51,-2.71,-5.934847486689311
CO[C@@H]1[C@@H](O)[C@H](CO)O[C@@H]1n1cnc2c(N)nc(N)nc21,C34350986_decoy,TRY1,Decoy,0,-6.58175,-7.05,-0.89,-7.604946589046184
NNC(=O)c1nnn2c1Sc1c(C(=O)NN)nnn1CC2,C36489959_decoy,TRY1,Decoy,0,-7.84344,-5.69,-0.8,-5.437398270613687
C=C1CCO[C@@]2([C@H](O)[C@@](C)(O)CO)NC(=O)[C@]1(O)NC2=O,C00967754_decoy,TRY1,Decoy,0,-6.00081,-4.81,-1.4,-4.112220382652676
CNc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C02244192_decoy,TRY1,Decoy,0,-6.91143,-7.11,-0.55,-9.81677687807013
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)nc(N)nc21,C34019039_decoy,TRY1,Decoy,0,-6.69434,-7.87,-0.43,-13.486550869004176
Nc1cccc2c1nnn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C03998851_decoy,TRY1,Decoy,0,-6.72274,-7.62,-1.0,-6.868832692485904
CCCCCCN1C(=O)/C(=C/NNC(N)=[NH2+])C(=O)N=C1[O-],C38172126_decoy,TRY1,Decoy,0,-8.47419,-6.94,-0.82,-10.69286865720933
Nc1cc(N)nc(Sc2ccc(C(F)(F)F)cc2N)n1,C41023254_decoy,TRY1,Decoy,0,-7.63428,-7.32,-1.02,-9.64113007969186
Nc1cc(=O)[nH]c(Sc2cc3c(cc2N)NC(=O)CC3)n1,C41027105_decoy,TRY1,Decoy,0,-7.68181,-7.84,-1.78,-6.687311376982691
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H]3CO[C@H]3O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C44171309_decoy,TRY1,Decoy,0,-4.0687,-5.01,-2.77,-3.5607750494121024
OC[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@@H]3CO[C@H]3O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C44171317_decoy,TRY1,Decoy,0,-4.98123,-4.73,-1.93,-3.920859374357927
C[C@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(=O)[nH]c(N)nc21,C44171513_decoy,TRY1,Decoy,0,-6.07723,-6.65,-0.79,-7.024322863345236
NC(=S)N/N=C1/CC[C@@H]2C[C@H]1CC/C2=N/NC(N)=S,C44356379_decoy,TRY1,Decoy,0,-7.96693,-5.02,-1.57,-8.547657557226614
Nc1cc2c(cc1NCCCS(N)(=O)=O)NC(=O)CC2,C45071186_decoy,TRY1,Decoy,0,-8.68958,-6.55,-1.65,-7.019754063910106
NC(=O)CCCNC(=O)C(=O)Nc1sccc1C(N)=O,C48002914_decoy,TRY1,Decoy,0,-9.05155,-6.42,-2.2,-7.1722054669726285
Nc1cc2c(ncn2[C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=S)[nH]1,C48995394_decoy,TRY1,Decoy,0,-9.10123,-4.79,-1.2,-4.512339728761176
Nc1nc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=S)[nH]1,C04557081_decoy,TRY1,Decoy,0,-7.82814,-4.61,-0.53,-4.608168103731302
C[C@H]1CC[C@H](C(N)=O)CN1c1cc(C(N)=O)c(N)cc1F,C50032542_decoy,TRY1,Decoy,0,-7.13003,-7.76,-1.28,-12.067225513771051
C[C@H]1CC[C@@H](C(N)=O)CN1c1cc(C(N)=O)c(N)cc1F,C50032548_decoy,TRY1,Decoy,0,-6.63903,-7.17,-0.95,-7.944320288054863
Nc1nc2c(ncn2[C@@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=S)[nH]1,C55376713_decoy,TRY1,Decoy,0,-6.20663,-4.86,-2.44,-3.6489895140819777
Cc1nnc(N(CC(N)=O)CC(N)=O)c(C(N)=S)c1C,C61809021_decoy,TRY1,Decoy,0,-7.12815,-4.08,-1.13,-4.796454959260808
NC(=O)[C@H]1[NH+]=CN([C@@H]2O[C@@H]3CO[P@@](=O)([O-])O[C@H]3[C@H]2O)C1=[NH2+],C65734125_decoy,TRY1,Decoy,0,-5.20053,-7.45,-1.04,-6.138042690787574
COc1cc(NC(=O)CN2C(=O)N[C@@](C)(c3ccc(Cl)cc3)C2=O)cc(OC)c1OC,C03456668_decoy,TRY1,Decoy,0,-8.06327,-6.68,-1.2,-5.845657779297013
COc1ccc(/C=N/NC(=O)C(=O)Nc2sc3c(c2C#N)CCCC3)c(OC)c1OC,C04210768_decoy,TRY1,Decoy,0,-8.73416,-6.53,-3.32,-6.01957187773581
COc1cc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2Cl)cc(OC)c1OC,C00881658_decoy,TRY1,Decoy,0,-7.40716,-5.52,-3.88,-5.300697300068699
Cc1cccc(-c2nnc(SCC(=O)NC(=O)NCc3ccco3)n2Cc2ccco2)c1,C09464412_decoy,TRY1,Decoy,0,-8.44032,-9.28,-2.33,-7.332128843333621
Cc1ccccc1-c1nnc(SCC(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)n1C,C09466693_decoy,TRY1,Decoy,0,-8.14334,-7.19,-1.67,-6.826410900242749
Cc1c(C(=O)OCC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3)c2)oc2ccccc12,C09634088_decoy,TRY1,Decoy,0,-8.61091,-6.46,-3.77,-5.712504556612949
Cc1ccc(NC(=O)CCc2nnc3ccc(NCc4ccc5c(c4)OCO5)nn23)cc1,C09831657_decoy,TRY1,Decoy,0,-8.76177,-6.42,-3.44,-5.778394075237573
CCCCCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)NC(=O)NCC)nnc12,C10266623_decoy,TRY1,Decoy,0,-8.91248,-5.94,-3.03,-5.850559622044137
COc1ccc(-n2nnnc2SCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1,C10861164_decoy,TRY1,Decoy,0,-8.56506,-8.06,-1.67,-6.301163430335066
COc1cc(OC)cc(C(=O)Nc2cc(-c3cccs3)nn2-c2nc(C)cc(=O)[nH]2)c1,C11854379_decoy,TRY1,Decoy,0,-9.40152,-6.5,-1.78,-7.433100755879829
Cc1ccccc1OCC(=O)Nc1cc(-c2ccco2)nn1-c1nc2c(c(=O)[nH]1)CCC2,C12009830_decoy,TRY1,Decoy,0,-8.15677,-8.19,-3.06,-7.530950490128825
C[C@@H](Sc1nnc(N2CCCCC2)n1Cc1ccco1)C(=O)NC(=O)NC(C)(C)C,C12216231_decoy,TRY1,Decoy,0,-7.97861,-7.39,-1.94,-6.543023536671277
CCOc1ccc([C@H]2CC(=O)NC(SCC(=O)Nc3ccccc3[N+](=O)[O-])=C2C#N)cc1,C12276877_decoy,TRY1,Decoy,0,-6.66425,-6.14,-2.71,-5.462181534632621
CCOC(=O)C1=C(CSc2nnc(-c3ccoc3C)o2)NC(=O)N[C@@H]1c1cccs1,C12724837_decoy,TRY1,Decoy,0,-7.65837,-7.13,-3.36,-6.055341887926373
CCOC(=O)c1c(C)oc2nc(CSc3nnc(NC(C)(C)C)s3)[nH]c(=O)c12,C12753330_decoy,TRY1,Decoy,0,-7.62624,-4.97,-2.73,-5.266743588334823
COc1cc(C(=O)NC(=S)Nc2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1OC,C14012039_decoy,TRY1,Decoy,0,-6.93733,-6.42,-3.06,-5.317608430878579
COc1ccc(CC[C@@]2(C)NC(=O)N([C@@H](C)C(=O)Nc3ccc4c(c3)OCO4)C2=O)cc1,C14254374_decoy,TRY1,Decoy,0,-8.61126,-6.85,-2.2,-6.594297708946288
COCCNC(=O)NC(=O)COC(=O)c1cc2c(C)nn(-c3ccccc3Cl)c2s1,C15186259_decoy,TRY1,Decoy,0,-9.23623,-6.3,-2.31,-5.907483032676688
Cc1ccccc1NC(=O)CCc1nnc2ccc(NCc3ccc4c(c3)OCO4)nn12,C15776634_decoy,TRY1,Decoy,0,-9.51052,-5.97,-3.75,-6.137873358971482
CCc1cc2c(C)cc(=O)oc2cc1OC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-],C18698813_decoy,TRY1,Decoy,0,-8.15032,-7.9,-2.14,-7.458797196130627
CCOC(=O)C1=C(CN2CCN(c3ccc(Cl)nn3)CC2)NC(=O)N[C@H]1c1ccccc1,C20284087_decoy,TRY1,Decoy,0,-7.43869,-5.8,-2.1,-5.2997048607504444
C[NH+](C)CCN1C(=O)C([O-])=C(C(=O)c2cc(Cl)ccc2O)[C@@H]1c1ccc([N+](=O)[O-])cc1,C20309183_decoy,TRY1,Decoy,0,-7.8282,-6.34,-0.57,-5.794310315651768
CC1CCC2(CC1)NC(=O)N(NC(=O)COC(=O)c1ccc(-c3ccc(F)cc3)o1)C2=O,C21499789_decoy,TRY1,Decoy,0,-7.19546,-8.88,-1.67,-5.761941929987084
Cc1cccc(C)c1OCC(=O)NNC(=O)c1cc(-c2ccco2)nc2c1c(C)nn2C,C25169777_decoy,TRY1,Decoy,0,-7.99669,-8.36,-2.6,-6.271599588108907
COc1cc(OC)c2cc(C(=O)Nc3ccc(N4CCCS4(=O)=O)cc3)[nH]c2c1OC,C31275731_decoy,TRY1,Decoy,0,-8.1934,-7.18,-2.58,-6.366393112513003
CCOC(=O)C1=C(CSc2nnc(-c3cccnc3)o2)NC(=O)N[C@@H]1c1ccccc1,C32945306_decoy,TRY1,Decoy,0,-7.36658,-7.95,-2.69,-6.696281789955706
O=C(CCc1nc(CSc2nc(-c3cccnc3)n[nH]2)no1)Nc1ccc(F)c(Cl)c1,C33271046_decoy,TRY1,Decoy,0,-9.37429,-8.44,-1.2,-7.216973881740926
CNC(=O)NC(=O)COC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2o1,C10384980_decoy,TRY1,Decoy,0,-8.40702,-8.67,-1.35,-8.914463930986964
CCSc1nc2n(n1)[C@H](c1ccnn1C)C(C(=O)Nc1ccccc1OC)=C(C)N2,C36621253_decoy,TRY1,Decoy,0,-6.8248,-5.48,-1.73,-5.253855772896261
O=C1c2ccccc2C(=O)N1CCCC1=NN2[C@@H]([C@H]3C=C(c4ccccc4)N=N3)NN[C@H]2S1,C38743228_decoy,TRY1,Decoy,0,-7.40373,-8.11,-2.59,-6.074707507148212
O=C(NCCOc1cc(N2CCOCC2)ncn1)Nc1ccc(OC(F)(F)F)cc1,C38908505_decoy,TRY1,Decoy,0,-7.90028,-7.0,-2.03,-5.346976262152696
COc1cc(OC)c(/C=N/N2[C@@H](S)NN[C@H]2[C@@H]2C=C(c3ccccc3)N=N2)c(OC)c1,C38965817_decoy,TRY1,Decoy,0,-6.92715,-6.74,-2.52,-5.249159195009783
COCCNC(=O)c1c(NC(=O)/C(C#N)=C/c2ccccc2[N+](=O)[O-])sc2c1CCCC2,C39992371_decoy,TRY1,Decoy,0,-7.94879,-6.99,-3.48,-6.661043506347339
COc1cc(OC)cc(C(=O)NCCCNc2nc3cc4c(cc3cc2C#N)OCO4)c1,C40010108_decoy,TRY1,Decoy,0,-7.6247,-8.59,-3.63,-7.905545902003894
COc1cc(OC)c([C@H]2C(C(=O)Nc3ccc(F)cc3C)=C(C)Nc3ncnn32)cc1OC,C40484464_decoy,TRY1,Decoy,0,-7.72637,-4.59,-2.27,-4.938659367850185
Cc1cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)no1,C40816204_decoy,TRY1,Decoy,0,-7.27174,-5.78,-2.07,-5.224005879338792
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCN1CCN(c2ccc(Cl)cc2)CC1,C56966617_decoy,TRY1,Decoy,0,-8.79149,-5.79,-2.26,-5.447858581089968
COc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1Cl,C22530983_decoy,TRY1,Decoy,0,-8.56604,-5.98,-1.84,-5.538353928973023
CCOc1ccc(OC[C@@H](O)CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)cc1,C24097539_decoy,TRY1,Decoy,0,-8.71321,-7.47,-2.18,-6.044297460724296
COc1cccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c1O,C58157039_decoy,TRY1,Decoy,0,-8.40362,-6.86,-1.52,-5.593010834116975
Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)C)c12,C58489608_decoy,TRY1,Decoy,0,-7.58959,-8.52,-1.78,-8.396037190198552
Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)NC(=O)NC3CC3)c3c(C)noc3n2)cc1,C12178251_decoy,TRY1,Decoy,0,-8.39501,-8.29,-0.97,-9.462592250707289
C[C@H](C(=O)NC(=O)NC1CC1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1,C59039070_decoy,TRY1,Decoy,0,-8.18372,-7.58,-3.05,-6.587484283228853
O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1,C59240930_decoy,TRY1,Decoy,0,-6.28798,-7.65,-1.75,-5.110746889035275
Cc1ccc(NC(=O)CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c([N+](=O)[O-])c1,C59404094_decoy,TRY1,Decoy,0,-7.5902,-6.18,-2.37,-5.1578966607766725
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1,C59404125_decoy,TRY1,Decoy,0,-7.89317,-7.9,-3.48,-5.87809381703692
CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)OCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)(C3)C2,C20971509_decoy,TRY1,Decoy,0,-8.33484,-7.39,-2.17,-6.969821184357874
COC/C([O-])=N/C1=NC2=[NH+][C@@H](c3ccc(OC)cc3)C[C@@H](c3ccc(OC)cc3)N2N1,C13127419_decoy,TRY1,Decoy,0,-7.60456,-7.8,-1.48,-5.718160773400033
CCOC(=O)c1sc(NC(=O)CNC(=O)N2CCN(c3ccc(F)cc3)CC2)nc1C,C49550085_decoy,TRY1,Decoy,0,-9.70433,-7.86,-2.26,-7.1939589853614265
CCc1nnc(NC(=O)CSc2nc(-c3ccc(Cl)cc3)nc3cc(=O)[nH]n23)s1,C21911141_decoy,TRY1,Decoy,0,-10.4978,-8.17,-1.92,-7.781828570919408
COc1ccc(NC(=O)O[C@@H]2CC[C@]3(C)[C@H](CC[C@@H](O)[C@H]3CC(=O)NCc3ccco3)[C@]2(C)CO)cc1,C04236656_decoy,TRY1,Decoy,0,-9.64393,-7.13,-3.53,-6.543986177145497
CC(=O)Nc1ccc(NC(=O)CSc2nnc(NC(=O)Nc3ccc(Cl)cc3)s2)cc1,C09324294_decoy,TRY1,Decoy,0,-9.62372,-6.06,-2.19,-5.974754401236814
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C(C)C)cc(Br)c1O,C01897114_decoy,TRY1,Decoy,0,-10.265,-6.47,-2.89,-6.348142187407949
NC(=O)c1ccsc1NC(=O)COC(=O)C[C@H]1Sc2ccc(C(F)(F)F)cc2NC1=O,C12426122_decoy,TRY1,Decoy,0,-9.5778,-8.12,-2.21,-6.8065100707879065
COC(=O)C1=C(C)Nc2sc(C(=O)Nc3cc(C)on3)c(N)c2[C@@H]1c1ccc(C(=O)OC)cc1,C12446706_decoy,TRY1,Decoy,0,-8.21859,-4.96,-2.05,-5.578666816119306
CC(=O)N[C@H]1[C@@H](O/N=C2/C(=O)N(CCOc3ccccc3C)c3ccc(C)cc32)O[C@H](CO)[C@H](O)[C@@H]1O,C12636367_decoy,TRY1,Decoy,0,-7.41507,-8.8,-2.51,-6.756333058206224
CC(C)(CO)NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3[C@@H](O)C[C@@]21C,C12889286_decoy,TRY1,Decoy,0,-10.0795,-6.01,-2.32,-7.199979775257932
Cc1cc[nH+]c(NCCCCC(=O)NNC(=O)C[C@H](CC(=O)[O-])c2ccc(-c3ccccc3)cc2)c1,C13472609_decoy,TRY1,Decoy,0,-8.49455,-8.14,-2.79,-7.699545421467338
Nc1nccnc1C(=O)OCC(=O)Nc1sc2c(c1C(=O)Nc1ccc(Cl)cc1)CCCC2,C14640946_decoy,TRY1,Decoy,0,-9.73092,-7.12,-1.64,-6.503847132614312
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NCCc2ccc(F)cc2)n1N,C20911521_decoy,TRY1,Decoy,0,-9.64218,-7.96,-3.49,-6.570716225241722
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)Nc3ccc(Cl)cc3Cl)n2N)cn1,C20921311_decoy,TRY1,Decoy,0,-9.24186,-7.04,-4.08,-6.309025110022208
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(OC(F)F)cc1,C03536288_decoy,TRY1,Decoy,0,-7.02682,-8.75,-1.31,-6.418526811332689
C/C(=N\Nc1nnc(SCC(=O)Nc2nc(C)cs2)n1N)c1ccc(Br)cc1,C21323082_decoy,TRY1,Decoy,0,-11.1842,-8.09,-3.52,-7.290161065698786
C[C@@H](OC(=O)CNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C21601861_decoy,TRY1,Decoy,0,-11.0215,-6.54,-2.83,-6.960700276300173
CC(=O)Nc1sc2c(c1C(=O)O[C@H](C)C(=O)Nc1sc3c(c1C(N)=O)CCC3)CCCC2,C21602434_decoy,TRY1,Decoy,0,-9.86012,-8.09,-2.07,-7.759851264617721
Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)c1C,C21603985_decoy,TRY1,Decoy,0,-8.46747,-7.41,-1.29,-6.527211787830809
NS(=O)(=O)c1ccc(NCCC(=O)NC[C@@H](c2cccs2)N2CCOCC2)c([N+](=O)[O-])c1,C25458223_decoy,TRY1,Decoy,0,-10.0563,-6.06,-2.52,-6.360923317088174
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CC23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)c(=O)[nH]c1=O,C17968734_decoy,TRY1,Decoy,0,-8.3283,-6.77,-1.39,-6.520621982501114
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2c(O)cc(O)cc2O)N(C=O)c2ccccc2Cl)cc1,C36544375_decoy,TRY1,Decoy,0,-8.63056,-8.02,-3.94,-10.47321614894985
COc1cc([C@@H]2C(C#N)=C(N)O[C@@H]3N=NC(CSc4ccc(C)cc4)=C23)ccc1OCC(N)=O,C38915307_decoy,TRY1,Decoy,0,-8.01469,-5.98,-2.62,-5.749685924500842
Cc1ccc(C)c(N2C(SCC(=O)Nc3ccc(F)cc3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361865_decoy,TRY1,Decoy,0,-8.9467,-9.01,-1.93,-8.789158586743266
COc1ccc(N2C(SCC(=O)Nc3nccs3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362361_decoy,TRY1,Decoy,0,-8.12607,-7.57,-1.58,-12.085897371605173
Cc1ccc(C)c(NC(=O)CSC2=NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)c1,C39362751_decoy,TRY1,Decoy,0,-8.34406,-8.07,-5.05,-7.910308977073519
Cc1ccc(C)c(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)c1,C39362753_decoy,TRY1,Decoy,0,-8.74284,-8.56,-1.49,-11.834235587402594
Cc1cc(C)cc(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)c1,C39362761_decoy,TRY1,Decoy,0,-8.89536,-8.39,-1.52,-8.706123349732474
COc1ccc(NC(=O)CSC2=NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)cc1,C39362801_decoy,TRY1,Decoy,0,-8.9487,-8.11,-1.3,-8.388775482746905
COc1ccc(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(Cl)cc2)cc1,C39363092_decoy,TRY1,Decoy,0,-8.33571,-8.06,-2.44,-7.273301359809532
O=S(=O)(Nc1ccc(S(=O)(=O)Oc2ccccc2)cc1N1CC[NH2+][C@@H](O)C1)c1ccccc1[O-],C39482746_decoy,TRY1,Decoy,0,-8.04078,-6.51,-1.34,-6.137013529236873
NC(=O)c1c(NC(=O)COC(=O)CNC(=O)C23CC4CC(CC(C4)C2)C3)sc2c1CCCC2,C39640329_decoy,TRY1,Decoy,0,-10.6709,-8.18,-4.02,-7.968694334002792
OC[C@@H]1O[C@@H](Sc2nc3ccccc3n2CCOc2ccc(Cl)cc2Cl)[C@H](O)[C@H](O)[C@@H]1O,C39915993_decoy,TRY1,Decoy,0,-8.93249,-5.9,-1.52,-6.438154467296171
OC[C@@H]1O[C@@H](Sc2nc3ccccc3n2CCCOc2ccccc2Cl)[C@H](O)[C@H](O)[C@@H]1O,C39916029_decoy,TRY1,Decoy,0,-8.33837,-7.71,-1.85,-6.622849353192747
CCOc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccc(F)cc3)[nH]c(=O)c21,C40399781_decoy,TRY1,Decoy,0,-7.34382,-7.66,-2.48,-6.523778917822285
COc1ccc(Nc2nc3c(c(=O)[nH]2)[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC(=O)N3)cc1,C40399932_decoy,TRY1,Decoy,0,-7.75974,-8.95,-2.51,-9.324014567020546
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccccc3OC)[nH]c(=O)c21,C40400124_decoy,TRY1,Decoy,0,-7.48728,-8.04,-1.93,-6.428916765592905
CCOc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccc(C)cc3)[nH]c(=O)c21,C40400541_decoy,TRY1,Decoy,0,-8.02786,-8.38,-4.53,-6.6165363799074175
Nc1c(NNC(=O)COc2ccccc2)ncnc1Oc1ccc(Br)c2cccnc12,C40795292_decoy,TRY1,Decoy,0,-8.17713,-8.46,-3.05,-6.674559233460495
O=C1[C@@H]2[C@@H](C(=O)N1CCNc1ccccc1)[C@](Cc1c[nH]c3ccccc13)(C(=O)[O-])[NH2+][C@H]2c1nccs1,C33601849_decoy,TRY1,Decoy,0,-6.36923,-5.77,-1.95,-4.781057486307527
COc1ccc(NC(=O)O[C@@H]2CC[C@@]3(C)[C@H](CC[C@@H](O)[C@H]3CC(=O)NCc3ccco3)[C@]2(C)CO)cc1,C43553845_decoy,TRY1,Decoy,0,-9.98068,-7.79,-2.51,-7.828108799428504
C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)n1N)C(=O)NC(=O)Nc1ccc(C#N)cc1,C45900206_decoy,TRY1,Decoy,0,-8.32335,-9.49,-4.27,-7.706607379951104
[NH3+][C@H](Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)[O-])C[C@H](c2cc(F)cc(F)c2)CC1,C49037424_decoy,TRY1,Decoy,0,-9.5518,-8.51,-2.17,-8.459918211278472
[NH3+][C@H](Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)[O-])C[C@@H](c2cc(F)cc(F)c2)CC1,C49037428_decoy,TRY1,Decoy,0,-7.60758,-8.31,-1.98,-6.147463985152524
COc1cc(NC(=O)[C@@H]2CC(=O)Nc3nc(Nc4ccc(C)cc4)[nH]c(=O)c32)cc(OC)c1OC,C54202175_decoy,TRY1,Decoy,0,-9.16429,-8.2,-2.23,-7.434865232087969
CCOc1ccccc1NC(=S)NNC(=O)c1cnn2c1N[C@H](c1ccccc1)C[C@H]2C(F)F,C02794637_decoy,TRY1,Decoy,0,-8.10324,-8.09,-3.03,-6.646105177358508
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)cc(Br)c2O)n1)NC1CC1,C59018465_decoy,TRY1,Decoy,0,-10.6453,-7.13,-2.17,-8.276744022745651
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)c(F)c3)n[nH]2)c([N+](=O)[O-])cc1O,C59040087_decoy,TRY1,Decoy,0,-8.17443,-9.16,-1.65,-12.530794555829583
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(Cl)cc3Cl)n2)cc1,C59813994_decoy,TRY1,Decoy,0,-10.2319,-9.55,-3.48,-9.755117809573123
CNC(=O)CCSc1n[nH]c(N/N=C/c2cc(Br)cc(Br)c2O)n1,C59819216_decoy,TRY1,Decoy,0,-9.69595,-6.97,-1.66,-7.727483565464786
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2ccccc2Br)n[nH]1,C59887564_decoy,TRY1,Decoy,0,-10.0762,-7.6,-2.45,-7.571542316025333
COc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)ccc1OS(=O)(=O)c1ccc(C)cc1,C08670776_decoy,TRY1,Decoy,0,-8.71943,-6.51,-1.94,-5.776940075357002
OCCN(CCO)c1nc(N(CCO)CCO)c2nc(N3CCCCC3)nc(N3CCCCC3)c2n1,C65740628_decoy,TRY1,Decoy,0,-9.91633,-5.59,-3.15,-7.317277628383914
CC1(C)CC(=O)C2=C(C1)N(c1ccc([N+](=O)[O-])cc1)C(N)=C(C#N)[C@@H]2c1ccc(Br)s1,C04004586_decoy,TRY1,Decoy,0,-7.54196,-5.8,-2.32,-4.991272710694738
COc1ccc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@H]3c2coc3ccc(Cl)cc3c2=O)cc1,C04080654_decoy,TRY1,Decoy,0,-8.11484,-8.35,-1.07,-5.627908990917044
Cc1cccc(S(=O)(=O)c2c(N)n(/N=C/c3ccc(C(C)C)cc3)c3nc4ccccc4nc23)c1,C02401781_decoy,TRY1,Decoy,0,-8.90001,-9.03,-2.57,-7.31928206338994
Nn1c(SCc2cc(Br)cc3c2O[C@@H](c2ccccc2)OC3)nnc1C(F)(F)F,C02632625_decoy,TRY1,Decoy,0,-7.44847,-6.96,-2.47,-4.993800681444279
Nc1c(S(=O)(=O)c2ccc(Br)cc2)c2nc3ccccc3nc2n1Cc1ccco1,C03328219_decoy,TRY1,Decoy,0,-8.29689,-5.63,-2.09,-5.688797242461841
CC1(C)SC(=S)N(/N=C/c2c(F)cccc2Cl)[C@H]1N(O)C(=O)Nc1ccc(Cl)cc1,C08951288_decoy,TRY1,Decoy,0,-8.9548,-5.19,-1.57,-5.192278424908201
Cc1ccc(C)c(CSC[C@@H]2Nc3ccc(C(=O)N4CCC5(CC4)OCCO5)cc3NC2=O)c1,C09490600_decoy,TRY1,Decoy,0,-8.23352,-8.14,-2.57,-6.168412604096049
C[C@H]1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@]21C(=O)N2c3c1cccc3[C@](C)(c1ccccc1)CC2(C)C,C10075450_decoy,TRY1,Decoy,0,-7.30999,-6.32,-0.66,-4.34091291364194
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,C10519048_decoy,TRY1,Decoy,0,-9.60987,-5.85,-3.18,-6.381729636949468
CN(C)c1ccc([C@H]2C3=C(CCCC3=O)Nc3nc(SCc4ccccc4Cl)[nH]c(=O)c32)cc1,C09781004_decoy,TRY1,Decoy,0,-8.9804,-8.4,-3.12,-6.627427494355286
Cc1ccc(-c2cc(C(F)F)nc3sc4c(c23)N[C@H](c2c(Br)cnn2C)NC4=O)cc1,C13959354_decoy,TRY1,Decoy,0,-7.43942,-6.83,-0.58,-5.36883202980144
Cc1ccc([C@H]2Nc3ccccc3-n3c(-c4ccc(Cl)cc4)c4c(=O)n(C)c(=O)n(C)c4c32)c(O)c1,C15834421_decoy,TRY1,Decoy,0,-7.85839,-6.95,-1.84,-4.588023433429115
CC1(C)CC(=O)C2=C(C1)Nc1[nH]nc(-c3ccc([N+](=O)[O-])cc3)c1[C@H]2c1cccc(Br)c1,C20135266_decoy,TRY1,Decoy,0,-6.25772,-6.38,-2.72,-4.116296584182702
COc1ccccc1[C@H]1C(C#N)=C(N)OC2=C1S(=O)(=O)N(Cc1ccccc1C)c1ccccc12,C20558671_decoy,TRY1,Decoy,0,-8.18829,-5.35,-3.33,-5.342001476896568
O=C([O-])[C@@H](c1c[nH]c2cc(Br)ccc12)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C20722919_decoy,TRY1,Decoy,0,-7.69699,-7.06,-1.67,-9.308559959414932
COc1ccccc1N1C(=O)NC(=O)C(=C2C[C@H](c3sccc3C)Sc3ccccc3N2)C1=O,C21149844_decoy,TRY1,Decoy,0,-8.32873,-4.96,-3.21,-4.8387080601584165
COc1ccccc1[C@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1cc2c(cc1Br)OCO2,C21228097_decoy,TRY1,Decoy,0,-7.95154,-7.58,-2.57,-6.9276461067584245
COc1ccc(OC)c([C@@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@@H]3c2ccc(OC)c(Cl)c2)c1,C21249704_decoy,TRY1,Decoy,0,-9.94185,-6.78,-1.3,-8.121367463096227
CN(C)c1ccc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@H]3c2coc3ccc(Cl)cc3c2=O)cc1,C21255773_decoy,TRY1,Decoy,0,-9.77564,-5.81,-1.51,-5.374952637531882
Cn1c(=O)c2c(-c3ccc(Cl)cc3)n3c(c2n(C)c1=O)[C@H](c1ccc(O)cc1)Nc1ccccc1-3,C21524949_decoy,TRY1,Decoy,0,-7.11965,-6.63,-1.65,-4.252240918968584
CCOc1cc(Br)c([C@@H]2[C@@H]3CN(C)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OCC,C23380907_decoy,TRY1,Decoy,0,-6.63554,-4.27,-2.44,-4.534129344073427
Cc1[nH]c2ccccc2c1-c1csc(NC(=O)c2ccccc2S[C@@H]2CCS(=O)(=O)C2)n1,C24134503_decoy,TRY1,Decoy,0,-10.4748,-9.55,-1.36,-13.04656859769537
CC1(C)CC(=O)C2=C(C1)N(c1cccc(C(F)(F)F)c1)C(N)=C(C#N)[C@H]2c1cccc([N+](=O)[O-])c1,C25782305_decoy,TRY1,Decoy,0,-6.2775,-6.81,-4.33,-4.650917922288776
Cc1ccc(CSc2nc3c(c(=O)[nH]2)[C@@H](c2ccc(N(C)C)cc2)C2=C(CC(C)(C)CC2=O)N3)cc1,C33810631_decoy,TRY1,Decoy,0,-9.72976,-6.72,-1.81,-6.218615569032581
O[C@@H]1[C@H](Oc2ccc(Br)cc2Br)O[C@H]2CO[C@@H](c3ccco3)O[C@H]2[C@@H]1O,C35270156_decoy,TRY1,Decoy,0,-7.19644,-5.39,-1.23,-4.498475914900501
Cc1ccc2c(=O)cc(C(=O)Nc3sc4c(c3C(=O)NC[C@H]3CCCO3)CCCC4)oc2c1C,C08612391_decoy,TRY1,Decoy,0,-9.03904,-8.71,-1.7,-10.088898246184051
Cc1ccc2c(C)c(C(=O)Oc3ccc4c(c3)OC(N)=C(C#N)[C@H]4c3cccc(Br)c3)oc2c1,C38687865_decoy,TRY1,Decoy,0,-7.47819,-9.83,-2.94,-5.732246719339039
Cc1c(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc3ccccc23)oc2ccc(F)cc12,C38688556_decoy,TRY1,Decoy,0,-7.72835,-10.97,-3.21,-6.383954931120179
Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4oc5cc(Br)ccc5c4C)ccc32)o1,C38688702_decoy,TRY1,Decoy,0,-9.21751,-8.6,-0.95,-6.809810550550829
O=C1C[C@H](c2ccccc2O)Nc2c1n(I)c(=O)c1cc3c(F)cccc3nc21,C39452743_decoy,TRY1,Decoy,0,-8.10467,-8.62,-1.27,-4.921168439089475
CCOn1c(C)c(-c2ccccc2O)c2c1-c1nc3ccccc3c(-c3ccccc3O)c1C(=O)CC2,C39456529_decoy,TRY1,Decoy,0,-8.07148,-6.0,-1.24,-6.236070503739531
CSC1=C[C@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)NN3C[C@@H]2C=C1S(=O)(=O)c1ccccc1,C39467286_decoy,TRY1,Decoy,0,-7.91906,-5.77,-2.19,-5.340636979651524
CCO/C1=N/c2c(Cl)ncnc2N(C)c2c(cc(-c3ccccc3O)cc2-c2ccccc2O)C1,C39479416_decoy,TRY1,Decoy,0,-8.76506,-7.55,,99.0
O=C([C@H]1CC(Cl)=C2Nc3ccccc3C[NH+]21)N(c1ccccc1)S(=O)(=O)Oc1ccccc1,C39545372_decoy,TRY1,Decoy,0,-8.72438,-8.09,-2.51,-6.574079475966426
Cc1c(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)oc2c1C1(CCC2)SCCS1,C39852004_decoy,TRY1,Decoy,0,-10.476,-7.64,-1.86,-9.567261939404716
COc1cc([C@H]2C(C#N)=C(N)O[C@H]3N=NC(C)=C23)cc(Br)c1OCc1cccc(F)c1,C39962536_decoy,TRY1,Decoy,0,-7.33986,-6.24,-2.39,-5.335788050679783
O=C1c2[nH]nc(-c3ccccc3O)c2[C@@H](c2ccc(Br)cc2)N1[C@@H]1CCS(=O)(=O)C1,C38701522_decoy,TRY1,Decoy,0,-7.26494,-5.62,-1.16,-4.51485330831412
O=C1c2[nH]nc(-c3ccccc3O)c2[C@H](c2ccc(Br)cc2)N1[C@H]1CCS(=O)(=O)C1,C40547557_decoy,TRY1,Decoy,0,-6.29982,-6.24,-1.01,-4.017857350504382
Cc1ccc2oc(C(=O)Nc3sc4c(c3C(=O)N[C@H]3CCS(=O)(=O)C3)CC[C@H](C)C4)cc2c1,C41308342_decoy,TRY1,Decoy,0,-9.50495,-6.25,-1.92,-6.75091018868305
O=c1sc2ccccc2c(O)c1C(c1cccc([N+](=O)[O-])c1)c1c(O)c2ccccc2sc1=O,C15947235_decoy,TRY1,Decoy,0,-9.34252,-9.39,-1.18,-10.099200241434746
Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C/Nc3sc4c(c3C#N)CCC4)C2=O)cc1C,C16267915_decoy,TRY1,Decoy,0,-9.41904,-5.91,-2.11,-4.942394076571353
COc1ccc(Cl)cc1NC(=O)c1nn2c(c1Cl)N[C@@H](c1cccs1)C[C@@H]2C(F)(F)F,C00674011_decoy,TRY1,Decoy,0,-9.98286,-7.17,-2.59,-7.994106038387967
COc1ccc(Cl)cc1NC(=O)c1nn2c(c1Cl)N[C@H](c1cccs1)C[C@H]2C(F)(F)F,C00674014_decoy,TRY1,Decoy,0,-9.63836,-5.92,-1.78,-6.19170481499506
Cc1ccc(C2=NN=C3OC(N)=C(C#N)[C@H](c4ccccc4OC(=O)c4ccccc4Cl)[C@@H]32)cc1,C10013828_decoy,TRY1,Decoy,0,-6.67683,-6.48,-2.55,-5.054118945898412
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)cc3Cl)[C@H]2[C@@H]1c1ccc(OCc2ccccc2F)cc1,C08854849_decoy,TRY1,Decoy,0,-8.60268,-7.18,-3.85,-6.532449244242907
O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C1/C[C@H](c2ccc(F)cc2)Sc2ccccc2N1,C20899195_decoy,TRY1,Decoy,0,-9.72108,-7.9,-1.69,-5.948032149377585
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)cc3)[C@@H]2[C@H]1c1ccc(OCc2cccc(Cl)c2)cc1,C20437314_decoy,TRY1,Decoy,0,-7.61063,-8.7,-2.67,-6.199809948656795
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)cc3)[C@@H]2[C@@H]1c1ccc(OCc2cccc(Cl)c2)cc1,C20437310_decoy,TRY1,Decoy,0,-8.99538,-8.31,-1.55,-7.29867764965176
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)cc3)[C@H]2[C@H]1c1ccc(OCc2ccccc2Cl)cc1,C20495130_decoy,TRY1,Decoy,0,-8.53819,-6.44,-2.11,-5.991028220028727
O=C1C[C@@H](c2cccs2)CC2=C1[C@H](c1cc(Cl)ccc1O)[C@H]1C(=O)N(c3ccccc3)N=C1N2,C18196423_decoy,TRY1,Decoy,0,-8.1526,-8.8,-1.63,-6.533972952259815
O=C1c2cc(S(=O)(=O)N(CCO)CCO)ccc2-c2ccc(S(=O)(=O)N(CCO)CCO)cc21,C02290243_decoy,TRY1,Decoy,0,-9.18828,-6.12,-3.84,-9.315578916638472
NC(=O)c1c(NC(=O)COC(=O)CNS(=O)(=O)/C=C/c2ccccc2)sc2c1CCC2,C03314211_decoy,TRY1,Decoy,0,-8.76393,-7.74,-4.05,-6.559211717541238
Cn1c(=O)[nH]c(=O)c2c1nc(N(CCO)CCO)n2C[C@@H](O)COc1ccccc1,C08926045_decoy,TRY1,Decoy,0,-7.59769,-6.57,-3.47,-7.623670138602741
O=S(=O)(c1ccc(Cl)c(NC(=S)NNC(=S)Nc2cccnc2)c1)N1CCOCC1,C09562551_decoy,TRY1,Decoy,0,-8.41866,-5.5,-2.68,-5.328669449786887
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1NC(=O)CCCCCCSc1ccccc1[N+](=O)[O-],C09956623_decoy,TRY1,Decoy,0,-3.53873,-5.65,-4.13,-4.067682318740263
COc1ccc(OC[C@@H](O)Cn2c(NC[C@H](C)O)nc3c2c(=O)[nH]c(=O)n3C)cc1,C10385324_decoy,TRY1,Decoy,0,-8.56084,-5.77,-3.46,-5.675193539603631
COc1ccc(OC[C@@H](O)Cn2c(NC[C@@H](C)O)nc3c2c(=O)[nH]c(=O)n3C)cc1,C10385326_decoy,TRY1,Decoy,0,-7.87465,-7.31,-1.78,-6.993234597222427
COCCNC(=O)NC(=O)COC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C11440740_decoy,TRY1,Decoy,0,-8.35485,-5.93,-2.95,-5.712170909542552
CCOC(=O)[C@@](NC(=O)CCl)(Nc1ccc(S(N)(=O)=O)cc1)C(F)(F)F,C12412286_decoy,TRY1,Decoy,0,-9.06195,-5.31,-1.21,-6.109847514475276
CCOC(=O)CCCCCSc1nn([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05386305_decoy,TRY1,Decoy,0,-7.45338,-5.35,-3.22,-5.64094801841852
Cc1ccc(OC[C@H](O)Cn2c(NCCCO)nc3c2c(=O)[nH]c(=O)n3C)cc1C,C04371092_decoy,TRY1,Decoy,0,-7.90147,-6.48,-1.68,-5.545063737962116
O=C([O-])C[C@@H](NC(=O)CNC(=O)CCCNc1cccc[nH+]1)c1cccc([N+](=O)[O-])c1,C13472623_decoy,TRY1,Decoy,0,-8.06555,-6.15,-1.76,-5.818527047399487
Fc1ccc(NC(=S)Nc2cnn(Cn3cc(NC(=S)Nc4ccc(F)cc4)cn3)c2)cc1,C02799522_decoy,TRY1,Decoy,0,-9.6167,-7.9,-1.11,-8.04844491652905
CCCCN(C(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C14075349_decoy,TRY1,Decoy,0,-8.37203,-6.08,-2.17,-6.014026443003903
CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSc1nc(O)nc2[nH]cnc12,C14919991_decoy,TRY1,Decoy,0,-8.64126,-5.22,-2.49,-6.112699952713659
CCNc1ccc(S(=O)(=O)N(C)C)cc1NCC(=O)c1c(N)n(CC(C)C)c(=O)n(C)c1=O,C15366022_decoy,TRY1,Decoy,0,-8.52376,-8.13,-4.93,-8.815998905476611
CC(C)[C@@H](NC(=O)c1ccco1)C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C16045847_decoy,TRY1,Decoy,0,-9.96946,-7.91,-3.66,-7.722961271158964
CCOc1ccccc1C(=O)NCC(=O)O[C@@H](C)C(=O)Nc1sccc1C(N)=O,C16710612_decoy,TRY1,Decoy,0,-7.83828,-7.38,-2.73,-6.939522488641152
C/C(=C(\CCO)SCC/C(=N\O)c1ccccc1)N(C=O)Cc1cnc(C)nc1N,C17042309_decoy,TRY1,Decoy,0,-8.90736,-6.83,-3.95,-7.044106125363066
NC(=O)NCCCCCC(=O)NCCN1C(=O)S/C(=C\c2ccc(F)cc2)C1=O,C19681201_decoy,TRY1,Decoy,0,-8.4069,-7.2,-3.3,-10.90679051865638
COc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(F)(F)F)n[nH]2)cc1,C20832322_decoy,TRY1,Decoy,0,-7.85771,-7.71,-3.25,-8.501043798394782
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)NCc3ccco3)n2N)cn1,C20921462_decoy,TRY1,Decoy,0,-9.52724,-7.84,-3.84,-7.132385477508118
C=CCOC(=O)[C@@H](CSC(=O)[C@@]1([C@H](O)C(C)C)NC(=O)[C@H](C)[C@@H]1O)NC(C)=O,C22061818_decoy,TRY1,Decoy,0,-7.99574,-5.42,-1.59,-5.8944618313625226
CC(=O)N[C@@H](CC(=O)OCC(=O)Nc1sccc1C(N)=O)c1ccc(Cl)cc1,C23036886_decoy,TRY1,Decoy,0,-8.16597,-7.75,-2.01,-6.744547851637551
CC(=O)N[C@H](CC(=O)OCC(=O)Nc1sccc1C(N)=O)c1ccc(Cl)cc1,C23036887_decoy,TRY1,Decoy,0,-9.27773,-7.16,-1.81,-7.170189536740865
COCCOC(=O)c1c(NC(=O)CNc2ccc(N3CCCC3=O)c(C)c2)sc(C(N)=O)c1C,C25047001_decoy,TRY1,Decoy,0,-9.76194,-6.69,-1.4,-7.022553692941946
CC(C)COC(=O)N[C@@H](CNC(=O)[C@H]1CCCn2c(/C=C/C3CC[NH2+]CC3)nnc21)C(=O)[O-],C26579895_decoy,TRY1,Decoy,0,-8.42485,-6.67,-3.49,-7.267614894536785
O=C([O-])C[C@H](CC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccc(F)cc1,C29562832_decoy,TRY1,Decoy,0,-7.88331,-7.33,-3.83,-6.225700511908621
C=C(C(=O)OC)[C@H]1[C@H](O)[C@@H]2[C@@H](C=O)CC[C@@H](O)[C@@]2(C)C[C@@H]1OC(=O)C(=C)[C@@H](O)CO,C31170372_decoy,TRY1,Decoy,0,-9.35152,-5.82,-4.35,-6.332072358520484
C=C(C(=O)OC)[C@@H]1[C@H](O)[C@@H]2[C@H](C=O)CC[C@H](O)[C@]2(C)C[C@@H]1OC(=O)C(=C)[C@H](O)CO,C35271191_decoy,TRY1,Decoy,0,-7.72862,-6.26,-3.64,-6.17749314731373
CC1=C(CSc2nnc([C@H](CC(C)C)NC(=O)OC(C)(C)C)o2)C(=O)N[C@H](O)N1,C38581244_decoy,TRY1,Decoy,0,-9.49353,-7.01,-1.82,-7.304433008971414
CC1=C(CSc2nnc([C@H](CC(C)C)NC(=O)OC(C)(C)C)o2)C(=O)N[C@@H](O)N1,C38581245_decoy,TRY1,Decoy,0,-9.01267,-8.09,-2.39,-7.7870393255629535
CCOC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(OC)cc34)C2)S1,C39252329_decoy,TRY1,Decoy,0,-8.56209,-6.58,-3.05,-6.444598326586202
NC(=O)CSc1nnc(SCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)s1,C36663425_decoy,TRY1,Decoy,0,-9.48007,-6.89,-3.99,-7.103759791154872
CCOC(=O)[C@@H]1[C@H](C)[C@H](C(=O)NC)S[C@@H]1NC(=O)CSc1nc(C)c(CCC(=O)O)c(=O)[nH]1,C39667945_decoy,TRY1,Decoy,0,-10.1512,-5.59,-2.97,-6.31846613739181
CCOC(=O)[C@H]1[C@H](C)[C@H](C(=O)NC)S[C@@H]1NC(=O)CSc1nc(C)c(CCC(=O)O)c(=O)[nH]1,C39667946_decoy,TRY1,Decoy,0,-9.39021,-5.46,-3.72,-6.793506354885714
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)NCCNc1ncnc2sccc12,C40146926_decoy,TRY1,Decoy,0,-9.29647,-5.36,-3.75,-5.82013571358847
O=S1(=O)CC[C@H](CNC(=S)Nc2ccc(NC(=S)NC[C@@H]3CCS(=O)(=O)C3)cc2)C1,C40166790_decoy,TRY1,Decoy,0,-9.2327,-6.14,-3.16,-5.836619928234503
CC(C)[C@H](NC(=O)C[C@H](CNC(=O)[C@@H]1CSC[NH2+]1)c1ccc(Cl)cc1)C(=O)[O-],C43618908_decoy,TRY1,Decoy,0,-8.94072,-5.8,-1.6,-6.098332411287423
CC(C)CNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2cccs2)n1CCC(N)=O,C28949052_decoy,TRY1,Decoy,0,-8.95708,-6.73,-2.82,-6.931404775517128
CCCCNC(=O)CN1CCN([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C22931211_decoy,TRY1,Decoy,0,-10.4957,-6.54,-1.75,-8.428916228355712
CC(C)NC(=O)NC(=O)[C@H](C)OC(=O)c1cccnc1S[C@@H](C)C(=O)NC(=O)NC(C)C,C15654965_decoy,TRY1,Decoy,0,-8.06442,-7.8,-4.21,-6.721892518545224
CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSc1nc(N)c(C#N)cc1C#N,C20167572_decoy,TRY1,Decoy,0,-8.04428,-5.74,-3.48,-7.006265068597185
CCN(CC)c1ccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(C)=O)n[nH]2)cc1,C59878883_decoy,TRY1,Decoy,0,-8.6061,-5.21,-1.24,-5.739347858576413
C/C(=N\Nc1nc(SCC(=O)NCc2nnc(C(C)C)o2)n[nH]1)c1ccccc1O,C59883690_decoy,TRY1,Decoy,0,-8.41576,-8.42,-2.55,-9.2860710236166
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1,C59887540_decoy,TRY1,Decoy,0,-10.3046,-8.0,-1.75,-15.40025925012134
CCOc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59888115_decoy,TRY1,Decoy,0,-7.86775,-7.53,-2.12,-6.003578595183424
CC(=O)c1ccc(NC(=O)CCSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1,C59888203_decoy,TRY1,Decoy,0,-10.5607,-9.1,-1.97,-11.622239224590755
COc1ccc(C(=O)CSc2nnc(N/N=C/c3c(C)nn(CCO)c3C)n2N)cc1,C59914420_decoy,TRY1,Decoy,0,-9.94234,-8.57,-2.27,-7.793735553579885
COc1cc(/C=C/C(=O)OCCCn2cnc3c(N)ncnc32)ccc1OCC(N)=O,C60322321_decoy,TRY1,Decoy,0,-8.13162,-7.26,-2.64,-6.853894729433545
O=C(/C=C/c1ccc(O)cc1)c1ccc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04557380_decoy,TRY1,Decoy,0,-7.92248,-8.07,-2.39,-9.520331542614022
Nc1nc(N)nc(CCC2OCC3(CO2)COC(CCc2nc(N)nc(N)n2)OC3)n1,C02556809_decoy,TRY1,Decoy,0,-8.69493,-9.03,-3.12,-8.144984435130036
CC(C)[NH2+]C[C@@H](O)COc1ccccc1-c1ccccc1OC[C@@H](O)C[NH2+]C(C)C,C04655719_decoy,TRY1,Decoy,0,-7.64158,-6.26,-2.36,-9.181121930317444
CC(C)[NH2+]C[C@@H](O)COc1ccccc1-c1ccccc1OC[C@H](O)C[NH2+]C(C)C,C04655720_decoy,TRY1,Decoy,0,-9.01809,-5.99,-3.79,-8.386284144410155
CC(C)[NH2+]C[C@H](O)COc1ccccc1-c1ccccc1OC[C@@H](O)C[NH2+]C(C)C,C04655721_decoy,TRY1,Decoy,0,-7.51583,-6.19,-3.98,-7.106736801723953
CC(C)(C)[NH2+]C[C@H](O)COc1cc2ccccc2cc1OC[C@@H](O)C[NH2+]C(C)(C)C,C06832297_decoy,TRY1,Decoy,0,-8.09138,-6.13,-2.08,-7.585588969001174
CC(C)(C)[NH2+]C[C@@H](O)COc1cc2ccccc2cc1OC[C@H](O)C[NH2+]C(C)(C)C,C06832299_decoy,TRY1,Decoy,0,-9.59028,-6.18,-2.26,-8.740575357534214
OCC[NH+](CCO)Cc1c2ccccc2c(C[NH+](CCO)CCO)c2ccccc12,C01504820_decoy,TRY1,Decoy,0,-5.94893,-5.99,-2.33,-4.72941290211667
COc1cccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1O,C09975164_decoy,TRY1,Decoy,0,-8.27778,-7.82,-1.77,-7.171695094467026
COc1cccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1O,C09975165_decoy,TRY1,Decoy,0,-7.69564,-7.98,-1.84,-8.433739132925718
C/C(Cc1ccccc1)=N\Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975257_decoy,TRY1,Decoy,0,-7.44349,-7.62,-0.95,-7.696423051519692
CCOc1ccccc1/C=N\Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C12340635_decoy,TRY1,Decoy,0,-7.16862,-7.19,-1.68,-6.852864060567522
CC1(C)CC(NC(=O)CCCCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C04256094_decoy,TRY1,Decoy,0,-8.37803,-6.44,-1.72,-6.081153829392237
COc1cccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1O,C08918578_decoy,TRY1,Decoy,0,-8.78347,-8.71,-1.8,-9.017643300418372
OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](Nc3ccccc3)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,C08740345_decoy,TRY1,Decoy,0,-5.84524,-6.32,-1.43,-6.3301769301814375
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C08740491_decoy,TRY1,Decoy,0,-7.57713,-7.81,-1.0,-7.90014723370026
OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](Nc3ccccc3)O[C@@H]2CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13549813_decoy,TRY1,Decoy,0,-6.19232,-6.89,-4.3,-5.889026092317159
OC[C@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](Nc3ccccc3)O[C@@H]2CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13549819_decoy,TRY1,Decoy,0,-6.04383,-6.24,-3.05,-4.4922246497862846
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CC2(O)CCCCC2)c1,C15066574_decoy,TRY1,Decoy,0,-8.60631,-6.94,-1.65,-7.797456764464652
CC(C)[NH2+]C[C@@H](O)COc1ccccc1-c1ccccc1OC[C@@H](O)C[NH2+]C(C)C,C17144024_decoy,TRY1,Decoy,0,-7.84062,-4.61,-2.28,-5.6855625643020495
CC(C)(C)[NH2+]C[C@@H](O)COc1cc2ccccc2cc1OC[C@@H](O)C[NH2+]C(C)(C)C,C17144034_decoy,TRY1,Decoy,0,-9.50034,-6.12,-2.19,-8.82064365576105
O=c1[nH]cnc2c1nc(N1CCN(C[C@H](O)CO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C16546180_decoy,TRY1,Decoy,0,-9.6434,-5.37,-1.83,-5.841057741186616
O=c1[nH]cnc2c1nc(N1CCN(C[C@@H](O)CO)CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C16546186_decoy,TRY1,Decoy,0,-8.85055,-4.73,-1.65,-5.435981471529884
Nc1nc(N[C@@H](O)C(Cl)(Cl)Cl)nc(N[C@H](O)C(Cl)(Cl)Cl)n1,C25666835_decoy,TRY1,Decoy,0,-8.23661,-6.31,-3.93,-9.066473911392498
O=C(/C=C/c1ccc(O)cc1)c1ccc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C25692245_decoy,TRY1,Decoy,0,-7.47948,-8.44,-2.27,-7.101232559316393
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH+](C)Cc2[nH]c(C)c[nH+]2)c1,C20149065_decoy,TRY1,Decoy,0,-7.04617,-6.13,-1.8,-5.586843411181064
C[C@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C34921295_decoy,TRY1,Decoy,0,-8.92576,-7.89,-2.5,-8.505457364561758
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645717_decoy,TRY1,Decoy,0,-5.44012,-7.8,-3.7,-5.692688634379416
C/C(=C/Cc1c(O)ccc2cc(O)c(=O)oc12)CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C36378685_decoy,TRY1,Decoy,0,-6.96353,-7.78,-2.46,-5.783391039776677
N#C[C@@H](O[C@H]1O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O)c1ccccc1,C34934401_decoy,TRY1,Decoy,0,-4.18547,-6.39,-3.1,-3.9863262189740274
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)cc1,C01753482_decoy,TRY1,Decoy,0,-8.16921,-7.44,-1.89,-7.082347441476753
C/C(=C\Cc1c(O)ccc2cc(O)c(=O)oc12)CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C39560192_decoy,TRY1,Decoy,0,-7.04616,-8.85,-2.4,-7.744224205890276
COc1ccc(N/N=C(\[C@@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@@H](O)[C@H](O)CO)cc1,C40151194_decoy,TRY1,Decoy,0,-8.84257,-5.7,-2.12,-5.8380975437142455
O=C(N/N=C(\[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccccc1Cl,C40151221_decoy,TRY1,Decoy,0,-8.12317,-8.25,-1.57,-7.958011693553112
O=C(N/N=C(\[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@@H](O)[C@H](O)CO)c1ccccc1Cl,C40151225_decoy,TRY1,Decoy,0,-9.34161,-8.43,-2.88,-9.270733821147385
NC(=O)c1c(Nc2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301776_decoy,TRY1,Decoy,0,-8.95041,-7.34,-3.02,-8.025807800593793
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C44135698_decoy,TRY1,Decoy,0,-5.70656,-5.3,-2.16,-4.343691998051043
Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44960163_decoy,TRY1,Decoy,0,-6.18217,-7.86,-1.76,-6.632236014854015
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44960171_decoy,TRY1,Decoy,0,-6.33581,-6.64,-2.7,-6.108654669573381
CCNc1cc(/C=C/c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc[nH+]1,C52627563_decoy,TRY1,Decoy,0,-10.2825,-8.3,-2.97,-7.8411196190195644
O=c1[nH]cnc2c1nc(N1CCN(C[C@@H](O)CO)CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C59369417_decoy,TRY1,Decoy,0,-8.11896,-6.74,-1.45,-7.088849645497196
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](Nc3ccccc3)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,C08740123_decoy,TRY1,Decoy,0,-5.19775,-7.19,-2.6,-5.720945581415849
CC1(C)CC(NC(=O)C(=O)NCCNC(=O)[C@H]2C=c3ccccc3=[NH+]2)CC(C)(C)[NH2+]1,C63366949_decoy,TRY1,Decoy,0,-8.03148,-6.09,-1.42,-5.299690319880149
[NH3+][C@@H]1N=Nc2[nH+]c(NCCCN3CCOCC3)c3c(c21)CC[NH+](C1CCCCC1)C3,C38752373_decoy,TRY1,Decoy,0,-10.8102,-8.75,-1.64,-10.76239100341637
[NH3+][C@H]1N=Nc2[nH+]c(NCCCN3CCOCC3)c3c(c21)CC[NH+](C1CCCCC1)C3,C38752377_decoy,TRY1,Decoy,0,-9.43453,-7.27,-0.48,-8.251919740827306
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCC(=O)c2ccc(Cl)cc2)O1,C63985176_decoy,TRY1,Decoy,0,-9.51618,-8.1,-2.25,-7.864610190068083
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@H](SCC(=O)c2ccc(Cl)cc2)O1,C63985177_decoy,TRY1,Decoy,0,-7.98871,-7.44,-1.84,-6.00907657319804
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@@H](SCC(=O)c2ccc(Cl)cc2)O1,C63985178_decoy,TRY1,Decoy,0,-9.21519,-7.56,-2.12,-6.1891848154471285
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@@H](SCC(=O)c2ccc(Cl)cc2)O1,C63985179_decoy,TRY1,Decoy,0,-8.5011,-6.2,-1.99,-4.939116878923363
CC[NH+](CC)CCCN1c2nc(C#N)c(C#N)nc2[C@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1[NH3+],C64162151_decoy,TRY1,Decoy,0,-8.97978,-6.21,-1.18,-5.9913078262429895
CCc1cc2c(=O)c(-c3nc(C)cs3)c([C@H](C)[NH3+])oc2cc1OC(=O)[C@@H](C)[NH3+],C01882462_decoy,TRY1,Decoy,0,-10.0215,-6.7,-1.44,-8.299086393466592
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C,C04353342_decoy,TRY1,Decoy,0,-7.76563,-6.98,-1.09,-6.254943082306614
NC(=O)NC(=O)CSc1nnc(SCC(=O)NC(N)=O)s1,C03395074_decoy,TRY1,Decoy,0,-7.65743,-5.96,-2.61,-6.296850001307993
Nc1nnc(SCc2nnc(CSc3nnc(N)s3)n2N)s1,C02190567_decoy,TRY1,Decoy,0,-10.2086,-7.61,-1.94,-9.044464123259669
CCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C04544392_decoy,TRY1,Decoy,0,-3.66567,-4.27,-1.91,-3.107705916537848
[NH3+]CC(=O)N[C@@H](CSSC[C@H](NC(=O)C[NH3+])C(=O)[O-])C(=O)[O-],C05328769_decoy,TRY1,Decoy,0,-9.79113,-4.97,-4.47,-6.363215910749482
[NH3+]CC(=O)N[C@H](CSSC[C@@H](NC(=O)C[NH3+])C(=O)[O-])C(=O)[O-],C05328789_decoy,TRY1,Decoy,0,-9.15462,-4.13,-2.75,-5.887448567290627
Cc1ccc(C2=NN[C@H]([C@@](C)(O)[C@](C)(O)[C@](C)(O)[C@](C)(O)CO)S2)cc1,C06204415_decoy,TRY1,Decoy,0,-8.74753,-5.33,-1.76,-7.601665246603499
O=C1Nc2ccccc2N=C(c2ccccc2)/C1=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C12376593_decoy,TRY1,Decoy,0,-6.47491,-6.96,-2.34,-6.843704214817458
CO[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1NC(C)=O,C13515140_decoy,TRY1,Decoy,0,-4.21104,-5.79,-1.5,-4.143488467337229
[NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)[O-],C04545903_decoy,TRY1,Decoy,0,-8.11617,-5.56,-3.68,-6.434354378338985
[NH3+][C@H](CCSSCC[C@@H]([NH3+])C(=O)NCC(=O)[O-])C(=O)NCC(=O)[O-],C05698919_decoy,TRY1,Decoy,0,-10.4504,-4.66,-3.0,-6.200581114488522
O=C(CO)C1=CO[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(CO)=CC[C@H]12,C21992890_decoy,TRY1,Decoy,0,-8.27278,-5.34,-3.32,-5.11172400425004
[NH3+][C@@H](CSCCOCCOCCSC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C22052244_decoy,TRY1,Decoy,0,-7.97069,-4.39,-3.68,-5.223195319799252
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C22059820_decoy,TRY1,Decoy,0,-5.55823,-5.09,-3.75,-4.289079481227011
CS(=O)(=O)SCCNC(=O)N[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C02576410_decoy,TRY1,Decoy,0,-7.6443,-5.47,-2.34,-5.784406575078166
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C22059826_decoy,TRY1,Decoy,0,-5.98877,-5.48,-2.32,-4.44938501546361
CS(=O)(=O)SCCNC(=O)N[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C22059829_decoy,TRY1,Decoy,0,-6.78487,-4.78,-3.98,-4.306297984433175
CC1=CC(=O)C[C@@](C)(CO)[C@@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31168186_decoy,TRY1,Decoy,0,-7.3549,-6.26,-2.79,-4.880980895311211
CCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O,C31169032_decoy,TRY1,Decoy,0,-4.69872,-6.7,-2.34,-5.765208336078573
O=C[C@H](O)[C@@H](O)[C@H](S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,C31543379_decoy,TRY1,Decoy,0,-6.63454,-5.2,-1.53,-5.213060106812343
CS(=O)(=O)SCCNC(=O)N[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C33875496_decoy,TRY1,Decoy,0,-7.65912,-5.43,-2.18,-5.837990849147437
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C33875498_decoy,TRY1,Decoy,0,-6.66005,-5.11,-2.27,-4.747504725055726
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1NC(C)=O,C33851452_decoy,TRY1,Decoy,0,-5.01488,-4.43,-2.29,-4.243667167793927
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]1NC(C)=O,C33851455_decoy,TRY1,Decoy,0,-5.54214,-4.91,-2.21,-4.576289087533358
C[C@H](O)CCCc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,C31158986_decoy,TRY1,Decoy,0,-7.09082,-6.67,-1.11,-6.894205244930999
C[C@H](O)[C@@H]([NH3+])[C@@H]1[N-][C@H](Cc2c[nH]c3cccc(F)c23)C(=[OH+])N1CC(=O)[O-],C38664656_decoy,TRY1,Decoy,0,-7.38914,-6.72,-2.1,-6.161292373832104
C=C[C@](C)(O)CC[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C31159578_decoy,TRY1,Decoy,0,-8.32959,-5.43,-2.95,-6.198488520229072
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1/C(=N\Nc1ccccc1F)[C@H](O)[C@H](O)CO,C40151099_decoy,TRY1,Decoy,0,-7.71458,-7.08,-0.8,-5.918376081917097
Cc1ccc(C(=O)N/N=C(\[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)cc1,C40151260_decoy,TRY1,Decoy,0,-8.05429,-8.56,-1.47,-7.795948054976742
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C44135839_decoy,TRY1,Decoy,0,-6.95727,-4.87,-2.38,-5.2602092496826005
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C44135842_decoy,TRY1,Decoy,0,-7.51171,-7.64,-2.81,-7.67214792255802
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O,C44135845_decoy,TRY1,Decoy,0,-7.64579,-6.41,-2.76,-8.375230292311645
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O,C44135848_decoy,TRY1,Decoy,0,-8.02234,-4.59,-1.81,-4.878841388999819
Cc1ncc(C[n+]2csc(CCO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c2C)c(N)n1,C44171040_decoy,TRY1,Decoy,0,-6.55895,-6.59,-1.7,-4.854765977265827
CS(=O)(=O)SCCNC(=O)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C44608392_decoy,TRY1,Decoy,0,-6.51206,-5.2,-3.35,-4.892817553217418
CC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C44960068_decoy,TRY1,Decoy,0,-5.17073,-5.18,-3.78,-4.724938850300726
C[NH2+]CC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H]([C@@H]2C=CC(N)=NC2=O)O[C@@H]1C(N)=O,C40802328_decoy,TRY1,Decoy,0,-6.57472,-5.43,-3.04,-6.786136448056466
C[NH2+]CC(=O)N[C@@H](CO)C(=O)N[C@H]1[C@H](O)[C@H](O)[C@H]([C@@H]2C=CC(N)=NC2=O)O[C@@H]1C(N)=O,C40802337_decoy,TRY1,Decoy,0,-7.42471,-6.54,-2.37,-7.089566612683151
C[NH2+]CC(=O)N[C@H](CO)C(=O)N[C@H]1[C@H](O)[C@H](O)[C@H]([C@@H]2C=CC(N)=NC2=O)O[C@@H]1C(N)=O,C40802341_decoy,TRY1,Decoy,0,-6.67979,-5.53,-1.67,-4.571532506305459
[NH3+][C@@H](CNc1nccc(-c2ccncc2)n1)[C@@H](O)C1=c2ccccc2=[NH+]C1,C52569930_decoy,TRY1,Decoy,0,-7.52192,-5.32,-1.2,-4.6958419337011135
Cc1sc2nc(CC[NH3+])nc(NC[C@@H]3CCC[NH+](CCO)C3)c2c1C,C65460502_decoy,TRY1,Decoy,0,-10.5141,-5.85,-1.57,-9.235543989710342
CC(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2NC(C)=O)O[C@@H]1O,C34264954_decoy,TRY1,Decoy,0,-5.97151,-5.08,-1.2,-4.416624463700039
CC(=O)N[C@H]1[C@@H](OC[C@@H]2O[C@H](O)[C@@H](NC(C)=O)[C@@H](O)[C@@H]2O)O[C@@H](CO)[C@@H](O)[C@H]1O,C34264957_decoy,TRY1,Decoy,0,-5.50984,-6.05,-2.48,-4.577583904873711
CC(=O)N[C@@H]1[C@H](O)[C@H](O[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C65733890_decoy,TRY1,Decoy,0,-5.04681,-5.05,-2.15,-4.237154981304757
CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C65733894_decoy,TRY1,Decoy,0,-5.36939,-6.45,-2.04,-4.934505746599792
C[NH2+]C[C@H](O)c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C65740711_decoy,TRY1,Decoy,0,-6.42118,-6.76,-2.83,-5.575030068763498
C[NH2+]C[C@@H](O)c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c(O)c1,C65740714_decoy,TRY1,Decoy,0,-5.94705,-6.42,-1.04,-4.748314846515181
C[NH2+]C[C@H](O)c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c(O)c1,C65740715_decoy,TRY1,Decoy,0,-6.51505,-6.67,-2.62,-5.551785059727394
C[NH2+]C[C@@H](O)c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c(O)c1,C65740717_decoy,TRY1,Decoy,0,-6.60496,-6.34,-3.26,-5.300895189298243
CCOP(=O)(CCC[C@@H](O)CNc1cc(Cl)nc(N)n1)OCC,C01645802_decoy,TRY1,Decoy,0,-8.64147,-5.67,-1.91,-8.437839783026536
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]([NH2+]CCOCCO)C(=O)[O-],C04939715_decoy,TRY1,Decoy,0,-5.92087,-5.8,-3.76,-5.77501353409063
CCOc1ccc(NC(=O)C[C@@H]([NH2+]CCCO)C(=O)[O-])c([N+](=O)[O-])c1,C04939762_decoy,TRY1,Decoy,0,-5.16392,-5.83,-2.69,-4.78342140360055
CCCCCC[NH2+][C@@H](CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)[O-],C05257966_decoy,TRY1,Decoy,0,-7.64225,-6.2,-4.66,-5.7720205249507
CCOC(=O)c1c(NC(=O)C[C@H]([NH2+]CCCO)C(=O)[O-])sc2c1CCCC2,C05258930_decoy,TRY1,Decoy,0,-8.99816,-5.46,-3.63,-5.742546420865351
CCCCc1nnc(SCCCSc2nnc(CCCC)n2N)n1N,C05483003_decoy,TRY1,Decoy,0,-9.0608,-6.41,-1.48,-7.4989240466800675
COCCNC(=S)/N=C(\NCCc1c[nH]cn1)Nc1nc(C)cc(C)n1,C14156553_decoy,TRY1,Decoy,0,-8.0843,-6.34,-1.8,-7.980975466815449
CCCCCOC[C@H]1C[C@](C/C(C)=N/NC(N)=O)(C(=O)OCC)[C@@H](O)O1,C16158043_decoy,TRY1,Decoy,0,-6.98489,-5.74,-4.22,-6.002497313744327
CCC[C@@H](NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO)c1ccccc1,C25607021_decoy,TRY1,Decoy,0,-7.56617,-6.67,-2.28,-7.707897270991684
CCCCCNC(=S)NNC(=O)[C@@H](NC(=O)c1ccco1)C(C)C,C26680282_decoy,TRY1,Decoy,0,-7.79495,-6.52,-2.14,-6.531417441343104
CCCCC[C@@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)OC[C@@H](O)CO,C27639288_decoy,TRY1,Decoy,0,-10.599,-7.28,-2.84,-8.409350371149989
CCCCC[C@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@H]1C/C=C\CCCC(=O)OC[C@@H](O)CO,C27639305_decoy,TRY1,Decoy,0,-9.64293,-5.04,-2.93,-6.413449003570954
CC[C@@](CO)(COC(=O)CCCCC[NH3+])COC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-],C05923816_decoy,TRY1,Decoy,0,-9.29494,-6.05,-2.58,-7.801961550817702
CCCCCNC(=S)NNC(=O)/C=C/c1ccc(S(=O)(=O)NCC)cc1,C31487245_decoy,TRY1,Decoy,0,-8.51871,-5.72,-4.01,-5.899456205938502
CCCCCC(=O)N(Cc1ccco1)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36504052_decoy,TRY1,Decoy,0,-7.88275,-6.82,-3.64,-8.78737803604975
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CCCC,C36507259_decoy,TRY1,Decoy,0,-7.97542,-5.72,-3.18,-8.005810963128248
CCCCCCN(C(=O)CCS)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36515393_decoy,TRY1,Decoy,0,-9.37878,-6.24,-2.43,-9.404025517227064
O=C(NCCCCCCNC(=O)NCc1ccco1)NCc1ccco1,C04774933_decoy,TRY1,Decoy,0,-6.94301,-6.74,-3.85,-6.332994637427377
CC1(C)C[C@H]1C(=O)N/C(=C/CCCCSC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C01529258_decoy,TRY1,Decoy,0,-8.25478,-5.2,-1.54,-6.058265683335958
CCc1c(C)[nH]c(NCCCCCCNc2nc(C)c(CC)c(=O)[nH]2)nc1=O,C16809340_decoy,TRY1,Decoy,0,-8.03565,-5.77,-3.35,-5.632960383124885
C=CCNC(=S)NNC(=O)CCNS(=O)(=O)/C=C/c1ccccc1,C41962374_decoy,TRY1,Decoy,0,-8.04592,-6.77,-1.36,-8.806082548772359
CCCC[C@@H](CC)CNC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42842195_decoy,TRY1,Decoy,0,-7.85981,-5.73,-1.98,-5.841469632939655
CCCC[C@H](CC)CNC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42842197_decoy,TRY1,Decoy,0,-8.24691,-6.27,-1.59,-5.901443675535538
CCCCOCCCNC(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42898502_decoy,TRY1,Decoy,0,-7.64853,-5.49,-2.24,-5.485660075661626
CCCCOCCCNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1,C43038881_decoy,TRY1,Decoy,0,-8.82414,-5.65,-2.97,-5.9536487428598015
CCCCC[C@@H](O)/C=C/[C@H]1[C@@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)OC[C@H](O)CO,C43771982_decoy,TRY1,Decoy,0,-10.4621,-5.44,-1.54,-6.923455746150158
O=C(CCS)OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)COC(=O)CCS,C05113750_decoy,TRY1,Decoy,0,-11.3005,-4.43,-2.15,-8.606307535121491
CCOCCCNC(=S)NNC(=O)[C@@H](NC(=O)CC(C)C)C(C)C,C58876197_decoy,TRY1,Decoy,0,-8.07246,-6.05,-2.7,-6.686411510170633
CC(=O)NC/C(C)=N\NC(=O)CCCCC(=O)N/N=C(\C)CNC(C)=O,C59502044_decoy,TRY1,Decoy,0,-6.75042,-6.24,-2.13,-6.498291473233555
C=CCNC(=O)CCSc1n[nH]c(N/N=C/c2cccc(CC=C)c2O)n1,C59813567_decoy,TRY1,Decoy,0,-9.25159,-6.91,-1.98,-9.732767856682212
NC(=O)CSCC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1,C60396565_decoy,TRY1,Decoy,0,-7.65597,-6.01,-2.39,-7.269141708462838
CCOCCCNC(=S)NNC(=O)CCCNC(=O)c1ccco1,C60400331_decoy,TRY1,Decoy,0,-6.76889,-6.03,-2.71,-6.846014386334958
CCOCCCNC(=S)NNC(=O)C[C@H](NC(C)=O)c1cccs1,C60400473_decoy,TRY1,Decoy,0,-8.21709,-6.35,-3.01,-7.216394587216698
CCOCCCNC(=S)NNC(=O)CN1C(=O)NC(CC)(CC)C1=O,C60400653_decoy,TRY1,Decoy,0,-7.60798,-5.35,-3.19,-5.432897055614949
CCOC(=O)N[C@H](CNC(=O)NCCNC(=O)C(C)C)CC(C)C,C61285894_decoy,TRY1,Decoy,0,-7.8518,-6.45,-2.04,-6.1632490071747705
CCOC(=O)N[C@H](CNC(=O)NCCNS(C)(=O)=O)CC(C)C,C48559244_decoy,TRY1,Decoy,0,-8.02027,-5.34,-1.62,-5.35051240094941
CCOCCOc1c(Cl)cccc1NC(=O)CCCCNC(N)=O,C63264573_decoy,TRY1,Decoy,0,-8.34037,-6.32,-2.71,-7.771903748249667
CCCCC[C@@H](C)CNC(=S)NNC(=O)[C@H](CCC)NC(N)=O,C63665662_decoy,TRY1,Decoy,0,-7.35049,-5.76,-2.06,-5.183317421640784
CC(C)CNC(=O)CNC(=O)CC[C@H](C)CC(=O)NCC(=O)NCC(C)C,C64405097_decoy,TRY1,Decoy,0,-8.50582,-5.88,-2.92,-6.186423497022891
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)NCCOC,C64899741_decoy,TRY1,Decoy,0,-7.10857,-6.14,-1.38,-6.075082499588236
CCOC(=O)Cc1csc(NC(=O)C[C@H]([NH2+]CCCO)C(=O)[O-])n1,C65090378_decoy,TRY1,Decoy,0,-7.63565,-4.36,-1.95,-6.107270516557852
COCCCNC(=O)NNC(=O)c1[nH]c(C)c(C(=O)OCCOC)c1C,C65205174_decoy,TRY1,Decoy,0,-7.36745,-4.36,-4.59,-4.568840613896155
COCCCNC(=O)NNC(=O)CCCNc1ccc([N+](=O)[O-])cc1,C65207351_decoy,TRY1,Decoy,0,-5.92299,-5.26,-2.31,-4.70571554326349
CCOC(=O)N[C@H](CNC(=O)NCCCNS(=O)(=O)CC)CC(C)C,C65380066_decoy,TRY1,Decoy,0,-7.82393,-5.77,-2.88,-7.269800481591392
CCCCC[C@@H](C)CNC(=S)NNC(=O)[C@H](CCCC)NC(N)=O,C65580849_decoy,TRY1,Decoy,0,-7.63138,-5.81,-3.87,-5.500949079403008
CCCCCN(CC(=O)NCC#N)c1c(N)n(CCCC)c(=O)[nH]c1=O,C66491966_decoy,TRY1,Decoy,0,-7.49056,-5.83,-3.57,-7.142434424213302
COCCNC(=O)CCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21,C67232173_decoy,TRY1,Decoy,0,-8.31007,-6.0,-3.3,-6.570085596445807
COCCCNC(=O)NNC(=O)CCCCCCNC(=O)OC(C)(C)C,C67237037_decoy,TRY1,Decoy,0,-7.71596,-5.56,-3.07,-6.2910280628966575
CCOCCCNC(=O)NNC(=O)CCNC(=O)N(C)Cc1ccccc1,C67271329_decoy,TRY1,Decoy,0,-6.86011,-5.89,-2.61,-5.142569096289443
CCOCCCNC(=O)NNC(=O)CSCC(=O)Nc1cc(C)on1,C67313685_decoy,TRY1,Decoy,0,-8.89053,-6.07,-3.96,-6.714855978321107
OC[C@@H](O)Cn1c(SCCSc2nc3ccccc3n2C[C@H](O)CO)nc2ccccc21,C03766933_decoy,TRY1,Decoy,0,-10.3296,-7.18,-1.94,-7.19779824546676
COc1ccccc1NC(=S)NC(=S)C(=S)NC(=S)Nc1ccccc1OC,C01681388_decoy,TRY1,Decoy,0,-7.60357,-5.51,-1.47,-6.045921173837585
CCOC(=O)[C@](NC(=O)CC)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C05950699_decoy,TRY1,Decoy,0,-9.02993,-5.45,-1.25,-6.848210978981266
CCC[C@H](C(=O)NC(C)(C)C)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06501278_decoy,TRY1,Decoy,0,-6.69621,-6.1,-3.2,-6.746399227800422
CCCn1c(N)c(C(=O)CNc2ccccc2SCc2ccccc2)c(=O)[nH]c1=O,C09155519_decoy,TRY1,Decoy,0,-7.36543,-6.62,-2.37,-5.451923079084832
CCOCCOc1ccc(C(=O)NC(=S)Nc2sc(C)c(C)c2C(N)=O)cc1,C09820856_decoy,TRY1,Decoy,0,-8.87615,-6.02,-2.47,-5.681568675595121
CCCCN(C(=O)COC(=O)c1cccc(O)c1)c1c(N)n(CCC)c(=O)[nH]c1=O,C10529690_decoy,TRY1,Decoy,0,-7.28025,-7.16,-2.65,-7.125210002990241
CCOC(=O)CCC(=O)NC(=S)NNC(=O)CCC(=O)Nc1ccc(C)c(C)c1,C06655447_decoy,TRY1,Decoy,0,-7.78606,-6.01,-3.79,-5.556457016656805
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12,C13132164_decoy,TRY1,Decoy,0,-9.64483,-7.41,-2.74,-6.927855406869066
O=C(/C=C/c1cccs1)NC(=S)NNC(=O)CCC(=O)Nc1ccccc1Cl,C13979408_decoy,TRY1,Decoy,0,-9.14659,-5.92,-4.19,-6.278312765963247
CCCCCN(C(=O)c1ccc(NC(C)=O)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697832_decoy,TRY1,Decoy,0,-7.8861,-4.21,-3.67,-5.327283815004921
COC(=O)c1c(NC(=O)[C@H]2CCOC2)c2cc(NC[C@H](O)CO)cnc2n1CCCc1ccccc1,C14747020_decoy,TRY1,Decoy,0,-8.40946,-6.43,-2.47,-8.267896208932225
C=C[C@@]1(C)C[C@H](OC(=O)C(=C)[C@@H](O)CO)[C@H](C(=C)C(=O)OC)[C@H](O)[C@H]1C(=C)CO,C14781596_decoy,TRY1,Decoy,0,-7.77162,-5.1,-4.11,-5.184960843480607
Nc1nc(COC(=O)CCNC(=O)CCC(=O)c2cccs2)nc(Nc2ccccc2)n1,C16368438_decoy,TRY1,Decoy,0,-9.23851,-7.38,-3.56,-7.067101339194278
COc1ccccc1Nc1nc(N)nc(COC(=O)CNC(=O)c2ccccc2C)n1,C16658161_decoy,TRY1,Decoy,0,-8.1085,-7.03,-3.35,-6.853574595362042
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C17274851_decoy,TRY1,Decoy,0,-8.92733,-7.87,-3.14,-8.286696400332623
CCOc1ccc(NC(=O)/C=C(\C)NNC(=O)C(=O)Nc2cc(C)ccc2OC)cc1,C20176578_decoy,TRY1,Decoy,0,-8.21157,-7.48,-1.71,-6.112439853994501
CC(=O)Nc1ccc(S(=O)(=O)N2CC[C@@H](CC(=O)[O-])[C@@H](CC[NH+]3CCC[C@H]3C(N)=O)C2)cc1,C20463030_decoy,TRY1,Decoy,0,-8.83876,-6.8,-2.36,-6.359176853581168
CCOc1ccc(/C=N/Nc2nnc(SCC(=O)Nc3nccs3)n2N)cc1,C20528005_decoy,TRY1,Decoy,0,-10.0195,-7.58,-2.5,-7.436842650707862
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2ccccc2F)n1N,C20528140_decoy,TRY1,Decoy,0,-8.17656,-7.79,-2.9,-7.100070229718631
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3ccccc3C#N)n[nH]2)c1O,C20832680_decoy,TRY1,Decoy,0,-8.61541,-8.06,-3.97,-6.84851662195302
COc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2cccc(O)c2)n1,C20906644_decoy,TRY1,Decoy,0,-8.7894,-8.72,-3.25,-10.948065481219258
Cc1ccc(NC(=O)CCSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)c(C)c1,C20921317_decoy,TRY1,Decoy,0,-9.64956,-8.88,-3.27,-8.90351388065849
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)Nc3ccc(F)cc3)n2N)cn1,C20921727_decoy,TRY1,Decoy,0,-8.35652,-8.74,-2.72,-6.791726823307726
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccccc3)n2)c1,C21036738_decoy,TRY1,Decoy,0,-8.58271,-9.12,-1.9,-7.369061178970398
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccco3)n2)c1,C21076539_decoy,TRY1,Decoy,0,-8.61567,-8.69,-2.71,-7.406110031861014
COc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1,C21078157_decoy,TRY1,Decoy,0,-8.57323,-7.89,-4.38,-7.232442751427008
COc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3ccccc3)n[nH]2)c1O,C21079871_decoy,TRY1,Decoy,0,-9.31321,-7.93,-3.54,-7.721595093071066
CN(C)c1cccc2c([S@](=O)ONCCSSCCC(=O)NN)cccc12,C22055418_decoy,TRY1,Decoy,0,-9.15648,-6.72,-1.19,-6.754039544453251
CCCCN(C(=O)COC(=O)c1cc(C)ccc1O)c1c(N)n(CCC)c(=O)[nH]c1=O,C24918752_decoy,TRY1,Decoy,0,-7.63122,-6.76,-1.64,-7.031745890473863
Cc1cc(OCCCON=C(N)N)cc(C(=O)N(Cc2ccncc2)CC2CC2)c1,C27207213_decoy,TRY1,Decoy,0,-6.598,-7.04,-2.41,-6.906946814309693
C=C[C@]1(C)C[C@@H](OC(=O)C(=C)[C@H](O)CO)[C@H](C(=C)C(=O)OC)[C@H](O)[C@@H]1C(=C)CO,C35271762_decoy,TRY1,Decoy,0,-9.16927,-4.89,-3.25,-6.651157185074439
Cc1ccccc1Nc1nc(N)nc(COC(=O)[C@H](NC(=O)c2ccco2)C(C)C)n1,C03419462_decoy,TRY1,Decoy,0,-7.6578,-6.13,-1.55,-5.203844109760053
CCCCn1c(N)c(N(CCOC)C(=O)CCNC(=O)c2ccccc2Cl)c(=O)[nH]c1=O,C14624739_decoy,TRY1,Decoy,0,-8.05624,-6.8,-4.07,-6.188533977874555
CCCCN1C(=O)N=C([O-])[C@@H](N(CCC)C(=O)CCc2c[nH]c3ccccc23)[C@@H]1[NH3+],C38509859_decoy,TRY1,Decoy,0,-6.40684,-5.33,-2.65,-5.446035645695147
CCOC(=O)c1c(C)[nH]c(C(=O)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1-c1ccc(F)cc1,C38790509_decoy,TRY1,Decoy,0,-9.47808,-7.67,-4.63,-7.467286568986296
CCOc1cccc(/C=N/NC(=O)CCC(=O)N/N=C/c2cccc(OCC)c2O)c1O,C19635836_decoy,TRY1,Decoy,0,-9.47239,-4.93,-1.86,-6.96118394004541
CCOC(=O)C1=C(CNC(=O)C(=O)NC(C)C)NC(=O)N[C@H]1c1ccc(OC)cc1,C40158674_decoy,TRY1,Decoy,0,-7.51444,-5.47,-1.9,-5.8005685420325
[H]/N=C(\Nc1nc(CSc2nnc(C)s2)cc(=O)[nH]1)Nc1ccc(OC)cc1OC,C20503053_decoy,TRY1,Decoy,0,-8.87312,-7.29,-2.08,-6.173679971442656
S=C(NCc1cccc(CNC(=S)NC[C@@H]2CCCO2)c1)NC[C@H]1CCCO1,C16237833_decoy,TRY1,Decoy,0,-10.5939,-5.65,-2.23,-6.46850180060452
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)NCCc1ccc(F)cc1,C58994269_decoy,TRY1,Decoy,0,-10.4754,-10.08,-1.85,-9.253965006718758
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3nncs3)n[nH]2)c1O,C59004733_decoy,TRY1,Decoy,0,-8.27115,-7.24,-2.79,-9.581743667427896
CCOc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)cc1,C59015354_decoy,TRY1,Decoy,0,-9.03399,-8.76,-1.78,-8.082041531357103
COc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cccc(OC)c2O)n1,C59016773_decoy,TRY1,Decoy,0,-8.94719,-7.87,-2.33,-6.88764782447856
Cc1cc(C)nc(N/C(=N\C(=S)NC[C@H]2CCCO2)NCCc2ccc(O)cc2)n1,C14158953_decoy,TRY1,Decoy,0,-9.07181,-7.17,-3.2,-7.219687140094126
CC(/C=C/c1ccccc1)=N\Nc1nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]1,C59881232_decoy,TRY1,Decoy,0,-9.23508,-7.67,-3.51,-7.167288501402076
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2cccc(F)c2C)n[nH]1,C59887756_decoy,TRY1,Decoy,0,-8.91784,-7.51,-1.91,-7.192476525875578
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)c(F)c1,C59887764_decoy,TRY1,Decoy,0,-9.93391,-9.11,-3.06,-7.850784949393876
CCOc1cccc([C@H](C)NC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1,C60185294_decoy,TRY1,Decoy,0,-7.31414,-6.74,-1.87,-5.706960788376201
CC(C)(C)OC(=O)[C@](N)(C[C@H]([NH3+])C(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21,C64219207_decoy,TRY1,Decoy,0,-8.23455,-7.62,-2.79,-6.567031191809385
Nc1nc(N)c2nc(C[NH2+]C3CCCCC3)cnc2n1,C01762562_decoy,TRY1,Decoy,0,-7.56421,-8.14,0.31,-9.835298471846247
NC(=[NH2+])NNC(=O)C(F)(F)C(F)(F)C(F)(F)F,C09614786_decoy,TRY1,Decoy,0,-6.87265,-6.66,-1.07,-9.639960998954695
Nc1nc(NCCC[NH3+])nc(N2CCCC2)c1[N+](=O)[O-],C05249584_decoy,TRY1,Decoy,0,-7.39206,-6.01,-3.06,-7.653413970840974
NS(=O)(=O)c1ccc(C[NH2+]Cc2ccc(O)cc2O)cc1,C19980652_decoy,TRY1,Decoy,0,-7.86806,-5.57,-1.5,-4.934556950631516
NC1=[NH+][C@@](O)(c2ccccc2)[C@@](O)(c2ccccc2)N1,C17128386_decoy,TRY1,Decoy,0,-5.65094,-4.58,-2.91,-3.7544558723907993
[NH3+]C1=CNN([C@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](O)[C@@H]2O)C(=O)N1,C00041974_decoy,TRY1,Decoy,0,-6.73047,-8.01,-1.95,-7.808450013588165
[H]/N=C(\Nc1cc(OC)c(Cl)cc1OC)[NH+]=C(N)N,C24171217_decoy,TRY1,Decoy,0,-8.03219,-6.41,-0.49,-9.678943667238515
C[C@H]([NH2+][C@H](C)c1ccc(S(N)(=O)=O)cc1)C(N)=O,C35018206_decoy,TRY1,Decoy,0,-8.70009,-5.28,-1.53,-5.319686827911574
NS(=O)(=O)c1ccc(N[C@@H]2C[C@H]2[NH3+])c([N+](=O)[O-])c1,C36267828_decoy,TRY1,Decoy,0,-7.35311,-5.05,-1.62,-4.791478263895895
Cc1cc([C@@H](C)NC(=O)[C@H]([NH3+])CC(N)=O)c(C)s1,C37626719_decoy,TRY1,Decoy,0,-9.19788,-6.37,-1.92,-9.019672138399102
Cc1cc([C@H](C)NC(=O)[C@H]([NH3+])CC(N)=O)c(C)s1,C37626720_decoy,TRY1,Decoy,0,-8.86414,-5.65,-1.43,-5.193792424636045
C[C@H](NC(=O)[C@H]([NH3+])CC(N)=O)c1cc(F)ccc1F,C37626993_decoy,TRY1,Decoy,0,-8.4984,-6.7,-1.07,-9.479288540785207
C[C@@H](NC(=O)[C@H]([NH3+])CC(N)=O)c1cc(F)ccc1F,C37626994_decoy,TRY1,Decoy,0,-8.23398,-6.75,-0.62,-9.37679643246939
C[C@H](NC(=O)[C@@H]([NH3+])CC(N)=O)c1cc(F)ccc1F,C37626995_decoy,TRY1,Decoy,0,-7.38063,-7.02,-1.35,-9.78764113921411
C[C@@H](NC(=O)[C@@H]([NH3+])CC(N)=O)c1cc(F)ccc1F,C37626996_decoy,TRY1,Decoy,0,-7.17184,-7.23,-1.72,-9.590013907834257
C[C@H](NC(=O)[C@H]([NH3+])CC(N)=O)c1ccc(F)c(F)c1,C37627393_decoy,TRY1,Decoy,0,-8.93509,-6.63,-1.5,-9.17185754365071
C[C@@H](NC(=O)[C@H]([NH3+])CC(N)=O)c1ccc(F)c(F)c1,C37627395_decoy,TRY1,Decoy,0,-8.34018,-7.01,-1.57,-9.64694726015584
C[C@H](NC(=O)[C@@H]([NH3+])CC(N)=O)c1ccc(F)c(F)c1,C37627397_decoy,TRY1,Decoy,0,-7.98617,-6.93,-1.69,-7.371513929393673
NC(=O)C[C@@H]([NH3+])C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2,C37627842_decoy,TRY1,Decoy,0,-7.42145,-6.25,-1.3,-7.679935118611899
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)[C@H]([NH3+])CC(N)=O,C37628688_decoy,TRY1,Decoy,0,-8.03773,-4.87,-2.77,-5.194768433188408
CC(C)[C@@H]1CC[C@H](C)C[C@H]1NC(=O)[C@H]([NH3+])CC(N)=O,C37628694_decoy,TRY1,Decoy,0,-8.8313,-5.16,-1.55,-5.591571759884647
NS(=O)(=O)c1ccc(N[C@H]2CCCC[C@@H]2[NH3+])nc1,C38050671_decoy,TRY1,Decoy,0,-8.25525,-4.35,-1.54,-4.328110566355235
CCNc1nc(NC(C)C)nc(N[C@@H]([NH3+])NOC)n1,C39706975_decoy,TRY1,Decoy,0,-7.83398,-5.14,-0.94,-6.642005372487114
CCNc1nc(NC(C)C)nc(N[C@H]([NH3+])NOC)n1,C39706976_decoy,TRY1,Decoy,0,-8.71992,-6.3,-1.06,-8.744589009091845
C[NH+]1CCC(NC(=O)NC(C)(C)C)(/C(N)=N/O)CC1,C40375541_decoy,TRY1,Decoy,0,-7.10705,-4.07,-0.05,-4.266613717242465
CCCCNC(=O)NC1(/C(N)=N/O)CC[NH+](C)CC1,C40375543_decoy,TRY1,Decoy,0,-6.56848,-5.24,-0.82,-4.882605809714263
CC[C@@H](C)Nc1nc[nH+]c(NNc2ccccc2)c1N,C40757633_decoy,TRY1,Decoy,0,-7.02949,-5.23,-2.72,-4.356856438150406
CC(C)[NH+](CCC(=O)Nc1ccccc1N)CC(N)=O,C42427859_decoy,TRY1,Decoy,0,-6.25014,-6.3,-1.41,-5.307433761258133
C[NH+]1CC[C@H](Nc2ccc(S(N)(=O)=O)cc2N)C1,C42544926_decoy,TRY1,Decoy,0,-7.03437,-4.99,-1.29,-3.871466025972089
C[NH+]1CC[C@H](Nc2cc(N)cc(S(N)(=O)=O)c2)C1,C42545108_decoy,TRY1,Decoy,0,-6.67277,-7.25,-0.87,-6.93937141386749
C[NH+]1CC[C@@H](Nc2cc(N)cc(S(N)(=O)=O)c2)C1,C42545110_decoy,TRY1,Decoy,0,-7.20632,-4.71,-0.42,-4.346557234735226
Nc1cc(N)nc(S[C@@H](C[NH3+])c2ccccc2F)n1,C43050335_decoy,TRY1,Decoy,0,-7.79225,-7.56,-1.0,-8.07590795106808
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)C(C)(C)C,C43297915_decoy,TRY1,Decoy,0,-7.71619,-6.04,-2.03,-8.19644167851115
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)C(C)(C)C,C43297916_decoy,TRY1,Decoy,0,-7.65404,-5.97,-0.18,-9.801435951079982
C[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)C(F)(F)F,C43386431_decoy,TRY1,Decoy,0,-6.69771,-5.85,-0.74,-9.101828376306113
C[C@@H](CNc1ccc(S(N)(=O)=O)cc1N)[NH+](C)C,C45105883_decoy,TRY1,Decoy,0,-7.44763,-4.4,-0.69,-4.66540333924662
C[C@@H](CNc1cc(N)cc(S(N)(=O)=O)c1)[NH+](C)C,C45106033_decoy,TRY1,Decoy,0,-6.91707,-4.58,-0.73,-4.139701853892901
C[C@H](CNc1cc(N)cc(S(N)(=O)=O)c1)[NH+](C)C,C45106035_decoy,TRY1,Decoy,0,-7.35557,-4.74,-2.27,-4.057304498567678
NC(=O)c1cc(NCCCCn2cc[nH+]c2)ccc1N,C45113851_decoy,TRY1,Decoy,0,-7.53946,-6.62,-1.61,-6.708872147036528
CC(C)[NH+](C)Cc1ccccc1CNC(=O)NNC(N)=O,C45789972_decoy,TRY1,Decoy,0,-5.72446,-4.87,-1.51,-5.02858574406659
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(N)=O)C1,C46426993_decoy,TRY1,Decoy,0,-7.71947,-4.41,-1.86,-4.626507626113569
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)NNC(N)=O)C1,C46426994_decoy,TRY1,Decoy,0,-7.65223,-4.66,-2.98,-4.414108731362672
CC[NH+](C)CCNc1ccc(S(N)(=O)=O)cc1N,C54111870_decoy,TRY1,Decoy,0,-7.97153,-4.01,-0.21,-4.655109347587221
NC(=O)C/C(N)=[NH+]\Nc1ccc(Cl)cc1[N+](=O)[O-],C16385213_decoy,TRY1,Decoy,0,-6.06107,-4.69,-1.41,-5.806742956832889
NC(=O)C/C(N)=[NH+]\Nc1cc(Cl)ccc1[N+](=O)[O-],C16385159_decoy,TRY1,Decoy,0,-6.221,-6.36,-1.27,-7.054150872152872
NNC(=O)C/C(N)=[NH+]\Nc1ccc(Cl)cc1[N+](=O)[O-],C16385216_decoy,TRY1,Decoy,0,-6.6288,-7.01,-1.36,-7.027958225459926
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(N)=O)C1,C56945339_decoy,TRY1,Decoy,0,-7.32975,-4.63,-1.79,-4.630434885752818
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(N)=O)C1,C56945340_decoy,TRY1,Decoy,0,-6.13103,-6.32,-1.77,-6.226143361155324
Cc1n[nH]cc1CNc1cc2c(cc1[NH3+])CCC(=O)N2,C58938006_decoy,TRY1,Decoy,0,-6.85794,-7.84,-0.32,-9.166905551549268
CCOc1ccc(C/[NH+]=C(/N)N=C(N)N)cc1Cl,C15974477_decoy,TRY1,Decoy,0,-8.28243,-5.2,-1.01,-8.693173428518348
CCOc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C[C@H]3CCCO3)[NH+]3CCN(c4ccc(O)cc4)CC3)cc2c1,C06133970_decoy,TRY1,Decoy,0,-9.5695,-6.28,-2.5,-6.307387859520318
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4C[C@@H](C)C[C@H](C)C4)cc3)c2C(=O)NC)C1,C08920584_decoy,TRY1,Decoy,0,-10.0832,-6.55,-2.92,-6.433527811016033
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)c2C(=O)NC(=O)N(C)C)C1,C08920775_decoy,TRY1,Decoy,0,-9.00516,-5.46,-2.35,-6.186679929563227
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(CC#N)CC#N)cc2)sc2c1CC[NH+](C(C)C)C2,C08920879_decoy,TRY1,Decoy,0,-8.95387,-4.94,-3.63,-5.748021220485112
COc1cccc(C2=[NH+]C(C(F)(F)F)(C(F)(F)F)c3c(n(CCc4ccccc4)c(=O)[nH]c3=O)N2)c1,C09280853_decoy,TRY1,Decoy,0,-7.01946,-5.9,-2.03,-5.660725751943652
CCOc1cccc([C@@H]2CC(c3cccc(OC)c3)=N[C@H](c3ccc(OC)c(Br)c3)[NH2+]2)c1O,C09542569_decoy,TRY1,Decoy,0,-10.4095,-7.36,-3.19,-7.341747149455817
COc1ccc(-c2n[nH]cc2C[NH+]2CCN(c3cccc4c3C(=O)N(CC3(O)CCCCC3)C4=O)CC2)cc1,C11783061_decoy,TRY1,Decoy,0,-9.4804,-7.28,-1.94,-6.828068038773358
COc1ccc(CCn2cnc3c(c2=[NH2+])[C@@H](c2ccc(OC)c(OC)c2)c2ccc(O)cc2O3)cc1OC,C13768273_decoy,TRY1,Decoy,0,-8.657,-8.16,-3.4,-8.09242769587823
CC[NH+]1CCN(c2ccc(NC(=S)NC(=O)c3cc(Br)ccc3OC)cc2Cl)CC1,C16681557_decoy,TRY1,Decoy,0,-9.41331,-5.5,-1.19,-6.373657749645622
CCc1cccc(CC)c1NC(=S)N/N=C1\C(=O)N(CN2CCN(c3cccc[nH+]3)CC2)c2ccccc21,C20685332_decoy,TRY1,Decoy,0,-10.1086,-9.19,-3.06,-10.076071092428949
COc1cc(C[NH2+][C@H](C)c2ccccc2)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCCO2,C20877118_decoy,TRY1,Decoy,0,-9.33209,-8.15,-3.86,-7.2305753988771775
COc1cc(C[NH2+]C2CCCCCCC2)cc(Br)c1OC[C@H](O)c1ccc2c(c1)OCCO2,C20877193_decoy,TRY1,Decoy,0,-10.4677,-7.51,-2.37,-8.008978975274982
CC[NH+]1CCN(c2c(Cl)cccc2NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1,C20971775_decoy,TRY1,Decoy,0,-8.09326,-5.57,-2.57,-5.570194836191236
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC[C@H]1CCC[NH2+]C1)C2,C27318047_decoy,TRY1,Decoy,0,-11.8107,-9.01,-2.94,-10.084149617212455
CC1CCN(c2ccc(C(=O)NC(=S)Nc3cccc(Cl)c3N3CC[NH+](C)CC3)cc2[N+](=O)[O-])CC1,C30825759_decoy,TRY1,Decoy,0,-7.95337,-7.06,-1.88,-6.182488467574251
CCc1c(C)sc2nc(SCc3ccc(Br)cc3)nc(N3CC[NH+](CC(N)=O)CC3)c12,C34761862_decoy,TRY1,Decoy,0,-10.5845,-5.45,-1.53,-6.271973032713087
CCOC(=O)c1c(NC(=O)[C@@H](C)[NH+](C)CC(=O)Nc2ccc(F)c(F)c2F)sc2c1CC[C@@H](C)C2,C34800878_decoy,TRY1,Decoy,0,-9.50224,-7.58,-2.82,-7.388568602202525
C[NH+](C)CCCN1C(=O)c2oc3ccc(Br)cc3c(=O)c2[C@H]1c1ccc(OCC(N)=O)cc1,C35486976_decoy,TRY1,Decoy,0,-8.78704,-7.61,-1.41,-9.015343370622851
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(C)C(=O)N[C@H]1c1ccc(C(F)(F)F)cc1,C36001587_decoy,TRY1,Decoy,0,-8.27389,-6.73,-2.56,-6.59202572419204
CCOc1ccc(Nc2scc(-c3ccc(Cl)s3)[n+]2CCc2ccc(S(N)(=O)=O)cc2)cc1,C36019075_decoy,TRY1,Decoy,0,-9.29632,-5.57,-1.73,-6.04041200644398
Cc1cccc(-c2nc(N3CC[NH+](CCN4CCOCC4)CC3)nc3nn(Cc4ccccc4)c(N)c23)c1,C37359887_decoy,TRY1,Decoy,0,-10.3814,-8.34,-2.66,-7.6294975533595695
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-],C38799180_decoy,TRY1,Decoy,0,-8.54951,-8.38,-1.54,-7.719254918525931
CCOC(=O)C1=C(CN2CC[NH+](C34CC5CC(CC(C5)C3)C4)CC2)NC(=O)N[C@H]1c1ccc2c(c1)OCO2,C22828639_decoy,TRY1,Decoy,0,-8.69129,-7.79,-2.29,-5.895341753753921
COc1ccc(NC(=O)C[NH+]2CCC[C@@]23CCN([C@@H](CC(C)C)C(=O)Nc2ccc(N(C)C)cc2)C3=O)cc1,C39266320_decoy,TRY1,Decoy,0,-8.25556,-6.53,-0.56,-7.086736853795501
COc1ccc(NC(=O)C[C@@H]2C(=O)NCCN2C(=O)C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1,C22933541_decoy,TRY1,Decoy,0,-9.04756,-7.48,-2.1,-6.208070510406845
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NC[C@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)no1,C39596347_decoy,TRY1,Decoy,0,-8.76659,-6.13,-2.46,-6.939221203301551
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCc2cc(F)cc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39600455_decoy,TRY1,Decoy,0,-7.23684,-5.59,-4.85,-5.56336783276334
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)NCCN4CCOCC4)C4(CC[NH2+]CC4)C3)cccc12,C39625864_decoy,TRY1,Decoy,0,-8.83873,-7.05,-1.61,-6.5058364648778
COc1cc(OC)c(CNC(=O)[C@@H]2CN(C(=O)[C@@H]3COc4ccccc4O3)CC23CC[NH2+]CC3)c(OC)c1,C39639151_decoy,TRY1,Decoy,0,-9.24094,-7.49,-2.72,-6.236464922011474
CCOc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39652653_decoy,TRY1,Decoy,0,-9.65974,-6.48,-1.68,-6.935803607759143
CCOc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3F)CC23CC[NH2+]CC3)cc1,C39653749_decoy,TRY1,Decoy,0,-9.38239,-7.91,-2.5,-7.479441572529314
COc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3csc(Cl)c3OC)CC23CC[NH2+]CC3)cc1,C39665776_decoy,TRY1,Decoy,0,-10.3224,-6.99,-1.96,-6.970146538271619
COc1cc(C(=O)N2C[C@H](C(=O)NCc3cn4cc(C)ccc4n3)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39670469_decoy,TRY1,Decoy,0,-9.50669,-6.65,-2.91,-6.151880329147371
O=C(NCC1(N2CCOCC2)CCCCC1)[C@@H]1CN(C(=O)COc2cccc(Cl)c2)CC12CC[NH2+]CC2,C39672893_decoy,TRY1,Decoy,0,-10.8338,-7.63,-2.29,-7.654667289889959
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NCC2(N3CCOCC3)CCCCC2)C2(CC[NH2+]CC2)C1,C39672903_decoy,TRY1,Decoy,0,-9.35321,-7.37,-1.93,-6.472813744133752
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)NCc3cnn(Cc4ccccc4)c3)C3(CC[NH2+]CC3)C2)c1C,C39676070_decoy,TRY1,Decoy,0,-8.46022,-8.02,-2.42,-7.1170342736069205
COc1ccc(C(NC(=O)[C@H]2CN(C(=O)c3sccc3C)CC23CC[NH2+]CC3)c2ccc(OC)cc2)cc1,C39676598_decoy,TRY1,Decoy,0,-9.80932,-8.35,-1.07,-9.726627091716328
COc1cc(C(=O)N2C[C@H](C(=O)NCc3ccc4c(c3)OCCO4)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39677450_decoy,TRY1,Decoy,0,-8.76258,-7.76,-4.27,-9.470285641929715
COc1cc(C(=O)N2C[C@@H](C(=O)NCc3ccc4c(c3)OCCO4)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39677451_decoy,TRY1,Decoy,0,-9.28806,-7.35,-1.59,-6.385688916009088
Cc1cc(C(=O)N2C[C@H](C(=O)NC[C@@H]3CN(Cc4ccccc4)CCO3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39677942_decoy,TRY1,Decoy,0,-9.00244,-6.78,-1.93,-6.997969122727072
COc1cc(C(=O)N2C[C@H](C(=O)NC3CCN(C(=O)C(C)C)CC3)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39686009_decoy,TRY1,Decoy,0,-9.26032,-5.31,-2.59,-5.886475590993695
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(-c3ccccc3)noc2C)CC12CC[NH2+]CC2,C39686734_decoy,TRY1,Decoy,0,-7.8629,-6.16,-1.94,-6.183996476127075
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39687090_decoy,TRY1,Decoy,0,-7.86871,-7.92,-3.26,-7.058223205990632
Cc1ccc(Oc2ncccc2C(=O)N2C[C@@H](C(=O)NCCOc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)cc1,C39688285_decoy,TRY1,Decoy,0,-9.82601,-8.96,-4.05,-8.91439853041781
CC(C)C[n+]1c(N)c(C(=O)Nc2nnc(SCc3ccccc3)s2)cc2c(=O)n3ccccc3nc21,C39840965_decoy,TRY1,Decoy,0,-8.42782,-8.52,-2.27,-6.23976676999582
COc1ccc2nc(CCNC(=O)[C@H]3CN(C(=O)c4cc(C)nn4C(C)(C)C)CC34CC[NH2+]CC4)[nH]c2c1,C44713557_decoy,TRY1,Decoy,0,-9.71443,-8.63,-2.6,-9.205058494497536
Nc1c2c(-c3ccccc3F)nc(N3CC[NH+](CCN4CCOCC4)CC3)nc2nn1Cc1ccccc1,C47975164_decoy,TRY1,Decoy,0,-9.41232,-7.77,-2.91,-7.173282664461526
CC[C@@H](C)[C@H]1[NH2+]C2(CCN(C(=S)Nc3cccc(Cl)c3)CC2)N(Cc2ccc3c(c2)OCO3)C1=O,C36029008_decoy,TRY1,Decoy,0,-8.95377,-6.71,-2.92,-6.698676493102109
COc1cc2c(c(OC)c1OC)-c1ccc(NCCC3=c4ccccc4=[NH+]C3)c(=O)cc1[C@@H](NC(C)=O)CC2,C63351314_decoy,TRY1,Decoy,0,-8.86748,-9.09,-2.04,-6.915271504187519
CCc1ccc(-c2nc3sc(N(C)CC(=O)NCC[C@H](C)[NH+]4CCCC4)nn3c2NC(C)(C)C)cc1,C64703814_decoy,TRY1,Decoy,0,-10.2678,-7.47,-2.39,-9.547512055524724
NNC(=O)c1ccc(-c2ccc(Cc3ccc(Cc4ccc[nH]4)[nH]3)[nH]2)[nH]1,C01721188_decoy,TRY1,Decoy,0,-8.014,-5.67,-1.19,-5.676307117330913
CCCCNc1ccc(-c2c(N)nc(N)nc2CC)cc1N,C01591450_decoy,TRY1,Decoy,0,-8.22744,-6.88,-0.22,-7.97554795290679
NC(=S)c1nc2c(N)nc(-c3ccccc3)nc2nc1N,C01699128_decoy,TRY1,Decoy,0,-5.52108,-6.68,-0.61,-5.135588863485128
NNc1nc(NN)nc(N(c2ccccc2)c2ccccc2)n1,C00363259_decoy,TRY1,Decoy,0,-7.73002,-7.31,-3.4,-9.17592044107875
Cc1c2c(c(O)c3c(O)cccc13)C(=O)[C@]1(O)C(=O)C(C(N)=O)=C(O)C[C@@H]1C2,C04879692_decoy,TRY1,Decoy,0,-6.3074,-7.3,-2.42,-4.705567897179737
CCC[C@H]1C/C(=N/NC(N)=O)[C@@H](NNC(N)=O)[C@H](C)C1,C05432005_decoy,TRY1,Decoy,0,-6.76408,-5.29,-1.25,-5.154902010870082
NNC(=O)N/N=C(/C[C@@]1(O)C(=O)Nc2ccccc21)c1ccc(Cl)cc1Cl,C05739553_decoy,TRY1,Decoy,0,-7.2832,-7.98,-1.64,-8.173885364442368
Nc1ccc(O)c2c1C(=O)c1c(O)cc(Br)c(N)c1C2=O,C05420586_decoy,TRY1,Decoy,0,-6.69116,-5.56,-0.56,-3.198172386705672
NC(=O)CSc1nnc(N/N=C/c2ccc(O)cc2O)[nH]1,C06330108_decoy,TRY1,Decoy,0,-7.84958,-7.34,-0.7,-7.0139163090701455
Nc1ccccc1/C=C\c1cc(/C=C/c2ccccc2)c(N)cc1N,C03844631_decoy,TRY1,Decoy,0,-7.06755,-6.71,-0.73,-4.852207135811153
Nc1ccc2nc([C@@H](O)[C@@H](O)c3nc4ccc(N)cc4s3)sc2c1,C06045355_decoy,TRY1,Decoy,0,-8.7919,-8.24,-1.69,-9.029469263049911
Nc1ccc(OCCCOc2ccc(N)c(N)c2)c(N)c1,C22007516_decoy,TRY1,Decoy,0,-7.04939,-6.77,-1.27,-6.714871913601683
[H]/N=C(/N)N/C(N)=N/c1cc(Cl)c(Cl)cc1Cl,C06495053_decoy,TRY1,Decoy,0,-7.85124,-6.95,-0.85,-7.659993571903954
Nc1cc(N)c(/C=C/c2ccccc2)c(N)c1/C=C\c1ccccc1,C13402371_decoy,TRY1,Decoy,0,-6.15967,-5.98,-0.78,-3.95110309699426
COc1ccc(/N=N\c2ccc(N)cc2N)cc1/N=N/c1ccc(N)cc1N,C04558760_decoy,TRY1,Decoy,0,-7.3452,-8.88,-3.51,-8.35973972964964
Cc1ncc(CO)c(/C=N/NC(=O)c2cc(O)c(O)c(O)c2)c1O,C03910433_decoy,TRY1,Decoy,0,-9.37826,-5.63,-0.81,-6.10485595467611
[H]/N=C(\N)NC(=O)c1nc(Cl)c(N2CCCCCC2)nc1N,C03871091_decoy,TRY1,Decoy,0,-8.4042,-7.2,-0.68,-9.646084524812473
Cc1cc(C)c(/C=N/NC(N)=O)c(C)c1/C=N/NC(N)=O,C00042455_decoy,TRY1,Decoy,0,-6.16335,-5.7,-2.19,-4.5941497840347285
NC(=[NH2+])NN/C=C1\C(=O)N=C([O-])N(c2ccc(I)cc2)C1=O,C34236724_decoy,TRY1,Decoy,0,-9.48632,-8.59,-0.33,-13.87831339211866
NC(=O)C[C@@H]([NH3+])C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)[O-],C40481215_decoy,TRY1,Decoy,0,-8.05325,-4.56,-2.77,-4.824100684260068
NC(=O)C[C@H]([NH3+])C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)[O-],C40481217_decoy,TRY1,Decoy,0,-8.86976,-5.38,-1.58,-6.207138320778858
CC(C)C[C@@H](CO)Nc1ccc(S(N)(=O)=O)cc1N,C40774117_decoy,TRY1,Decoy,0,-9.48355,-4.99,-3.19,-5.968675129913348
CC(C)C[C@H](CO)Nc1ccc(S(N)(=O)=O)cc1N,C40774119_decoy,TRY1,Decoy,0,-9.30147,-5.2,-2.31,-5.764926501169024
CC(C)C[C@@H](CO)Nc1cc(N)cc(S(N)(=O)=O)c1,C40774509_decoy,TRY1,Decoy,0,-9.01299,-5.5,-1.48,-6.228452167880092
Nc1ccc(OCCCSc2nc(N)cc(N)n2)cc1,C41023483_decoy,TRY1,Decoy,0,-8.28488,-6.65,-2.91,-7.103433264433817
Nc1cc(N)nc(SCc2ccc(N)c3cccnc23)n1,C41023542_decoy,TRY1,Decoy,0,-8.2389,-6.89,-1.24,-6.89132234942202
COC(=O)c1cc(Sc2nc(N)cc(N)n2)ccc1N,C41080786_decoy,TRY1,Decoy,0,-7.81262,-7.58,-1.21,-9.574092751365535
Nc1ccccc1/C=[NH+]/CCC/[NH+]=C/c1ccccc1N,C04964650_decoy,TRY1,Decoy,0,-7.65281,-7.29,-1.12,-5.913977165098561
Cc1cc(S(=O)(=O)c2ccc(N)cc2)c(S(N)(=O)=O)cc1N,C44124389_decoy,TRY1,Decoy,0,-7.20034,-6.91,-3.88,-7.668152828243376
NC(=O)NNC(=O)NCCNc1ncc(Cl)cc1Cl,C46903341_decoy,TRY1,Decoy,0,-7.48948,-6.59,-1.89,-7.337195760580336
Cc1cc([C@@H](C)NC(=O)NC(C(N)=O)C(N)=O)c(C)s1,C46906664_decoy,TRY1,Decoy,0,-6.66447,-6.76,-1.77,-7.116282210670942
Cc1cc([C@H](C)NC(=O)NC(C(N)=O)C(N)=O)c(C)s1,C46906666_decoy,TRY1,Decoy,0,-6.83316,-6.11,-3.77,-5.845780193265259
Nc1cc(NC2(CO)CCCC2)cc(S(N)(=O)=O)c1,C53045357_decoy,TRY1,Decoy,0,-8.79497,-5.78,-1.44,-5.350865877920999
CCC(CC)(CO)Nc1ccc(S(N)(=O)=O)cc1N,C53045511_decoy,TRY1,Decoy,0,-8.93473,-5.42,-4.01,-5.155669392246087
CC1CCC(CO)(Nc2cc(N)cc(S(N)(=O)=O)c2)CC1,C53114325_decoy,TRY1,Decoy,0,-7.37333,-5.85,-2.27,-5.1245167078830685
C[C@@H]1CCC[C@@](CO)(Nc2ccc(S(N)(=O)=O)cc2N)C1,C53114722_decoy,TRY1,Decoy,0,-9.22893,-5.3,-4.16,-5.3389045726123525
C[C@@H]1CCC[C@](CO)(Nc2ccc(S(N)(=O)=O)cc2N)C1,C53114727_decoy,TRY1,Decoy,0,-9.09581,-6.62,-3.11,-7.666091314871005
C[C@H]1CCC[C@](CO)(Nc2ccc(S(N)(=O)=O)cc2N)C1,C53114730_decoy,TRY1,Decoy,0,-9.46437,-5.94,-2.05,-5.335102969363396
NC1=[NH+]c2nc3cc4c(cc3n2[C@@H](c2ccc(O)c(O)c2)N1)OCCCO4,C12507322_decoy,TRY1,Decoy,0,-8.5211,-7.46,-2.38,-5.063827218181257
NC1=[NH+]c2nc3cc4c(cc3n2[C@@H](c2cccc(O)c2O)N1)OCCCO4,C12539407_decoy,TRY1,Decoy,0,-8.44709,-8.07,-2.53,-4.96944001222373
CC1=C(C(N)=O)[C@@H](c2cccc([N+](=O)[O-])c2)C(C(N)=O)=C(N)O1,C58949522_decoy,TRY1,Decoy,0,-5.06481,-5.0,-1.43,-4.096552015809506
CC1=C(C(N)=O)[C@H](c2c(C)cc(C)cc2C)C(C(N)=O)=C(N)O1,C58949573_decoy,TRY1,Decoy,0,-4.81685,-4.72,-1.99,-3.753554156355062
CC1=C(C(N)=O)[C@H](c2ccc(C#N)cc2)C(C(N)=O)=C(N)O1,C58949580_decoy,TRY1,Decoy,0,-6.50375,-5.01,-1.59,-4.38283499985394
CCOc1ccccc1[C@H]1C(C(N)=O)=C(C)OC(N)=C1C(N)=O,C58949649_decoy,TRY1,Decoy,0,-5.88663,-5.5,-2.11,-4.928957400365442
[NH2+]=C1Nc2nc3cc4c(cc3n2[C@H](c2cc(O)c(O)c(Cl)c2)N1)OCCCO4,C12506245_decoy,TRY1,Decoy,0,-10.5083,-7.34,-2.42,-7.599524682233863
[NH2+]=C1Nc2nc3cc4c(cc3n2[C@@H](c2cc(O)c(O)c(Cl)c2)N1)OCCCO4,C12506243_decoy,TRY1,Decoy,0,-9.10155,-6.13,-2.73,-5.004492997623577
NC1=[NH+]c2nc3cc4c(cc3n2[C@H](c2ccc(O)c(O)c2)N1)OCCCO4,C12507324_decoy,TRY1,Decoy,0,-9.17787,-6.46,-1.81,-4.264198364861995
NC(=O)C(NC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)C(N)=O,C29733405_decoy,TRY1,Decoy,0,-7.42654,-5.22,-1.76,-4.717369109680009
Cc1c2c(c(O)c3c(O)cccc13)C(=O)[C@]1(O)C(=O)C(C(N)=O)=C([O-])[C@H]([NH+](C)C)[C@@H]1C2,C35799639_decoy1,TRY1,Decoy,0,-6.11704,-5.96,,-3.9247540889394097
CSCC[C@@H](NC(N)=O)C(=O)Nc1cc(Cl)c(N)c(Cl)c1,C67184250_decoy,TRY1,Decoy,0,-7.97791,-5.69,-2.73,-7.086686416425028
NC(=O)N/N=C/c1ccc2c(c1N)C(=O)c1ccccc1C2=O,C04235267_decoy,TRY1,Decoy,0,-6.37231,-6.42,-0.76,-4.919464094195795
CC1(C)Cc2nc3sc(C(=O)NN)c(N)c3cc2CS1,C00327605_decoy,TRY1,Decoy,0,-7.73473,-5.99,0.04,-8.38360954398001
CC1(C)Nc2ccccc2C2=C1SC(=C(C(N)=O)C(N)=O)C2=S,C05482174_decoy,TRY1,Decoy,0,-6.52868,-5.16,-1.18,-4.161265732545674
Cc1ccc(C2=NN[C@H]([C@](C)(O)[C@](C)(O)[C@](C)(O)CO)S2)cc1,C06211786_decoy,TRY1,Decoy,0,-8.09397,-5.35,-1.25,-5.423427923164162
C[C@@]1(Oc2ccccc2CO)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915846_decoy,TRY1,Decoy,0,-5.29748,-5.6,-3.55,-4.257023827057982
COC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@@H]1c1cccnc1,C12416523_decoy,TRY1,Decoy,0,-7.3727,-4.26,0.2,-4.687965022330377
NC(=O)c1cccc2c1N[C@H](c1ccc(O)cc1O)[C@@H]1CC=C[C@H]21,C13639718_decoy,TRY1,Decoy,0,-8.15466,-5.22,-0.62,-4.570541410527864
NC(=O)c1cccc2c1N[C@H](c1ccc(O)cc1O)[C@@H]1CC=C[C@@H]21,C20681541_decoy,TRY1,Decoy,0,-8.28182,-8.97,-0.1,-7.541137189477411
NNc1nnc(SCC(=O)c2ccc(Br)cc2)n1N,C21035299_decoy,TRY1,Decoy,0,-7.52776,-7.76,-0.8,-11.070877631284384
O=C1c2c(O)cc(O)cc2O[C@H](c2c(O)cccc2O)[C@H]1O,C14643339_decoy,TRY1,Decoy,0,-7.91743,-7.96,-1.41,-6.722553159688896
[H]/N=C1/Nc2nc(N)[nH]c(=O)c2[C@@H](c2ccc(F)cc2)[C@@H]1C#N,C04945498_decoy,TRY1,Decoy,0,-6.42009,-5.21,-1.95,-3.1307434222244432
Nc1[nH]nc2nc(NCCO)c3c(c12)CCN(Cc1ccccc1)C3,C20790952_decoy,TRY1,Decoy,0,-7.85829,-8.07,0.06,-9.498714661872476
C/C(=C\C(=O)Nc1ccccc1C(N)=O)NNC(=O)c1cccs1,C04723534_decoy,TRY1,Decoy,0,-8.1665,-7.03,-2.33,-6.394345863683236
Nc1cc(Cl)cnc1Nc1ccc(S(N)(=O)=O)cc1,C36242698_decoy,TRY1,Decoy,0,-7.83707,-6.79,-1.27,-5.2574871345668175
NC(=O)c1ccsc1NC(=O)CSc1ccc(N)cc1,C37182115_decoy,TRY1,Decoy,0,-7.71135,-6.94,-1.4,-7.344397167940852
O=C1c2c(O)cc(O)cc2O[C@@H](c2ccc(O)c(O)c2)[C@@H]1O,C00105082_decoy,TRY1,Decoy,0,-8.06954,-8.89,-1.01,-7.358675134038174
CNc1c/c(=N/S(=O)(=O)c2ccc(N)cc2)[nH]c(NC)n1,C00023472_decoy,TRY1,Decoy,0,-6.88651,-7.01,-1.07,-7.222698843556896
C=CCSC1=C(C(N)=O)C2(CCCCC2)C(C#N)=C(N)N1,C04755007_decoy,TRY1,Decoy,0,-7.39744,-5.13,-1.14,-4.271195389908054
Cc1cc(O)c(O)c(C(=O)C(=O)c2c(O)cc(O)cc2O)c1,C35456830_decoy,TRY1,Decoy,0,-8.23914,-8.76,-1.23,-8.979925164869867
Nc1cc(Nc2ccc3c(c2)OCO3)cc(S(N)(=O)=O)c1,C37934081_decoy,TRY1,Decoy,0,-7.34302,-6.17,-0.51,-4.752003267491268
Nc1cc(Nc2cc(F)ccc2F)cc(S(N)(=O)=O)c1,C37934101_decoy,TRY1,Decoy,0,-6.7913,-6.7,-2.14,-8.005926347418484
NC(=O)c1cc([N+](=O)[O-])ccc1Nc1cc(N)ccc1Cl,C38033888_decoy,TRY1,Decoy,0,-6.91876,-7.33,-0.72,-6.623405299190647
Cc1ccc(-c2n[nH]c(SCc3nc(N)nc(N)n3)n2)cc1,C07113688_decoy,TRY1,Decoy,0,-8.48126,-8.07,-0.8,-9.93290675630118
Nc1nc(N)nc(CSc2nc(-c3ccccc3F)n[nH]2)n1,C07183763_decoy,TRY1,Decoy,0,-8.03313,-6.31,-1.25,-6.827375176531046
Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)nc[nH]c1=O,C40794865_decoy,TRY1,Decoy,0,-7.32754,-7.99,-1.99,-10.023672238635804
CC(C)(C)NNc1ncnc(Nc2ccc(F)c(F)c2)c1N,C40796653_decoy,TRY1,Decoy,0,-6.21477,-5.29,-1.24,-4.837579053197249
NNC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccccc2)N1,C43754969_decoy,TRY1,Decoy,0,-6.64356,-8.07,-1.89,-8.398380053172495
Cc1cc([C@H](C)Nc2ccc(S(N)(=O)=O)cc2N)c(C)o1,C44729702_decoy,TRY1,Decoy,0,-8.36053,-4.99,-2.38,-5.730220929978428
CCN(Cc1ccc(Cl)s1)C(=O)NC(C(N)=O)C(N)=O,C45615513_decoy,TRY1,Decoy,0,-7.21081,-5.8,-1.69,-6.904247220033779
Cc1ccccc1[C@H](C)Nc1ccc(S(N)(=O)=O)cc1N,C49525326_decoy,TRY1,Decoy,0,-8.84077,-5.27,-2.2,-5.44656279357093
Nc1cc(N)nc(SCc2ccc(C#CCCO)cc2)n1,C49623759_decoy,TRY1,Decoy,0,-7.54278,-6.64,-1.43,-7.885268089869854
[H]/N=C1\C=CC2=N[C@H](CCCCc3nc4ccc(N)cc4[nH]3)NC2=C1,C39709530_decoy,TRY1,Decoy,0,-7.88092,-8.64,-2.37,-6.913648144063191
N#CCc1ccc(Nc2ccc(S(N)(=O)=O)cc2N)cc1,C51601320_decoy,TRY1,Decoy,0,-7.22921,-6.36,-2.63,-6.672223606059548
CNS(=O)(=O)c1ccc(NC2(CO)CCCC2)c(N)c1,C53045228_decoy,TRY1,Decoy,0,-7.83292,-5.91,-2.85,-7.208722672635926
CC[C@H](C)[C@@H](NC(N)=O)C(=O)N[C@]1(CO)CCC[C@H](C)C1,C53106755_decoy,TRY1,Decoy,0,-7.22764,-5.3,-1.97,-5.156673755009384
C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)SCc1nc(N)nc(N)n1,C56229257_decoy,TRY1,Decoy,0,-8.70462,-6.81,-2.47,-8.994569489751147
C[C@H]1[C@@H](NC(=O)[C@@H](C)SCc2nc(N)nc(N)n2)CCC[C@@H]1C,C56229262_decoy,TRY1,Decoy,0,-8.65897,-6.92,-1.34,-7.504736421046344
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc[nH]1)C(C(N)=O)=C(N)O2,C58903693_decoy,TRY1,Decoy,0,-6.66575,-5.22,-3.58,-3.980127683547962
Cc1n[nH]c2c1[C@H](c1ccccc1Cl)C(C(N)=O)=C(N)O2,C58950900_decoy,TRY1,Decoy,0,-4.87911,-5.22,-1.46,-3.914117007316257
Nc1ccccc1C1=NC(=O)[C@@]2(CC(c3ccccc3)=NN2)NN1,C12528116_decoy,TRY1,Decoy,0,-7.19089,-7.42,-0.66,-4.229143070072129
CC(C)[C@H](OC(=O)c1cc(N)ccc1Cl)C(=O)NC(N)=O,C60380654_decoy,TRY1,Decoy,0,-7.91934,-6.3,-2.64,-7.297156895244906
CC(C)(NC(=O)c1cc(N)c(F)cc1Br)C(N)=O,C61088599_decoy,TRY1,Decoy,0,-6.89819,-5.72,-1.71,-6.6094924450870405
C[C@H](OC(=O)c1cc(N)c(F)cc1Br)C(=O)NC(N)=O,C61089774_decoy,TRY1,Decoy,0,-6.98661,-6.13,-1.41,-6.017042154403197
Cc1ccc2nc(Sc3ccc(N)cc3C(N)=O)[nH]c2c1,C61440588_decoy,TRY1,Decoy,0,-8.3105,-4.88,-1.87,-4.935113692461741
NC(=O)c1ccc(Cl)cc1NCCOc1ccc(N)cc1,C62786112_decoy,TRY1,Decoy,0,-7.92654,-7.01,-0.97,-7.610754468829113
O=C1c2c(O)cc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C00105086_decoy,TRY1,Decoy,0,-8.72832,-5.67,-0.92,-4.611411430829575
C[C@H]1CCCC[C@H]1NC(=O)NCCCc1n[nH]c(N)c1C#N,C65393198_decoy,TRY1,Decoy,0,-8.02121,-7.51,-3.16,-7.475936496340445
C[C@]12CC3CC([NH2+][C@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]4O)(C1)C[C@@](C)(C3)C2,C65743174_decoy,TRY1,Decoy,0,-7.18242,-6.54,-0.63,-5.209115026720871
C=CCNC(=O)NC(=O)[C@@H](C)Nc1ccc(C)c(C(N)=O)c1,C66940776_decoy,TRY1,Decoy,0,-7.87829,-6.46,-0.69,-6.985795184490914
CC[C@H](C)[C@H](NC(N)=O)C(=O)Nc1cc(NC(C)=O)c(F)cc1F,C66941934_decoy,TRY1,Decoy,0,-8.4188,-6.67,-3.43,-6.287375169604731
N#Cc1c(CCC[NH2+]C2CCC(C#N)(c3ccccc3)CC2)n[nH]c1N,C08395452_decoy,TRY1,Decoy,0,-6.9947,-7.92,-1.94,-10.413995327056902
NC(=O)CC[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C08790741_decoy,TRY1,Decoy,0,-9.60489,-7.65,-1.5,-7.534301427810698
Cc1cnc(C)c(-c2ccc(O)c(C[NH2+]Cc3ccc(S(N)(=O)=O)cc3)c2)n1,C12049368_decoy,TRY1,Decoy,0,-8.24696,-6.83,-1.65,-6.703800318821411
Cc1cc(Br)ccc1NC(=O)CNC(=O)C[NH+]1CCCC[C@H]1C(N)=O,C12699241_decoy,TRY1,Decoy,0,-8.31612,-6.98,-4.42,-5.898787669436919
C[C@@H](C(=O)NC(N)=O)N1CC[NH+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1,C23469869_decoy,TRY1,Decoy,0,-7.92112,-6.77,-1.07,-6.235578530907409
[NH3+]CCCC[C@]1(C(=O)[O-])[NH2+][C@H](c2ccccn2)[C@@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C34388556_decoy,TRY1,Decoy,0,-9.10095,-7.13,-0.32,-17.77459983393359
CC[NH2+]Cc1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C34659469_decoy,TRY1,Decoy,0,-6.88054,-4.94,-1.68,-5.206058077008912
C[C@H](Oc1ccc(Br)cc1C[NH2+]C1CC1)C(=O)NC(N)=O,C34660022_decoy,TRY1,Decoy,0,-7.3516,-6.15,-0.63,-7.456411102501463
C[NH+](C)CCCNC(=O)Nc1c(-c2ccccc2)nn(C(C)(C)C)c1N,C34784959_decoy,TRY1,Decoy,0,-7.94728,-5.12,-0.57,-5.709212181748346
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)c3cccc(F)c3)c2C(N)=O)C1,C00849988_decoy,TRY1,Decoy,0,-9.83018,-6.01,-1.73,-6.023632889338691
O=c1[nH]c2ccccc2n1CCCS[C@@H]1N[NH2+]NN1c1ccccc1,C39411832_decoy,TRY1,Decoy,0,-7.51957,-5.88,-1.02,-4.665197255489147
CC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661759_decoy,TRY1,Decoy,0,-9.02808,-8.94,-2.3,-8.892829200941136
COc1c(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)csc1Cl,C39661845_decoy,TRY1,Decoy,0,-10.9565,-6.21,-1.08,-7.1787638501471775
C[C@@H]1CCC[NH+]([C@@H](C)CNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41652954_decoy,TRY1,Decoy,0,-9.05399,-6.65,-1.42,-7.4411796568802835
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41725340_decoy,TRY1,Decoy,0,-8.04351,-7.53,-1.38,-6.637213971510022
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41725643_decoy,TRY1,Decoy,0,-10.1588,-7.79,-1.28,-10.977555789809356
NS(=O)(=O)c1ccc(CCNC(=O)c2coc([C@H]3CCC[NH2+]C3)n2)cc1,C43216360_decoy,TRY1,Decoy,0,-9.01779,-6.6,-2.15,-6.282048031754117
CC1(C)[C@H]2CC[C@H](CNC(=O)c3coc([C@@H]([NH3+])Cc4c[nH]c5ccccc45)n3)[C@@H]1C2,C43217493_decoy,TRY1,Decoy,0,-9.48102,-8.22,-3.36,-6.55388938769789
C[C@H](O)[C@H]([NH3+])c1nc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)co1,C43218183_decoy,TRY1,Decoy,0,-8.55526,-7.37,-2.23,-6.77616369570155
NC(=O)CSc1ccccc1NC(=O)NCCC[NH+]1CCCCCC1,C45696210_decoy,TRY1,Decoy,0,-8.31253,-7.2,-0.62,-7.853618584562211
CC(C)[NH+](C)Cc1ccccc1CNC(=O)NNC(=O)C(=O)NC1CC1,C45790295_decoy,TRY1,Decoy,0,-6.71695,-5.93,-2.65,-5.566741502072492
C[C@@H]1CCC[NH+](CCCNC(=O)NNC(=S)NC2CCCC2)C1,C46394697_decoy,TRY1,Decoy,0,-7.89099,-6.62,-1.97,-5.890687599724178
CC1CC[NH+](CCCCNC(=O)NNC(=S)NC2CCCC2)CC1,C46738265_decoy,TRY1,Decoy,0,-8.68582,-6.48,-1.01,-6.3159138524136615
O=C(NNC(=S)NC1CCCC1)NC1CCN(c2cccc[nH+]2)CC1,C46943726_decoy,TRY1,Decoy,0,-7.82767,-7.55,-1.43,-5.515977365640056
C[NH+](C)CC(C)(C)CNC(=O)c1cc(Br)cnc1NN,C51089789_decoy,TRY1,Decoy,0,-7.43775,-4.91,-1.16,-8.748636258211167
COC(=O)CCCC[C@@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094741_decoy,TRY1,Decoy,0,-8.07365,-4.53,-0.94,-4.9029183692044604
C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C55375031_decoy,TRY1,Decoy,0,-7.64024,-7.66,-4.31,-5.499240565309555
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C[C@H](NC(N)=O)c2cccs2)C1,C55749817_decoy,TRY1,Decoy,0,-8.87296,-5.01,-0.97,-5.544116053044104
C[C@@H](NC(N)=O)C(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C55994039_decoy,TRY1,Decoy,0,-7.13354,-6.95,-1.42,-7.222702433151432
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)Nc2ccccc2CC(N)=O)C1,C56645067_decoy,TRY1,Decoy,0,-7.37283,-5.63,-1.18,-5.546947630885228
CC(C)([NH2+]CC(=O)Nc1ccccc1C(N)=O)c1ccc2c(c1)OCO2,C58434927_decoy,TRY1,Decoy,0,-8.19954,-7.04,-2.27,-5.57047249438638
C[C@@H]1CCC[NH+]([C@H](C)CNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C62121079_decoy,TRY1,Decoy,0,-9.36461,-7.69,-1.35,-10.669944723545225
CCOc1cc(/C=N/[NH+]=C(N)N)ccc1OCc1ccccc1Cl,C06590479_decoy,TRY1,Decoy,0,-9.25906,-6.9,-1.79,-8.771222571160544
NC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63270422_decoy,TRY1,Decoy,0,-6.791,-8.05,-1.41,-6.170917365995082
CSCC[C@@H](NC(N)=O)C(=O)NC[C@H](C1CCCCC1)[NH+](C)C,C63804458_decoy,TRY1,Decoy,0,-8.42462,-5.83,-3.52,-6.022325491220518
CCC[C@@H](NC(N)=O)C(=O)Nc1ccccc1OCC[NH+](CC)CC,C64291677_decoy,TRY1,Decoy,0,-7.66207,-5.82,-3.73,-7.628806965610897
CNC(=O)c1ccc(CNc2nc(CC[NH3+])nc3sc(C)c(C)c23)o1,C65383571_decoy,TRY1,Decoy,0,-8.83541,-6.98,-1.83,-7.569510563427261
CCCC[C@@H](NC(N)=O)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C65594212_decoy,TRY1,Decoy,0,-8.25865,-7.37,-2.03,-6.090134395229639
CCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115467_decoy,TRY1,Decoy,0,-6.53775,-5.16,-4.26,-4.708311150254487
COc1cc(Cl)c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cc1OC,C66148402_decoy,TRY1,Decoy,0,-7.38204,-4.74,-1.03,-4.871145593687023
C[C@H]1CCC[C@@H](NC(=O)CN2CC[NH+](CCC(=O)NC(N)=O)CC2)C1,C66566582_decoy,TRY1,Decoy,0,-7.93844,-6.9,-2.01,-5.622846717871797
Cc1occc1C(=O)NC1CC[NH+](CC(=O)Nc2ccccc2C(N)=O)CC1,C66890731_decoy,TRY1,Decoy,0,-7.31314,-4.14,-0.65,-4.22844221127902
NC(=O)[C@H]1C[C@@H](O)C[NH+]1CC(=O)NCCOc1ccc(Cl)cc1,C67129308_decoy,TRY1,Decoy,0,-8.14085,-6.85,-1.31,-6.8178349014779
CC(C)[C@@H](C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)[NH+]1CCCCC1,C67289195_decoy,TRY1,Decoy,0,-8.73023,-5.69,-1.33,-5.905479886723261
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C67439062_decoy,TRY1,Decoy,0,-10.2691,-7.25,-2.43,-7.393106198793774
CC(C)[C@H](NC(N)=O)C(=O)N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C67467649_decoy,TRY1,Decoy,0,-7.2315,-6.71,-2.25,-5.911949078239394
Cc1ccc(NC(=O)C(=O)NCC[NH+]2CCc3sccc3C2)cc1C(N)=O,C67534358_decoy,TRY1,Decoy,0,-8.0287,-7.37,-2.5,-5.9841095172427785
CC(=O)Nc1ccc(F)c(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c1,C67539505_decoy,TRY1,Decoy,0,-9.04293,-7.43,-3.2,-6.527211781911492
CNC(=O)c1cc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)ccc1F,C67550830_decoy,TRY1,Decoy,0,-8.75306,-6.57,-2.42,-5.890582348077398
Cc1ccc(NC(=O)C(=O)NCC[NH+]2Cc3ccccc3C2)cc1C(N)=O,C67559261_decoy,TRY1,Decoy,0,-7.44153,-6.51,-3.25,-6.378478634906434
C[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)cc1)C(=O)Nc1ccc(F)c(F)c1F,C03348381_decoy,TRY1,Decoy,0,-9.23545,-7.02,-2.0,-6.623872410845833
O=C(NCC[NH+]1CCCCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccccc3)S[C@@H]21,C08254641_decoy,TRY1,Decoy,0,-10.7134,-7.47,-1.07,-6.980614066481082
C[NH+](C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccccc3)S[C@@H]21,C08254661_decoy,TRY1,Decoy,0,-9.15861,-4.78,-1.49,-5.994432429059409
Cc1cccc(C)c1NC(=O)CNC(=O)C[NH+]1Cc2ccccc2C[C@@H]1C(N)=O,C08747717_decoy,TRY1,Decoy,0,-7.40193,-7.9,-4.62,-6.155580073828393
COc1ccc(CCC2CC[NH+](Cc3nc(N)nc(N)n3)CC2)cc1,C09515083_decoy,TRY1,Decoy,0,-7.73303,-7.43,-0.91,-7.0527632938188685
CC[NH+]1CCN(CCNC(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1,C32815249_decoy,TRY1,Decoy,0,-8.79956,-6.36,-2.35,-6.091885881730955
C[C@@H](O)[C@H]([NH3+])c1nc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)co1,C33635715_decoy,TRY1,Decoy,0,-7.8027,-7.15,-0.91,-7.820596814201617
C[C@@H](Oc1ccc(Br)cc1C[NH2+]C1CC1)C(=O)NC(N)=O,C34660024_decoy,TRY1,Decoy,0,-7.63993,-6.4,-2.8,-7.641255702390761
CONC[C@H](c1ccc(-c2ccccc2O)cc1)N1CC[NH2+][C@H](O)C1,C39534038_decoy,TRY1,Decoy,0,-8.93772,-6.32,-2.16,-5.816170028966121
CC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661761_decoy,TRY1,Decoy,0,-8.08442,-7.71,-1.6,-7.133457128890774
Cc1nc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)sc1C,C40756321_decoy,TRY1,Decoy,0,-8.53488,-6.71,-3.01,-7.073426913525909
C[C@H]1CCC[NH+]([C@@H](C)CNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41652959_decoy,TRY1,Decoy,0,-9.74361,-6.13,-0.79,-7.026041583139535
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41725344_decoy,TRY1,Decoy,0,-8.27223,-7.46,-4.3,-6.385824462613778
C[C@@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41725638_decoy,TRY1,Decoy,0,-10.0765,-7.16,-1.12,-7.824868134297477
Cc1ccccc1NC(=O)NNC(=O)NC[C@H](c1ccco1)[NH+](C)C,C43137934_decoy,TRY1,Decoy,0,-6.96357,-6.25,-1.42,-6.118214351163813
NS(=O)(=O)c1ccc(CCNC(=O)c2coc([C@@H]3CCC[NH2+]C3)n2)cc1,C43216359_decoy,TRY1,Decoy,0,-8.57551,-7.77,-2.61,-5.659212634316756
C[C@@H]1CCC[NH+]([C@@H](C)CNC(=O)NNC(=S)NC2CCCC2)C1,C46368171_decoy,TRY1,Decoy,0,-7.96289,-5.81,-1.54,-5.5492951883793324
NC(=O)C1CC[NH+](CCCNC(=O)c2cc(=O)[nH]c3ccccc23)CC1,C46919371_decoy,TRY1,Decoy,0,-7.88242,-7.22,-4.39,-7.198152071201426
CC(C)[NH+](CCNC(=O)C(=O)Nc1ccccc1CC(N)=O)C(C)C,C48693316_decoy,TRY1,Decoy,0,-8.35789,-6.17,-4.14,-5.823401730341552
COC(=O)CCC[C@@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094745_decoy,TRY1,Decoy,0,-7.567,-4.48,-1.32,-5.326622486725292
CC(C)[NH+](CC(N)=O)CC(=O)NCC(=O)Nc1ccc(F)c(F)c1,C08532896_decoy,TRY1,Decoy,0,-8.34065,-6.37,-4.18,-6.563102048062551
Cc1cc(NCCNc2ncc(C(F)(F)F)cc2Cl)nc(N)[nH+]1,C45724706_decoy,TRY1,Decoy,0,-11.3103,-7.25,-1.97,-12.831870417270824
C[NH+](C)Cc1ccccc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1,C54398722_decoy,TRY1,Decoy,0,-7.96005,-4.59,-0.64,-5.123805024445748
C[C@H]([NH2+][C@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc2c(c1)OCO2,C55375028_decoy,TRY1,Decoy,0,-8.71599,-7.41,-2.11,-6.266537308644122
C[C@H](NC(N)=O)C(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C55994038_decoy,TRY1,Decoy,0,-9.03862,-5.2,-1.89,-5.719141492896263
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@H](C)C[NH+]1CCC[C@H](C)C1,C56725363_decoy,TRY1,Decoy,0,-8.55195,-6.47,-3.01,-6.041694676379409
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CC[C@H](Nc2ccccc2)C1,C60370021_decoy,TRY1,Decoy,0,-7.4446,-4.91,-1.22,-4.529959721433824
NS(=O)(=O)c1ccc(CCNC(=O)NC2CC[NH+](C3CC3)CC2)cc1,C47617104_decoy,TRY1,Decoy,0,-9.00133,-5.47,-1.67,-5.707717617793884
CCC[C@@H](NC(N)=O)C(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1,C61502395_decoy,TRY1,Decoy,0,-8.18503,-5.85,-1.53,-6.0910607565061134
CCCSc1nnc(NC(=O)c2ccc(N3CN[NH2+]N3)cc2)s1,C39980188_decoy,TRY1,Decoy,0,-10.4163,-7.95,-1.05,-8.57124696174984
CCC[C@@H](NC(N)=O)C(=O)Nc1ccc(N(C)C2CC[NH+](C)CC2)cc1,C63695415_decoy,TRY1,Decoy,0,-8.13923,-7.0,-1.69,-6.194590493405204
Cc1ccc2c(c1)=C(CCNC(=O)c1cccc(NC(=O)[C@H]3NN[C@@H](C)S3)c1)C[NH+]=2,C64502494_decoy,TRY1,Decoy,0,-7.67872,-7.67,-2.88,-5.581440161721088
Cc1cc(=O)[nH]c(NCC[NH2+]CC(=O)Nc2ccc(Cl)c(C)c2)n1,C65381874_decoy,TRY1,Decoy,0,-7.50468,-6.98,-2.87,-6.237360081150117
COc1ccccc1N1NC(CC(C)C)=[NH+][C@@H]1CCc1n[nH]c(N)n1,C65383784_decoy,TRY1,Decoy,0,-8.14713,-7.24,-0.88,-7.755894694891402
C[C@@H]1C[C@H](C)C[NH+](C[C@H](C)NC(=O)C[C@H](NC(N)=O)c2cccs2)C1,C65760805_decoy,TRY1,Decoy,0,-8.4152,-6.41,-1.93,-7.540696980395628
CC[NH+]1CCC[C@H]1CNc1nc(-c2ccc(O)c(C(N)=O)c2)cs1,C66106630_decoy,TRY1,Decoy,0,-8.83678,-7.24,-1.18,-10.438227923168649
COc1cc(Cl)c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cc1OC,C66148400_decoy,TRY1,Decoy,0,-7.12323,-5.39,-1.9,-5.0801453252963045
Cc1cc(NC[C@H](O)COc2ccc(C(F)(F)F)cc2)nc(N)[nH+]1,C66387968_decoy,TRY1,Decoy,0,-7.64134,-6.96,-2.15,-10.23566215634478
C[C@@H]1CCC[C@H](NC(=O)CN2CC[NH+](CCC(=O)NC(N)=O)CC2)C1,C66566579_decoy,TRY1,Decoy,0,-7.82025,-7.61,-1.52,-6.9868685945665465
C[C@@H]1CCC[C@@H](NC(=O)CN2CC[NH+](CCC(=O)NC(N)=O)CC2)C1,C66566581_decoy,TRY1,Decoy,0,-8.50641,-5.42,-2.71,-5.483282694074569
NC(=O)[C@H]1C[C@H](O)C[NH+]1CC(=O)NCCOc1ccc(Cl)cc1,C67129310_decoy,TRY1,Decoy,0,-8.25494,-7.19,-1.33,-6.787984214616021
CC(C)[C@H](C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)[NH+]1CCCCC1,C67289197_decoy,TRY1,Decoy,0,-8.69372,-4.56,-1.25,-5.365705980126743
Cc1ccc(NC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)cc1C(N)=O,C67310379_decoy,TRY1,Decoy,0,-8.18993,-6.09,-0.85,-6.077721383828651
CC(C)[C@@H](NC(N)=O)C(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C67467647_decoy,TRY1,Decoy,0,-8.08567,-6.19,-3.01,-5.538886248621749
Cc1ccc(NC(=O)C(=O)NC[C@@H](C)[NH+]2CCC[C@H](C)C2)cc1C(N)=O,C67497499_decoy,TRY1,Decoy,0,-9.61976,-6.18,-1.17,-7.306094532776905
Cc1ccc(NC(=O)C(=O)NCC[NH+]2CCC[C@H](C)C2)cc1C(N)=O,C67497611_decoy,TRY1,Decoy,0,-7.70818,-6.86,-0.82,-12.548394669976217
NC(=O)c1ccsc1NC(=O)C[NH+]1CCC([C@H](O)c2ccccc2)CC1,C67511239_decoy,TRY1,Decoy,0,-8.36695,-7.48,0.07,-6.0299103688018
CCCc1nc(C)c(CNC(=O)C2=C(C)NC(=O)N[C@H]2c2[nH]c[nH+]c2C)s1,C67515490_decoy,TRY1,Decoy,0,-9.63542,-4.94,-1.75,-6.4974236369502325
CC(=O)Nc1ccc(F)c(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c1,C67539500_decoy,TRY1,Decoy,0,-8.20102,-6.91,-2.48,-6.092941158111775
CC(=O)Nc1ccc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c(Cl)c1,C67576847_decoy,TRY1,Decoy,0,-8.55379,-7.22,-4.72,-5.982575045686805
Cc1[nH]c(=O)[nH]c(=O)c1/C=C/C(=O)N[C@@H](CO)C[S@@+]([O-])Cc1ccccc1,C05352738_decoy,TRY1,Decoy,0,-7.29301,-8.0,-3.63,-9.44762710176308
Cc1[nH]c(=O)[nH]c(=O)c1/C=C/C(=O)N[C@H](CO)C[S@+]([O-])C[S@+](C)[O-],C05410770_decoy,TRY1,Decoy,0,-8.09158,-5.86,-1.41,-6.361761584814011
O=C(NNc1ccccc1)C(=O)NNS(=O)(=O)c1cccc([N+](=O)[O-])c1,C13372005_decoy,TRY1,Decoy,0,-7.11141,-8.04,-2.69,-6.796549046514435
C=CCNc1nnc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)s1,C16668333_decoy,TRY1,Decoy,0,-9.85602,-5.73,-1.65,-6.464156390479181
CCCCn1c(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)n[nH]c1=O,C16668373_decoy,TRY1,Decoy,0,-8.11573,-6.72,-1.82,-6.42836450563372
C[C@H](OC(=O)CCNC(=O)c1ccco1)C(=O)Nc1sccc1C(N)=O,C16858192_decoy,TRY1,Decoy,0,-8.27219,-6.94,-1.37,-7.474301247726618
C/C(=N\Nc1nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]1)c1ccncc1,C20835715_decoy,TRY1,Decoy,0,-9.09858,-7.58,-3.43,-9.96616045465295
Cn1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(F)(F)F)n[nH]2)cn1,C20837596_decoy,TRY1,Decoy,0,-7.36942,-5.97,-2.99,-4.917571539773172
CCC(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2cnn(C(C)C)c2)n1,C20911195_decoy,TRY1,Decoy,0,-8.59937,-6.4,-3.04,-6.098919923334384
CC(C)C(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2cnn(C(C)C)c2)n1,C20911200_decoy,TRY1,Decoy,0,-8.77513,-7.18,-3.07,-6.829765810423396
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NC(C)C)n1N,C20911529_decoy,TRY1,Decoy,0,-8.54582,-7.22,-1.86,-6.758106211961989
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=S)NC[C@H]1CCCO1,C22617606_decoy,TRY1,Decoy,0,-8.57025,-6.35,-1.35,-7.446005382673448
C[C@@H](Sc1nnc(C2CC2)n1CCC(N)=O)C(=O)NC(=O)NC(C)(C)C,C23365867_decoy,TRY1,Decoy,0,-8.27206,-6.6,-1.85,-5.895946864552089
CCCCNC(=O)NC(=O)[C@H](C)Sc1nnc(C2CC2)n1CCC(N)=O,C26974009_decoy,TRY1,Decoy,0,-8.59649,-5.16,-2.57,-5.911869144615858
CC/C=C\C[C@@H]1[C@H](CC(=O)OC)CC[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31168993_decoy,TRY1,Decoy,0,-7.55967,-5.02,-2.2,-4.847407535982622
COCCNC(=S)/N=C(/Nc1nc(C)cc(C)n1)N1CCC(C(N)=O)CC1,C14161102_decoy,TRY1,Decoy,0,-9.02809,-5.27,-0.97,-5.780601454928424
COc1cc(/C=N/NC(=O)[C@H](C)N[C@@H]2N=NC(=O)NC2=O)cc(OC)c1O,C38810842_decoy,TRY1,Decoy,0,-7.9666,-5.35,-1.54,-6.305551940026933
COc1ccc(C(=O)NNc2ncnc(N(CCC#N)CCC#N)c2N)cc1,C40737256_decoy,TRY1,Decoy,0,-7.63001,-4.96,-3.7,-5.039855393693821
COC(=O)C[C@H]1C(=O)NCCN1CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C45631274_decoy,TRY1,Decoy,0,-6.8928,-6.72,-0.94,-7.303605237141912
Cc1noc(N)c1C(=O)OCC(=O)c1c(N)n(CC(C)C)c(=O)n(C)c1=O,C45660581_decoy,TRY1,Decoy,0,-7.71763,-7.53,-4.46,-8.211013933774254
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCn2cccn2)nc1,C45714094_decoy,TRY1,Decoy,0,-7.83627,-7.08,-3.13,-6.406626552476293
CC(C)CNC(=O)NC(=O)[C@@H](C)Sc1nnc(C2CC2)n1CCC(N)=O,C28911166_decoy,TRY1,Decoy,0,-8.07941,-6.61,-2.37,-6.399664223772144
CC(C)CNC(=O)NC(=O)[C@H](C)Sc1nnc(C2CC2)n1CCC(N)=O,C28911169_decoy,TRY1,Decoy,0,-7.3648,-6.05,-3.52,-5.60398596250244
Cc1ccccc1[C@H](CC(=O)NCc1cccnc1-n1cccn1)NC(N)=O,C46707295_decoy,TRY1,Decoy,0,-7.21851,-6.17,-2.26,-5.160410489244392
CC(C)C[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)N1CCOCC1,C47970052_decoy,TRY1,Decoy,0,-9.21772,-6.31,-1.39,-6.88098683462162
O=C(Nc1cccc(F)c1)C(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C48591526_decoy,TRY1,Decoy,0,-8.10251,-8.29,-1.31,-7.207574230129124
Cc1ccc(F)cc1NC(=O)C(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C48591652_decoy,TRY1,Decoy,0,-7.91617,-6.76,-1.77,-6.0928654889517775
N#Cc1cccc(NC(=O)C(=O)N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c1,C48591687_decoy,TRY1,Decoy,0,-7.73322,-7.49,-3.86,-7.973498310550101
Cc1cc(F)ccc1NC(=O)C(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C48591742_decoy,TRY1,Decoy,0,-7.0455,-8.37,-1.33,-6.8059518176303255
COC(=O)/C=C/c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2NC(C)=O)c(OC)c1,C08555253_decoy,TRY1,Decoy,0,-6.14276,-4.33,-2.59,-4.0916228135308135
O=C(CCC(=O)NN[C@H]1CCS(=O)(=O)C1)NN[C@@H]1CCS(=O)(=O)C1,C17952889_decoy,TRY1,Decoy,0,-7.15985,-5.47,-2.23,-5.2068047492484695
Nn1c(SCCC(=O)NC(=O)NCc2ccco2)nnc1C(F)(F)F,C54430565_decoy,TRY1,Decoy,0,-6.85109,-7.18,-3.11,-6.161738030591164
CCOc1ccccc1OCC(=O)NNC(=O)NCCC(=O)NCCOC,C54738858_decoy,TRY1,Decoy,0,-7.12975,-6.03,-4.61,-6.018597404056151
Cc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)o1,C59880630_decoy,TRY1,Decoy,0,-8.26375,-7.56,-0.57,-7.558077782795415
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(S[C@H](C)C(=O)NC2CC2)n[nH]1,C59888407_decoy,TRY1,Decoy,0,-8.93498,-7.81,-1.46,-10.79927367702476
CC(C)NC(=O)C(=O)NNC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)C(C)C,C61087803_decoy,TRY1,Decoy,0,-8.48619,-6.7,-2.26,-8.7716223538126
CC(C)NC(=O)C(=O)NNC(=O)CCNC1=NS(=O)(=O)c2ccccc21,C61544702_decoy,TRY1,Decoy,0,-7.27555,-6.97,-2.4,-6.339006359710646
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=S)NCC(F)(F)F,C64081486_decoy,TRY1,Decoy,0,-7.14176,-6.25,-1.5,-5.216296518038553
C[C@@H]1NN[C@H](SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])S1,C64684500_decoy,TRY1,Decoy,0,-7.48321,-6.08,-2.65,-5.455035382694432
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)NC[C@@H]2CCCO2)c1C,C65146033_decoy,TRY1,Decoy,0,-8.40226,-5.62,-4.16,-6.16777407837779
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C65486358_decoy,TRY1,Decoy,0,-7.12199,-6.61,-2.0,-5.363402988347149
COCC1=NN=C2OC(N)=C(C#N)[C@H](c3ccc(OCC(N)=O)c(OC)c3)[C@@H]12,C04452934_decoy,TRY1,Decoy,0,-7.60053,-5.66,-2.2,-5.3346125190396005
CCOCCCNC(=O)NNC(=O)C[C@@H](NC(C)=O)c1c(F)cccc1F,C66634088_decoy,TRY1,Decoy,0,-8.07817,-5.91,-1.63,-6.454201799570478
CC[C@]1(C)NC(=O)N(NC(=O)CNc2ccc(F)c(NC(=O)OC)c2)C1=O,C66827583_decoy,TRY1,Decoy,0,-7.2774,-5.92,-2.89,-6.525745771225702
CCCCn1c(N)c(N(C)C(=O)CCCNC(=O)C(C)(C)C)c(=O)[nH]c1=O,C66965248_decoy,TRY1,Decoy,0,-7.95378,-6.18,-3.08,-7.641914462458324
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)NCCNC(=O)c1ccco1,C67143777_decoy,TRY1,Decoy,0,-7.58963,-4.97,-2.79,-5.732285654790567
CC(=O)N[C@@H](CC(=O)NNC(=O)NCC(F)(F)F)c1c(F)cccc1F,C67193574_decoy,TRY1,Decoy,0,-6.89388,-5.22,-1.53,-5.0637205811156285
CCOCCCNC(=O)NNC(=O)c1ccc2c(=O)n(CC)c(=O)[nH]c2c1,C67310156_decoy,TRY1,Decoy,0,-7.09903,-7.1,-3.45,-5.433516368824279
CCOCCCNC(=O)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21,C67312591_decoy,TRY1,Decoy,0,-6.97708,-6.61,-3.39,-5.329799289474331
CCOCCCNC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O,C67314006_decoy,TRY1,Decoy,0,-7.95231,-6.54,-1.56,-6.873751646353035
CCO/C(CCn1[nH]c(=O)c(Cl)c(Cl)c1=O)=N/NC(=O)C(=O)NN,C01622417_decoy,TRY1,Decoy,0,-7.1376,-6.91,-1.26,-8.725997621479852
CN(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c1ccc(C(F)(F)F)cc1[N+](=O)[O-],C04707520_decoy,TRY1,Decoy,0,-6.7938,-7.65,-2.88,-9.336641563130868
CN(C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c1ccc(C(F)(F)F)cc1[N+](=O)[O-],C04707526_decoy,TRY1,Decoy,0,-5.63957,-5.46,-2.97,-4.354486244291411
CN(C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C05283834_decoy,TRY1,Decoy,0,-7.90568,-5.08,-1.24,-5.773899649398161
CN(C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C05283835_decoy,TRY1,Decoy,0,-7.29847,-6.94,-2.49,-7.289053139580094
CN(C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C05283836_decoy,TRY1,Decoy,0,-7.46762,-6.6,-2.75,-7.493337435823821
CC1(C)Cc2c(sc(NC(=O)C(=O)NCCOCCO)c2C(N)=O)CO1,C06757439_decoy,TRY1,Decoy,0,-8.07328,-7.15,-3.32,-7.004021685915606
CCOc1cc(CNn2nnnc2N)cc(Br)c1OCC(N)=O,C07601878_decoy,TRY1,Decoy,0,-7.78115,-5.6,-1.98,-5.65968549722016
COc1cc([C@H]2Oc3c(OC)cc([C@@H](O)[C@@H](O)CO)cc3[C@@H]2CO)ccc1O,C14710217_decoy,TRY1,Decoy,0,-9.81165,-6.08,-1.46,-6.328833572243476
COc1cc([C@H]2Oc3c(OC)cc([C@H](O)[C@@H](O)CO)cc3[C@@H]2CO)ccc1O,C14710225_decoy,TRY1,Decoy,0,-9.3754,-5.37,-1.5,-5.7906099703045095
CN(C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c1ccc(C(F)(F)F)cc1[N+](=O)[O-],C14944843_decoy,TRY1,Decoy,0,-6.63551,-7.02,-3.64,-5.383963014456214
CN(C[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c1ccc(C(F)(F)F)cc1[N+](=O)[O-],C14944845_decoy,TRY1,Decoy,0,-6.66488,-5.16,-1.44,-4.849665255058882
CN(C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C15773397_decoy,TRY1,Decoy,0,-7.09805,-6.82,-1.73,-6.982934211502672
CN(C[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C15773399_decoy,TRY1,Decoy,0,-7.32068,-6.13,-1.68,-5.788040955458354
CN(C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)C(=O)C(C)(C)Oc1ccc(Cl)cc1,C15773401_decoy,TRY1,Decoy,0,-7.68645,-6.91,-2.25,-7.189388844636984
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C15774940_decoy,TRY1,Decoy,0,-7.12592,-7.96,-2.3,-8.146790235055583
CCO/C(CCn1[nH]c(=O)c(Cl)c(Cl)c1=O)=N\NC(=O)C(=O)NN,C16953492_decoy,TRY1,Decoy,0,-7.77544,-7.05,-2.27,-8.108039231019417
CC(C)NC(=O)NC[C@H]1O[C@@H](CC(=O)NCCN2CCOCC2)[C@H](O)[C@@H]1O,C20504099_decoy,TRY1,Decoy,0,-8.21522,-6.04,-2.66,-5.9789258680007125
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCC(=O)NCc1ccco1,C20806455_decoy,TRY1,Decoy,0,-8.42642,-8.24,-2.2,-9.050764533061152
COc1cc(/C=N/Nc2nnc(SCC(N)=O)n2N)cc(OC)c1OC,C20827155_decoy,TRY1,Decoy,0,-8.25951,-6.61,-1.29,-6.64883354451915
COCc1nnc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n1N,C20904943_decoy,TRY1,Decoy,0,-8.87657,-5.54,-2.64,-5.5895039276181695
Nn1c(N/N=C/c2ccc(O)cc2)nnc1SCC(=O)NCc1ccco1,C21315669_decoy,TRY1,Decoy,0,-8.74999,-9.01,-1.99,-10.216949632763182
NC(=O)CSc1nnc(SCC(=O)Nc2sccc2C(N)=O)s1,C25134165_decoy,TRY1,Decoy,0,-9.97856,-6.51,-3.24,-8.575362701491871
CC(C)(Sc1nnc(N)s1)C(=O)Nc1nnc(SCC(N)=O)s1,C30831885_decoy,TRY1,Decoy,0,-11.0806,-7.36,-3.18,-10.823257561467644
COc1cc([C@H]2Oc3c(OC)cc([C@H](O)[C@H](O)CO)cc3[C@@H]2CO)ccc1O,C33831072_decoy,TRY1,Decoy,0,-9.91637,-6.95,-1.42,-8.229922888293627
COc1cc([C@@H]2Oc3c(OC)cc([C@H](O)[C@H](O)CO)cc3[C@@H]2CO)ccc1O,C33831073_decoy,TRY1,Decoy,0,-9.04922,-5.86,-1.49,-5.894956078513471
CCN(CC)C(=O)Cn1c(=O)c2c(C)c(C(=O)NN)sc2n(CC(N)=O)c1=O,C34782852_decoy,TRY1,Decoy,0,-8.10468,-6.98,-1.0,-6.719553742068439
COc1cc([C@H]2Oc3c(OC)cc([C@H](O)[C@H](O)CO)cc3[C@H]2CO)ccc1O,C35456693_decoy,TRY1,Decoy,0,-8.44922,-6.5,-1.41,-5.856959715456379
COc1cc([C@@H]2Oc3c(OC)cc([C@H](O)[C@H](O)CO)cc3[C@H]2CO)ccc1O,C35456697_decoy,TRY1,Decoy,0,-9.86632,-6.83,-2.03,-8.211937029273297
C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)COc1ccc(Cl)cc1Cl,C04763735_decoy,TRY1,Decoy,0,-8.25977,-5.88,-2.64,-5.730774007260464
C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)COc1ccc(Cl)cc1Cl,C04763743_decoy,TRY1,Decoy,0,-8.67704,-7.58,-3.2,-7.758937493564851
C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)COc1ccc(Cl)cc1Cl,C04763740_decoy,TRY1,Decoy,0,-9.13277,-5.89,-3.96,-5.44256089202163
COc1ccc(N2C(SCC(N)=O)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362269_decoy,TRY1,Decoy,0,-7.57581,-7.53,-1.24,-7.602158230142277
COc1ccc(N2C(SCC(N)=O)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362271_decoy,TRY1,Decoy,0,-8.0768,-6.13,-0.85,-5.09709933283246
O[C@H]1[C@@H](O)[C@@H](OCCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C49600052_decoy,TRY1,Decoy,0,-4.64394,-6.42,-4.04,-4.194494559784146
C#CCNC(=O)CCNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1,C50136369_decoy,TRY1,Decoy,0,-8.74489,-5.1,-1.83,-5.707134046224231
Cc1occc1-c1nnc(SCCC(=O)Nc2sccc2C(N)=O)n1N,C54439714_decoy,TRY1,Decoy,0,-9.24065,-7.72,-2.63,-7.505908513110863
Cc1cc(OCC(N)=O)ccc1N[C@@H](C)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C56206824_decoy,TRY1,Decoy,0,-7.26819,-6.05,-3.3,-5.701427935581588
Cc1cc(OCC(N)=O)ccc1N[C@H](C)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C56206825_decoy,TRY1,Decoy,0,-6.89804,-8.4,-2.66,-6.553606606601393
O=S(=O)(Nc1ccccn1)c1ccc(/N=C/[C@H](O)[C@@H](O)[C@H](O)CO)cc1,C45286641_decoy1,TRY1,Decoy,0,-9.18191,-5.42,,-5.852126336695851
CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2c[nH]c3ccccc23)n1,C59878947_decoy,TRY1,Decoy,0,-7.87718,-7.41,-1.37,-5.632893415816312
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NCCO)n[nH]1,C59888372_decoy,TRY1,Decoy,0,-9.32292,-4.92,-1.01,-5.5683828961134685
NC(=O)CSc1nnc(NC(=O)CSc2nnc(C3CC3)n2N)s1,C59912859_decoy,TRY1,Decoy,0,-9.17086,-6.99,-1.16,-7.899837928100035
CC(C)c1nnc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n1N,C59913754_decoy,TRY1,Decoy,0,-8.82353,-4.96,-1.44,-5.312279012391218
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)NC1CC1,C61090892_decoy,TRY1,Decoy,0,-8.61873,-6.09,-2.09,-6.178383570844172
NC(=O)Cc1ccccc1NC(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-],C49244844_decoy,TRY1,Decoy,0,-7.18792,-7.71,-2.89,-6.697674440995487
O=S(=O)(Nc1ccccn1)c1ccc(/N=C/[C@@H](O)[C@H](O)[C@H](O)CO)cc1,C45286641_decoy2,TRY1,Decoy,0,-9.10091,-5.74,,-7.4244787481547485
CCNC(=O)NNC(=O)CSc1nnc2nc(NCC)nc(NCC)n12,C65189379_decoy,TRY1,Decoy,0,-7.41549,-5.8,-2.38,-5.582837197095657
CC(=O)OC[C@@H]1O[C@@H](N2C=[NH+][C@H](C(N)=O)C2=[NH2+])[C@@H](OC(C)=O)[C@H]1OC(C)=O,C65734340_decoy,TRY1,Decoy,0,-6.5997,-7.02,-1.93,-8.427977938478616
CCOCCCNC(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O,C67310484_decoy,TRY1,Decoy,0,-8.83322,-7.6,-4.81,-6.875494509695901
C[C@H](C(=O)NC(C)(C)C)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04192196_decoy,TRY1,Decoy,0,-8.27697,-6.96,-0.64,-10.362863049563543
C[C@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04192200_decoy,TRY1,Decoy,0,-8.19066,-6.42,-0.62,-9.527675678224671
C[C@@H](C(=O)NC(C)(C)C)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C04192201_decoy,TRY1,Decoy,0,-7.79482,-7.17,-1.32,-8.732845437911738
C[C@H](C(=O)NC(C)(C)C)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C04192202_decoy,TRY1,Decoy,0,-8.75066,-6.74,0.01,-9.506426014114313
C[C@@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCC1,C04192243_decoy,TRY1,Decoy,0,-7.70228,-7.92,-0.9,-9.954721866296564
C[C@@H](C(=O)NC[C@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCC1,C04192251_decoy,TRY1,Decoy,0,-7.88756,-7.92,-1.46,-8.696496204502367
O=C(CNC(=O)NCc1ccco1)NNC(=O)Nc1ccccc1C(F)(F)F,C02155874_decoy,TRY1,Decoy,0,-7.24264,-7.6,-3.41,-6.052228523324088
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(=O)oc2c1C,C08764220_decoy,TRY1,Decoy,0,-8.15245,-6.26,-2.51,-5.564225579071021
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C[C@@H]2CCCO2)C(=O)c2snc(C(N)=O)c2N)o1,C12715446_decoy,TRY1,Decoy,0,-8.65908,-7.89,-1.4,-9.924387160658789
OC[C@H]1O[C@H](Nc2ccc(-c3ccc(N[C@H]4C[C@H](O)[C@@H](CO)O4)cc3)cc2)C[C@H]1O,C16121470_decoy,TRY1,Decoy,0,-6.90399,-6.27,-2.36,-5.688831249842043
NC(=O)c1c(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N)sc2c1CCC2,C16862013_decoy,TRY1,Decoy,0,-7.66395,-7.48,-3.48,-6.3461585109249645
CC(=O)NNc1nc(C)c(C(/C=C/c2ccc([N+](=O)[O-])cc2)=N/NC(N)=O)s1,C16958142_decoy,TRY1,Decoy,0,-8.4268,-5.57,-1.86,-5.458945817052761
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3ccccc3O)n2N)n1,C20527339_decoy,TRY1,Decoy,0,-8.58608,-8.05,-3.33,-7.310426671447809
COC(=O)c1c(NC(=O)CCSc2nnc(NN)n2N)sc2c1CCC2,C20922319_decoy,TRY1,Decoy,0,-9.6552,-7.11,-1.14,-7.425530164950545
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3ccc(O)cc3)n2N)n1,C21315685_decoy,TRY1,Decoy,0,-9.25677,-9.47,-1.73,-8.079482486125906
COc1ccc(Br)cc1/C=N/Nc1nnc(SCC(N)=O)n1N,C21320510_decoy,TRY1,Decoy,0,-8.6059,-6.63,-0.95,-7.246035924506754
O=C(CCc1ccc(O)cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C22055950_decoy,TRY1,Decoy,0,-5.56771,-8.22,-3.82,-6.212269881492802
NC(=O)c1c(NC(=O)COC(=O)c2ccc(N)c([N+](=O)[O-])c2)sc2c1CCC2,C22826618_decoy,TRY1,Decoy,0,-8.75355,-8.15,-4.38,-7.226115063441323
CC(=O)NNc1nc(C)c(C(/C=C/c2cccc([N+](=O)[O-])c2)=N/NC(N)=O)s1,C25574603_decoy,TRY1,Decoy,0,-8.01454,-5.7,-0.93,-6.402515382919041
COc1cc(O)c2c(=O)c(-c3ccc(O[C@H](OCCO)[C@@H](O)[C@@H](O)[C@@H](C)O)cc3)coc2c1,C28115129_decoy,TRY1,Decoy,0,-8.47591,-7.54,-2.49,-6.053757229526216
O=C([O-])C[C@@H](NC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccc(OC(F)(F)F)cc1,C29567313_decoy,TRY1,Decoy,0,-8.74674,-6.96,-2.0,-7.188425541514336
O=C(CCc1ccc(O)cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C34864255_decoy,TRY1,Decoy,0,-5.87799,-7.33,-1.21,-6.424546956611245
O=C(CCc1ccc(O)cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C34864257_decoy,TRY1,Decoy,0,-7.04586,-7.29,-4.42,-7.117969874108034
CCCN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36575671_decoy,TRY1,Decoy,0,-7.01354,-5.51,-1.61,-6.121686429121886
CCCN(C(=O)[C@@H]1CCC(=O)N1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36575672_decoy,TRY1,Decoy,0,-7.15049,-7.05,-3.85,-7.582766525801164
Cc1ccc(CN(C(=O)CO)[C@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36600358_decoy,TRY1,Decoy,0,-7.20683,-5.63,-1.31,-6.572871480506396
Cc1ccc(CN(C(=O)CO)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36600359_decoy,TRY1,Decoy,0,-6.74827,-6.0,-2.92,-5.778577767751687
Cc1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)o1,C12715071_decoy,TRY1,Decoy,0,-8.44884,-6.94,-1.18,-7.533607407800026
CCOc1ccc([C@H](C(=O)NCCC(C)C)N(CCO)C(=O)c2snc(C(N)=O)c2N)cc1,C06601644_decoy,TRY1,Decoy,0,-8.98121,-5.68,-2.72,-6.60667035311664
O=C(CCc1ccc(O)cc1)c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1O,C31159157_decoy,TRY1,Decoy,0,-7.03952,-6.45,-4.01,-5.732942537938922
CC(=O)Nc1ccccc1NC(=O)/C=C(/C)NNC(=O)C(=O)NC1CCCCC1,C04697901_decoy,TRY1,Decoy,0,-7.97845,-6.92,-1.38,-6.974679592212245
O[C@@H]1[C@@H](O)[C@H](OC/C=C/c2ccccc2)O[C@H](CO[C@@H]2CO[C@H](O)[C@H](O)[C@H]2O)[C@H]1O,C39351839_decoy,TRY1,Decoy,0,-4.95115,-6.03,-1.98,-4.265826248756963
CCc1[nH]c(C(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(C)c1C(=O)OC,C39558820_decoy,TRY1,Decoy,0,-8.11766,-8.09,-1.67,-9.255235641161915
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C43465386_decoy,TRY1,Decoy,0,-7.78472,-8.09,-1.14,-7.964265851052736
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1,C44627917_decoy,TRY1,Decoy,0,-7.64801,-7.14,-3.01,-6.984308830964928
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1,C44627919_decoy,TRY1,Decoy,0,-8.43701,-7.2,-3.96,-6.624325296035098
CCCNC(=S)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1,C49458013_decoy,TRY1,Decoy,0,-9.60407,-4.52,-3.53,-5.476026564964172
C=CCNC(=S)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1,C49458121_decoy,TRY1,Decoy,0,-9.07576,-4.37,-3.71,-5.478851941979734
O[C@H]1[C@H](O)[C@H](OCCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C49600058_decoy,TRY1,Decoy,0,-4.68818,-7.25,-0.68,-4.631913294721647
OC[C@@H]1O[C@H](Nc2ccc(-c3ccc(N[C@@H]4C[C@H](O)[C@H](CO)O4)cc3)cc2)C[C@@H]1O,C04042227_decoy,TRY1,Decoy,0,-5.91574,-5.87,-1.79,-4.627227919021985
OC[C@@H]1O[C@@H](Nc2ccc(-c3ccc(N[C@@H]4C[C@H](O)[C@H](CO)O4)cc3)cc2)C[C@H]1O,C04042317_decoy,TRY1,Decoy,0,-5.94231,-6.5,-1.66,-4.64189131159122
[H]/N=C(/N/C(N)=N/c1c(C)n(C)n(-c2ccccc2)c1=O)Nc1ccc([N+](=O)[O-])cc1,C15636687_decoy,TRY1,Decoy,0,-6.82876,-6.23,-2.31,-5.056185199060828
Cc1csc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3O)n2)n1,C58994251_decoy,TRY1,Decoy,0,-9.23151,-8.92,-2.3,-8.6093306656103
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCC(=O)Nc1nccs1,C20292366_decoy,TRY1,Decoy,0,-9.46639,-9.55,-2.16,-12.385881309855485
CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1,C59880579_decoy,TRY1,Decoy,0,-8.54529,-5.75,-1.67,-6.968233267143932
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1,C59880582_decoy,TRY1,Decoy,0,-9.72742,-7.72,-1.39,-10.890715938108457
C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C60385506_decoy,TRY1,Decoy,0,-7.21531,-7.81,-1.5,-6.39081650538528
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C60385507_decoy,TRY1,Decoy,0,-7.79629,-6.76,-2.92,-6.534230066750444
N#Cc1c(CCCNC(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)n[nH]c1N,C67316654_decoy,TRY1,Decoy,0,-8.48553,-7.63,-2.64,-7.486939331705173
COc1cc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NN)cc(OC)c1OC,C01920284_decoy,TRY1,Decoy,0,-6.94956,-6.89,-3.11,-5.428508749700422
CCCCCOC(=O)/C=C/c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O,C06779831_decoy,TRY1,Decoy,0,-6.89057,-6.37,-2.66,-5.399081692422757
CC(C)[C@@H](NC(=O)c1ccco1)C(=O)OCC(=O)Nc1sccc1C(N)=O,C03378389_decoy,TRY1,Decoy,0,-8.58618,-7.17,-3.24,-7.143800043474397
C[C@H](OC(=O)Cn1ccc(=O)[nH]c1=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C08723613_decoy,TRY1,Decoy,0,-8.79114,-7.2,-3.77,-5.856060901580992
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1,C11669167_decoy,TRY1,Decoy,0,-6.51831,-5.74,-2.16,-4.71216823753519
CCCCCOC(=O)/C=C/c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C12652134_decoy,TRY1,Decoy,0,-7.05256,-6.82,-2.11,-6.908946642364231
COc1ccc(OC[C@@H](O)Cn2c(NN)nc3c2c(=O)n(C)c(=O)n3C)cc1,C00629432_decoy,TRY1,Decoy,0,-7.0662,-6.99,-1.99,-6.2691560496842405
CCOC(=O)CCCSc1nn([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05386292_decoy,TRY1,Decoy,0,-6.65541,-4.84,-4.19,-4.784759380064783
NC(=O)Cc1csc(NC(=O)Cc2csc(NC(=O)c3ccco3)n2)n1,C14331903_decoy,TRY1,Decoy,0,-9.28711,-5.44,-2.16,-5.688745208577215
C/C(CC(=O)Nc1ccc(Br)cc1)=N\NC(=O)C(=O)NCCO,C14922683_decoy,TRY1,Decoy,0,-8.61769,-6.82,-2.4,-6.094147798711248
Cc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(O)c3)n2)s1,C20906847_decoy,TRY1,Decoy,0,-9.39047,-8.83,-1.91,-8.96771225791252
NC(=O)COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1,C24704375_decoy,TRY1,Decoy,0,-8.98475,-6.06,-2.68,-6.150111429088662
CCCCNC(=O)NC(=O)COC(=O)c1cc(NC(C)=O)cc(NC(C)=O)c1,C27909249_decoy,TRY1,Decoy,0,-8.35206,-6.47,-3.33,-5.97897852612784
NC(=O)CCn1c(SCC(=O)NC(=O)NCC(F)(F)F)nnc1C1CC1,C28909958_decoy,TRY1,Decoy,0,-7.75555,-6.31,-2.48,-5.624959562348985
CC(=O)N[C@@H]1[C@H](OCCOc2ccc(Cl)cc2C)O[C@@H](CO)[C@@H](O)[C@H]1O,C05125388_decoy,TRY1,Decoy,0,-6.70436,-6.77,-2.31,-5.408038443969029
O=S1(=O)CC[C@H](NC(=S)NCCNC(=S)N[C@H]2CCS(=O)(=O)C2)C1,C08682495_decoy,TRY1,Decoy,0,-8.56322,-4.97,-2.26,-5.738886542544625
COCCN1C([O-])=NC(=O)[C@@H](C(=O)CSc2nc3ccc(C)cc3[nH]2)[C@@H]1[NH3+],C39458230_decoy,TRY1,Decoy,0,-9.72784,-6.48,-2.17,-7.880143711614963
C[C@]1(c2cccc(NC(=O)CCCNC(=O)c3ccsc3)c2)NC(=O)NC1=O,C40111107_decoy,TRY1,Decoy,0,-8.32561,-6.14,-2.39,-5.3330453795332255
O=C(CSC[C@@H](O)[C@H](O)CSCC(=O)NCc1ccco1)NCc1ccco1,C40546075_decoy,TRY1,Decoy,0,-8.94676,-4.85,-2.6,-5.927988106059376
O=C(NNc1ncnc(NNC(=O)c2ccc(F)cc2)c1[N+](=O)[O-])c1ccncc1,C40657956_decoy,TRY1,Decoy,0,-7.27994,-5.98,-1.8,-6.095890442163927
O=C(COc1ccccc1)NNc1ncnc(NNC(=O)c2ccco2)c1[N+](=O)[O-],C40659152_decoy,TRY1,Decoy,0,-5.58697,-7.92,-1.32,-5.545307571504601
CCCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c[nH]1,C43629850_decoy,TRY1,Decoy,0,-8.19681,-5.57,-4.55,-5.359809236845321
COCC(=O)Nc1cccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)c1,C45721313_decoy,TRY1,Decoy,0,-7.98274,-7.7,-1.4,-8.75127171965166
CS(=O)(=O)NCCCNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O,C48008177_decoy,TRY1,Decoy,0,-8.64925,-5.92,-1.47,-6.619424331030136
C#Cc1cccc(NC(=O)C(=O)N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1,C48591424_decoy,TRY1,Decoy,0,-8.04399,-6.26,-2.82,-6.252279370321666
COC(=O)/C=C/c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c(OC)c1,C49942593_decoy,TRY1,Decoy,0,-6.02006,-5.79,-2.19,-4.390816477582055
C#CCNC(=O)CCNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12,C50136606_decoy,TRY1,Decoy,0,-7.8105,-4.76,-2.41,-5.491550296107779
CCCCn1c(N)c(N(C)CC(=O)NCCCC(=O)OCC)c(=O)[nH]c1=O,C11236954_decoy,TRY1,Decoy,0,-8.00429,-6.5,-3.06,-8.626781631793522
CNC(=O)NC(C)(C)C(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1,C57454516_decoy,TRY1,Decoy,0,-7.20332,-6.19,-1.85,-4.978622012541636
CCc1cccc(C)c1NC(=S)NNC(=O)CCc1c(C)nc(C)[nH]c1=O,C57923542_decoy,TRY1,Decoy,0,-8.20505,-7.32,-2.57,-5.960149805947339
Nn1c(N/N=C/c2cccc([N+](=O)[O-])c2)nnc1SCC(=O)NCc1ccco1,C20291909_decoy,TRY1,Decoy,0,-8.09233,-6.72,-4.35,-6.379394622057853
CCC(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2ccccc2[N+](=O)[O-])n1,C59844373_decoy,TRY1,Decoy,0,-6.41946,-7.21,-2.19,-9.302105019330067
CC(=O)NNC(=O)[C@@H](C)Sc1nc(N/N=C/c2cccc([N+](=O)[O-])c2)n[nH]1,C59878406_decoy,TRY1,Decoy,0,-7.69059,-7.44,-0.75,-6.518428951521315
CC(=O)NNC(=O)[C@@H](C)Sc1nc(N/N=C/c2ccc([N+](=O)[O-])cc2)n[nH]1,C59878442_decoy,TRY1,Decoy,0,-8.34918,-7.56,-1.07,-6.91301041611322
CC(C)n1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)cn1,C59881857_decoy,TRY1,Decoy,0,-8.78474,-7.59,-2.03,-7.277581078759021
COCCn1c(N)c(C(=O)CN(C)CC(=O)Nc2ccc(C)cn2)c(=O)[nH]c1=O,C60363329_decoy,TRY1,Decoy,0,-6.83932,-6.17,-2.03,-5.140744516175952
Cn1c(N)c(C(=O)CSc2nnc(NCc3ccco3)s2)c(=O)[nH]c1=O,C17983834_decoy,TRY1,Decoy,0,-9.10799,-7.96,-2.58,-12.61481058316342
CNC(=O)C1CCC(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1,C63406685_decoy,TRY1,Decoy,0,-6.82378,-6.99,-3.51,-5.741593081624543
Cc1occc1C(=O)Nc1nc(CC(=O)NCC(=O)Nc2cn[nH]c2)cs1,C63534113_decoy,TRY1,Decoy,0,-7.88416,-6.24,-0.88,-5.358918483487669
C=CCNC(=O)c1ccc(NC(=O)CCc2nc3c([nH]2)c(=O)[nH]c(=O)n3C)cc1,C63811002_decoy,TRY1,Decoy,0,-8.11857,-5.88,-1.15,-4.994977183956995
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccoc1,C64227721_decoy,TRY1,Decoy,0,-6.72766,-7.62,-3.58,-5.783154902323882
O=C(CNC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-])Nc1cccc(F)c1,C64683183_decoy,TRY1,Decoy,0,-7.51433,-7.57,-2.6,-6.890055776616532
COCCCNC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O,C65207986_decoy,TRY1,Decoy,0,-7.11151,-7.13,-2.1,-7.124196370009095
COCCNC(=O)CCNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O,C54738490_decoy,TRY1,Decoy,0,-7.9245,-5.86,-1.76,-5.863629835711249
CCOCCCNC(=O)NNC(=O)C[C@H](NC(C)=O)c1c(F)cccc1F,C66634087_decoy,TRY1,Decoy,0,-7.51751,-6.48,-4.36,-6.099131821838998
CC(C)NC(=O)NC(=O)[C@H](C)Sc1nnc(-c2ccco2)n1CCC(N)=O,C25957119_decoy,TRY1,Decoy,0,-7.90875,-7.3,-2.13,-8.107372122039404
O=C(NC[C@@H](O)c1ccc(F)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1,C66984645_decoy,TRY1,Decoy,0,-7.97355,-6.67,-4.19,-5.6070340033591926
CCOCCCNC(=O)NNS(=O)(=O)c1c(C)cc(NC(C)=O)cc1C,C67124515_decoy,TRY1,Decoy,0,-8.34003,-7.27,-4.73,-6.208589794360558
CCOCCCNC(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21,C67313545_decoy,TRY1,Decoy,0,-7.13646,-7.22,-2.24,-6.68465612963913
CCOCCCNC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O,C67314003_decoy,TRY1,Decoy,0,-7.47385,-6.09,-2.51,-5.68348676467878
COc1cc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2cccs2)ccc1O,C00913060_decoy,TRY1,Decoy,0,-8.4764,-6.94,-1.08,-7.83185080274218
CC1(C)OC[C@H]([C@H](O)c2nc3ccccc3nc2C(=O)Nc2ccccc2N)O1,C01610824_decoy,TRY1,Decoy,0,-7.57437,-8.06,-1.18,-7.229285133102115
CC1(C)OC[C@@H]([C@@H](O)c2nc3ccccc3nc2C(=O)Nc2ccccc2N)O1,C01610825_decoy,TRY1,Decoy,0,-7.45845,-9.13,-0.5,-7.790096184755065
COc1ccccc1CNC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccc(C)cc3)[C@@H]21,C08254724_decoy,TRY1,Decoy,0,-8.51555,-5.94,-1.98,-6.296730951713163
NC(=O)C1CCN(C(=O)CCNC(=O)N2CCc3c([nH]c4ccc(Cl)cc34)C2)CC1,C12408650_decoy,TRY1,Decoy,0,-8.82268,-8.56,-0.64,-7.003656727207389
COc1ccccc1OCC(=O)NC(=S)Nc1sc(C)c(C)c1C(N)=O,C12498656_decoy,TRY1,Decoy,0,-7.87631,-6.73,-1.96,-6.506203193559515
NC(=O)c1nc(-c2cc3nc(-c4ccc(F)cc4)cc(C(F)(F)F)n3n2)oc1N,C13644838_decoy,TRY1,Decoy,0,-7.86607,-5.84,-1.66,-5.321463915527297
Cc1nc(SCC(=O)NC(=O)N[C@@H]2CCCC[C@H]2C)c(C(N)=O)c(C)c1C,C14254342_decoy,TRY1,Decoy,0,-8.17806,-6.95,-2.95,-5.539112502828458
Cc1cc(C)c(NC(=O)CNC(=O)COc2ccc(Cl)cc2C(N)=O)c(C)c1,C19042714_decoy,TRY1,Decoy,0,-8.10786,-7.39,-2.55,-6.156501348651088
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(OCC(N)=O)c2)[C@H]2CSCC=C12,C02324563_decoy,TRY1,Decoy,0,-8.0969,-4.87,-1.44,-4.863202943447459
C/C(=N\NC(=O)CNC(=O)c1ccccc1Br)c1cc(O)ccc1O,C20074375_decoy,TRY1,Decoy,0,-8.29515,-8.19,-2.17,-9.507689453834994
Cc1c(C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)[nH]c2c1C(=O)CC(C)(C)C2,C23445819_decoy,TRY1,Decoy,0,-8.55658,-9.59,-1.73,-6.093940755739883
C[C@@H](Sc1nc(CCC2CCCC2)n[nH]1)C(=O)Nc1sccc1C(N)=O,C32883973_decoy,TRY1,Decoy,0,-10.1018,-7.31,-2.62,-8.943811425530338
CSCC[C@@H](CO)NC(=O)[C@H](C)NC(=O)c1cc2c(cn1)[nH]c1ccccc12,C33575954_decoy,TRY1,Decoy,0,-9.3624,-6.8,-2.97,-6.207849584626664
CCOc1ccccc1N1C(=O)[C@@H]([C@H]2NCCc3c2[nH]c2ccccc32)C(O)=N[C@@H]1O,C38964787_decoy,TRY1,Decoy,0,-7.60889,-7.29,-1.66,-6.2348513331332445
CC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(C)cc34)C2)S1,C39147131_decoy,TRY1,Decoy,0,-8.20519,-7.36,-3.31,-5.574667766693752
O=C(CNC(=O)[C@@H]1COc2ccc(Cl)cc2C1)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558946_decoy,TRY1,Decoy,0,-8.56605,-8.51,-1.43,-6.214498426742157
Nc1c(NCCN2CCOCC2)ncnc1Nc1ccc(Br)cc1,C40782314_decoy,TRY1,Decoy,0,-8.76409,-5.03,-1.83,-5.251154986816692
CCc1cc(C(N)=O)c(NC(=O)[C@]2(C)Oc3ccc(Cl)cc3NC2=O)s1,C41548722_decoy,TRY1,Decoy,0,-9.45569,-7.77,-0.88,-6.790825404266596
CCC1(CC)NC(=O)N(CC(=O)NNC(=S)Nc2cc(C)ccc2C)C1=O,C41782279_decoy,TRY1,Decoy,0,-7.75395,-6.7,-3.13,-6.780907782946833
O=C(Cc1csc(NC(=O)c2ccccc2F)n1)NNC(=S)NC1CC1,C46567114_decoy,TRY1,Decoy,0,-9.15454,-6.6,-0.74,-6.2652128980351165
Cc1cccc(NC(=O)CSCC(=O)N[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)c1,C47572081_decoy,TRY1,Decoy,0,-8.05924,-6.99,-0.85,-6.650657004696333
CC(C)C(=O)Nc1cccc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)c1,C50038679_decoy,TRY1,Decoy,0,-7.3245,-7.85,-1.8,-6.296974957656489
O=C1C[C@@H](C(=O)Nc2cccc(F)c2)c2c(nc(Nc3ccccc3)[nH]c2=O)N1,C54202161_decoy,TRY1,Decoy,0,-6.79923,-8.17,-1.72,-6.289492145435246
COC(=O)c1cc(Br)cc(Br)c1NC(=O)c1n[nH]c(N)n1,C55166906_decoy,TRY1,Decoy,0,-7.16498,-6.89,-1.29,-8.522621629568983
O=C(CNC(=O)NCc1ccco1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1,C58533973_decoy,TRY1,Decoy,0,-8.757,-5.93,-2.61,-5.645687913735027
NC(=O)Nc1cccc(CNC(=O)C2(c3ccc4c(c3)OCCO4)CCCC2)c1,C58570573_decoy,TRY1,Decoy,0,-8.20816,-7.17,-2.51,-7.581990648269344
C[C@H]1CCc2c(sc3nc(Cn4c(C(F)(F)F)ccc(C(N)=O)c4=O)nc(N)c23)C1,C59124468_decoy,TRY1,Decoy,0,-8.51982,-8.55,-2.34,-6.504479022294851
NS(=O)(=O)c1cc2c(cc1Cl)N[C@@H](c1ccccc1OC(F)(F)F)NS2(=O)=O,C59590101_decoy,TRY1,Decoy,0,-7.58773,-7.91,-1.37,-7.749095020607655
C[C@@H]1CC=C(c2cc(C(=O)NCCCc3[nH]nc(N)c3C#N)c3ccccc3n2)O1,C39936658_decoy,TRY1,Decoy,0,-10.0472,-9.08,-0.88,-9.49138252734337
CC(C)NC(=O)NNC(=O)[C@H](NC(=O)c1ccccc1Br)C(C)C,C63270607_decoy,TRY1,Decoy,0,-7.34983,-6.09,-1.68,-5.407286465954007
COc1ccc(C(=O)[C@@H]2[C@H](c3ccc([O-])cc3)NC(O)=[NH+][C@]2(O)C(F)(F)F)cc1,C04899127_decoy,TRY1,Decoy,0,-6.91229,-5.48,-2.93,-5.206054871538736
Cc1ccc(F)c(NC(=S)NNC(=O)[C@H](NC(=O)c2ccco2)C(C)C)c1,C63344557_decoy,TRY1,Decoy,0,-6.91857,-6.97,-3.61,-5.674111780472829
NC(=O)[C@@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSc1nc2c(c(=O)[nH]1)CCCC2,C63527220_decoy,TRY1,Decoy,0,-9.80744,-7.61,-2.16,-6.552157146003163
NC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSc1nc2c(c(=O)[nH]1)CCCC2,C63527226_decoy,TRY1,Decoy,0,-9.82842,-7.98,-1.49,-6.431020682482157
COc1ccc(C[C@@H]2NN[C@H](NC(=O)c3cc(=O)[nH]c4ccccc34)S2)cc1,C63821975_decoy,TRY1,Decoy,0,-8.58841,-5.74,-1.43,-5.747342187568863
CCOC(=O)[C@@H]1C2=C(C[C@@H](C)CC2)S[C@H]1NC(=O)CSc1n[nH]c(N)n1,C40009785_decoy,TRY1,Decoy,0,-9.43986,-6.82,-1.68,-9.09214462031299
NC(=O)c1cc(-c2csc(NC(=O)[C@H](c3ccccc3)n3cccn3)n2)c[nH]1,C64906124_decoy,TRY1,Decoy,0,-8.73754,-8.48,-0.19,-11.192224380420331
Cc1[nH]c2ccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2c1C,C65031123_decoy,TRY1,Decoy,0,-8.94742,-9.24,-2.75,-6.99500889952084
CCCOc1c(Cl)cc(/C=C/C(=O)Nc2c(C(N)=O)n[nH]c2C)cc1OC,C65536335_decoy,TRY1,Decoy,0,-8.22729,-6.49,-0.84,-5.937454254005796
N#Cc1cnn(-c2ccc(C(=O)NC3[C@@H]4CCC[C@H]3C[NH+](C3CC3)C4)cc2)c1N,C66241065_decoy,TRY1,Decoy,0,-7.14759,-5.63,-1.23,-6.290471479179809
CC(C)CCC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br,C66791175_decoy,TRY1,Decoy,0,-9.05297,-5.2,-3.59,-6.2394495436534525
O=C(CCNC(=O)c1n[nH]c2ccccc12)NC[C@]1(O)CCCc2ccccc21,C66929391_decoy,TRY1,Decoy,0,-8.07864,-6.97,-0.97,-5.347287863843759
O=C(Cc1ccccc1F)NNC(=O)NCCNC(=O)c1ccccc1Cl,C66976668_decoy,TRY1,Decoy,0,-7.70823,-8.03,-2.61,-6.4131976636025305
O=C1CCc2cc(NC(=O)C(=O)NC[C@]3(O)CCCc4ccccc43)ccc2N1,C67000395_decoy,TRY1,Decoy,0,-10.3499,-8.63,-1.38,-7.127959427275179
CCNC(=O)C1(NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CCCCC1,C67202810_decoy,TRY1,Decoy,0,-9.20524,-6.09,-2.78,-6.045471744064497
Cc1csc(Nc2cccc(NC(=O)C3CCC4(CC3)NC(=O)NC4=O)c2)n1,C67269265_decoy,TRY1,Decoy,0,-9.2061,-7.32,-1.38,-5.916028546225231
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N[C@H](C)C(=O)NC2CCCC2)c1,C67418846_decoy,TRY1,Decoy,0,-9.1373,-6.68,-2.97,-6.109652986571222
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NC[C@@H](O)c2ccc(F)cc2)c1,C67469675_decoy,TRY1,Decoy,0,-8.95279,-5.83,-1.42,-5.466061338851644
Cc1ccc(NC(=O)C(=O)NCc2ccccc2OC(F)(F)F)cc1C(N)=O,C67494160_decoy,TRY1,Decoy,0,-8.61114,-7.51,-2.93,-8.016969701276478
O=C1N[C@H](c2ccc(O)cc2)[C@H](C(=O)c2cccnc2)[C@@](O)(C(F)(F)F)N1,C01092314_decoy,TRY1,Decoy,0,-6.48215,-6.73,-0.96,-5.310200062462248
CCOc1ccc(N2C[C@@H](NC(=O)Nc3ccccc3C(N)=O)CC2=O)cc1,C04373725_decoy,TRY1,Decoy,0,-7.9249,-5.41,-1.24,-5.225775076066478
O=[N+]([O-])c1cc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)cc(Sc2ccccc2)c1,C04185227_decoy,TRY1,Decoy,0,-6.26537,-6.66,-1.06,-4.955829711689477
CCCn1c(N)c(C(=O)CNc2ccc(Br)cc2)c(=O)[nH]c1=O,C05090141_decoy,TRY1,Decoy,0,-8.47583,-6.77,-1.66,-7.129355391028827
Cc1ccc(SCc2cn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c(=O)[nH]c2=O)cc1,C05663054_decoy,TRY1,Decoy,0,-8.278,-7.68,-2.9,-6.521123748527934
COc1cc([C@H]2S[C@@H](C)C(=O)Nc3[nH]nc(C)c32)ccc1OCC(N)=O,C06678846_decoy,TRY1,Decoy,0,-8.42835,-5.86,-1.62,-5.375468433994888
COc1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NC4CC4)[C@H]32)cc1,C08254772_decoy,TRY1,Decoy,0,-8.53819,-5.16,-1.35,-5.671742190278284
Nn1c(SCC(=O)NNC(=O)c2cccs2)nnc1-c1cccs1,C11591866_decoy,TRY1,Decoy,0,-8.80383,-5.2,-1.95,-5.424929005084661
O=C1N[C@@H](c2ccc(O)cc2)[C@@H](C(=O)c2cccnc2)[C@](O)(C(F)(F)F)N1,C11859160_decoy,TRY1,Decoy,0,-7.08714,-5.41,-1.24,-5.216894021023294
NC1=C(c2nc(-c3ccccc3)cs2)C(=O)CN1CCc1ccc(S(N)(=O)=O)cc1,C13682491_decoy,TRY1,Decoy,0,-9.26965,-8.7,-2.71,-6.371960083446587
COc1cc([C@@H](O)[C@H]2CO[C@@H](c3ccc(O)c(OC)c3)[C@@H]2CO)ccc1O,C14435808_decoy,TRY1,Decoy,0,-9.3025,-7.41,-1.96,-7.072070310766624
CCC(c1c(O)cc(C)n(CCO)c1=O)c1c(O)cc(C)n(CCO)c1=O,C16611401_decoy,TRY1,Decoy,0,-7.25452,-5.57,-2.26,-5.641709412197315
COc1cc([C@@H]2[C@@H](Cl)C(=O)N2NC(=O)c2ccc(N)cc2)cc(Br)c1O,C01633090_decoy,TRY1,Decoy,0,-8.3659,-7.36,-0.99,-6.793479861187355
Cc1ccc(C(=O)NCC(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)s1,C27325719_decoy,TRY1,Decoy,0,-9.53206,-6.38,-1.92,-6.0989292876606696
CC[C@@H](C)[C@H](NC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(O)cc1,C32102762_decoy,TRY1,Decoy,0,-7.86526,-8.33,-1.46,-8.045112773917973
Cc1cc(C)cc(OCC(=O)NNC(=O)c2csc(S(N)(=O)=O)c2)c1,C31969945_decoy,TRY1,Decoy,0,-8.43062,-7.35,-2.24,-6.7045942444926405
C[C@@H](C(=O)Nc1sccc1C(N)=O)N(C)Cc1nc2ccccc2c(=O)[nH]1,C12738936_decoy,TRY1,Decoy,0,-7.91507,-7.55,-3.15,-5.871855883544552
C[C@H](NC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)ccc1O,C36367119_decoy,TRY1,Decoy,0,-8.73076,-6.87,-1.25,-6.785289935691888
CC(=O)Nc1ccc([C@@H](O)/C(N=O)=C2/Nc3ccc(Cl)cc3NC2=O)cc1,C05398681_decoy,TRY1,Decoy,0,-8.43358,-8.8,-1.51,-6.390764188579981
NN1C(SCC(=O)Nc2ccccc2F)=NN[C@@H]1[C@@H]1N=NC2=C1CCC2,C38984693_decoy,TRY1,Decoy,0,-7.20871,-7.39,-1.61,-5.41946232023224
CSc1cccc(NC(=O)/C=C2\CS[C@H](NC(=O)c3ccc[nH]c3=O)N2)c1,C39590290_decoy,TRY1,Decoy,0,-7.69272,-6.56,-1.69,-5.585764376487725
CC(C)n1nccc1NS(=O)(=O)c1cc(Br)cnc1NN,C41069864_decoy,TRY1,Decoy,0,-7.10461,-6.26,-0.7,-8.001803715833855
C[C@@H]1CN(CCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C[C@H](C)O1,C41318089_decoy,TRY1,Decoy,0,-10.0168,-7.15,-1.51,-9.747807179368968
Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)C(=O)Nc1ccccc1CC(N)=O,C41897413_decoy,TRY1,Decoy,0,-7.41636,-7.81,-4.21,-6.378649520596673
CC(=O)Nc1ccc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)cc1,C45631533_decoy,TRY1,Decoy,0,-8.28437,-7.21,-3.35,-5.957802614000254
C[C@@H]1CN(CCCNC(=O)Nc2ccccc2SCC(N)=O)C[C@@H](C)O1,C45695593_decoy,TRY1,Decoy,0,-9.02768,-6.52,-2.66,-8.218158561451585
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=S)NC1CCCC1,C47071106_decoy,TRY1,Decoy,0,-9.97252,-6.31,-3.19,-6.353130153022088
Cc1c(NC(=O)C(=O)NCCCn2ccc3ccccc32)cccc1C(N)=O,C48885432_decoy,TRY1,Decoy,0,-7.88745,-7.86,-1.69,-6.98278565351024
Cc1cccc(C)c1NC(=O)C(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1,C49303419_decoy,TRY1,Decoy,0,-8.10206,-6.99,-3.02,-6.493440165869275
Cc1cc(OCC(=O)[C@H](C#N)c2nc(N)nc(N)n2)c(C(C)C)cc1Cl,C49435627_decoy,TRY1,Decoy,0,-7.8725,-7.98,-2.22,-10.025000002086305
Cc1cc(/C=C/C(=O)[C@@H](C#N)c2nc(N)nc(N)n2)c(C)n1C1CCCCC1,C49436098_decoy,TRY1,Decoy,0,-8.25294,-7.86,-1.13,-7.422494351684118
CC(C)(C)N1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C20548516_decoy,TRY1,Decoy,0,-6.69538,-5.28,-1.74,-5.176279880806331
C[C@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)N1CCO[C@H](C(N)=O)C1,C51130659_decoy,TRY1,Decoy,0,-9.69111,-6.34,-3.05,-5.668899513607597
CCS(=O)(=O)NCCCNC(=O)Nc1ccc(C(=O)NC)c(Cl)c1,C51618133_decoy,TRY1,Decoy,0,-9.3301,-5.72,-2.6,-6.11851596775019
C[C@H](Cc1ccsc1)NC(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C52583844_decoy,TRY1,Decoy,0,-8.98566,-6.71,-1.21,-7.1237185005723465
C[C@H](NC(=O)[C@@H](C)NC(=O)c1cccs1)c1cccc(S(N)(=O)=O)c1,C54320539_decoy,TRY1,Decoy,0,-8.20963,-7.36,-1.11,-8.12385968847199
Cc1cc(C)n(CC(=O)NNC(=O)NC2[C@@H]3CCC[C@H]2C[NH+](C2CC2)C3)n1,C56806695_decoy,TRY1,Decoy,0,-6.92607,-6.23,-2.84,-5.329662310677839
NC(=O)COc1ccc(/C=C/C(=O)NNC(=O)c2ccc(Cl)nc2)cc1,C58381854_decoy,TRY1,Decoy,0,-8.78632,-5.4,-2.23,-5.97213871338399
Cc1ccc(NC(=O)CSCC(=O)NNC(=O)NCC(F)(F)F)cc1,C60414869_decoy,TRY1,Decoy,0,-7.54516,-7.45,-1.92,-7.968882308773546
C=CCn1c(SCc2nc(N)nc(N)n2)nc2sc(C)c(C)c2c1=O,C07084740_decoy,TRY1,Decoy,0,-10.079,-8.47,-1.31,-15.139949822951532
Cc1cc(C)c(CNC(=O)NCc2ccc(N3CCNC(=O)C3)cc2)c(=O)[nH]1,C61552035_decoy,TRY1,Decoy,0,-7.70094,-7.23,-2.26,-6.498672602935091
C[C@@H](Cc1ccsc1)NC(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C62647660_decoy,TRY1,Decoy,0,-7.96198,-5.91,-0.78,-5.862632647806726
Cc1cc(C(=O)NNC(=S)NCC(F)(F)F)ccc1N1CCNC1=O,C64082800_decoy,TRY1,Decoy,0,-8.15215,-5.69,-1.76,-4.971655580263089
CCNC(=O)NNC(=O)CSCc1nc2sc3c(c2c(=O)[nH]1)CCC3,C65190982_decoy,TRY1,Decoy,0,-8.00615,-6.66,-2.1,-6.060745519066288
C[C@@H](NC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1)C(=O)NC(C)(C)C,C66923141_decoy,TRY1,Decoy,0,-7.64561,-7.05,-1.55,-7.198831094619006
O=C(NC[C@@H](O)c1ccccc1F)C(=O)Nc1ccc(NC(=O)C2CC2)nc1,C66984658_decoy,TRY1,Decoy,0,-8.0947,-7.41,-2.9,-5.915657899487437
CCNC(=O)Nc1cccc(F)c1C(=O)NCc1n[nH]c(=S)n1C(C)C,C67071480_decoy,TRY1,Decoy,0,-7.07145,-7.38,-1.77,-7.8890277108616
COc1ccc(OC)c([C@@H](O)CNC(=O)NNC(=O)c2sccc2C)c1,C67102087_decoy,TRY1,Decoy,0,-8.9705,-6.53,-1.74,-8.292667365998408
CC(=O)Nc1cccc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)c1,C67125650_decoy,TRY1,Decoy,0,-9.17173,-6.11,-2.59,-5.749749506441437
CNC(=O)c1ccccc1NC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21,C67143873_decoy,TRY1,Decoy,0,-8.07817,-6.58,-1.74,-5.937810069093407
Cc1ccc(N2C[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2=O)cc1C,C05188330_decoy,TRY1,Decoy,0,-9.15668,-7.99,-3.32,-6.828784125109711
NC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@H]2[C@@H]1N(Cc1ccco1)C(=S)N2Cc1cccs1,C08295910_decoy,TRY1,Decoy,0,-8.35906,-5.64,-2.17,-5.614275278366289
CN(C)c1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NC4CC4)[C@H]32)cc1,C08636524_decoy,TRY1,Decoy,0,-8.99425,-5.43,-2.37,-6.160589746130558
Nc1nc(N)nc(CSc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)n1,C08751558_decoy,TRY1,Decoy,0,-9.05527,-7.58,-2.18,-7.765397250705207
C=C1Nc2[nH]c(=S)[nH]c(=O)c2[C@H](c2ccc(O)cc2)[C@H]1C(=O)OCCOC,C03201550_decoy,TRY1,Decoy,0,-8.82758,-6.15,-1.95,-6.227163466513501
CCCn1c(N)c(C(=O)CSc2nc3ccc(OC)cc3[nH]2)c(=O)[nH]c1=O,C04273915_decoy,TRY1,Decoy,0,-7.32914,-7.83,-2.75,-10.007452201611976
Nc1ncnc2c1nc(SCc1cccc3nsnc13)n2C[C@H](O)CO,C03021165_decoy,TRY1,Decoy,0,-9.74218,-7.16,-1.24,-7.960582024835039
CCCn1c(S[C@H](C)C(=O)NC(=O)NC)nc2cc(S(N)(=O)=O)ccc21,C23044241_decoy,TRY1,Decoy,0,-8.226,-5.68,-1.79,-5.767754201771608
C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CSc1nnc(SCC(N)=O)s1,C24497224_decoy,TRY1,Decoy,0,-9.10167,-6.41,-1.96,-6.987717309757141
NC(=O)N[C@@H](CC(=O)NC[C@@H]1COc2ccccc2O1)c1ccccc1Cl,C24775407_decoy,TRY1,Decoy,0,-7.64321,-7.68,-3.69,-5.783295176740552
O=c1[nH]cnc2c1nc(SCc1ccccc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08582542_decoy,TRY1,Decoy,0,-7.41988,-7.26,-1.73,-5.7089015965943775
COc1ccc(O)c(C(=O)Nc2c(N)n(-c3ccc(F)cc3)c(=O)n(C)c2=O)c1,C39125223_decoy,TRY1,Decoy,0,-7.31831,-7.12,-1.3,-5.484973216959832
CC(=O)Nc1c([O-])[nH+]c(S[C@H](C)C(=O)Nc2ccc(C(C)=O)cc2)[nH]c1=O,C13565064_decoy,TRY1,Decoy,0,-8.40425,-6.2,-4.86,-5.64996056889233
CC(=O)NCc1ccc([C@H]2CS[C@@H](NC(=O)CCc3c(C)nc(C)[nH]c3=O)N2)s1,C39446474_decoy,TRY1,Decoy,0,-8.34426,-5.86,-3.61,-5.728859247828374
Cc1c(C(=O)NCCN2CCOCC2)oc2c1/C(=N/NC(N)=O)CC(C)(C)C2,C39856250_decoy,TRY1,Decoy,0,-8.31087,-7.62,-1.63,-5.900299729140356
Nc1c(NNC(=O)c2cccnc2)ncnc1Oc1ccc(Br)cc1,C40794148_decoy,TRY1,Decoy,0,-7.69031,-8.06,-2.33,-6.311194865280327
C[C@H]1CN(CCCNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C[C@H](C)O1,C41275865_decoy,TRY1,Decoy,0,-9.37268,-6.65,-2.49,-7.490618384568921
Cc1[nH+]c2ccc(F)cc2c(Nc2ccc(S(N)(=O)=O)cc2)c1CC(=O)[O-],C41495407_decoy,TRY1,Decoy,0,-6.94541,-8.71,-1.4,-8.932194863219541
CCC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](O)c2ccc(F)c(F)c2)cc1,C41740079_decoy,TRY1,Decoy,0,-7.31927,-7.09,-3.5,-5.481014335916315
CC(=O)Nc1ccc(/C=C\C(=O)Nc2nc(C)c(SCC(N)=O)s2)cc1,C41813529_decoy,TRY1,Decoy,0,-9.26512,-5.76,-3.17,-6.2459801532021375
CC(=O)N/C(=C/c1ccccc1)C(=O)Nc1nc(C)c(SCC(N)=O)s1,C41813550_decoy,TRY1,Decoy,0,-8.75089,-6.78,-1.81,-7.191842202760685
C#Cc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1,C42073080_decoy,TRY1,Decoy,0,-8.67482,-6.57,-4.48,-5.653414686876008
Cc1ccc([C@@H](CNC(=O)Nc2ccc(F)c(C(N)=O)c2)N2CCOCC2)o1,C45692940_decoy,TRY1,Decoy,0,-8.71387,-7.93,-1.95,-8.589979431731141
NC(=O)c1cc(NC(=O)CCCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl,C46577038_decoy,TRY1,Decoy,0,-8.48438,-7.0,-2.25,-5.827845418744501
CC(C)(CNC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(Br)cc1,C47084405_decoy,TRY1,Decoy,0,-7.39705,-7.13,-2.83,-5.806888264451177
CCc1cccc(C)c1NC(=O)C(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1,C49302798_decoy,TRY1,Decoy,0,-9.1062,-7.97,-2.21,-7.253699982571484
CCc1cccc(C)c1NC(=O)C(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1,C49302801_decoy,TRY1,Decoy,0,-8.43457,-8.26,-1.71,-7.197656303468283
COc1c(C)cnc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1C,C51755294_decoy,TRY1,Decoy,0,-8.57243,-7.55,-0.76,-7.754311675416555
CCNC(=O)c1ccc(C)c(NCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1,C55857902_decoy,TRY1,Decoy,0,-8.45366,-7.11,-1.7,-7.3955357719594
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cc1,C57005855_decoy,TRY1,Decoy,0,-9.09103,-6.31,-1.67,-5.69996183105212
Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1,C48193060_decoy,TRY1,Decoy,0,-10.3422,-7.15,-2.67,-7.007035600436047
CC(C)(C)n1ncc2c(=O)[nH]c(NCCc3ccc(S(N)(=O)=O)cc3)nc21,C60342817_decoy,TRY1,Decoy,0,-7.68306,-5.95,-1.09,-5.553760092495748
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C20610733_decoy,TRY1,Decoy,0,-8.34622,-4.67,-2.87,-5.107566015875036
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C15957063_decoy,TRY1,Decoy,0,-7.59364,-7.37,-3.74,-7.369970723583015
C[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccc2c(c1)OCO2,C41236573_decoy,TRY1,Decoy,0,-7.88947,-7.96,-1.41,-5.911148323317839
O=C(NCCCOc1ccc(Cl)cc1Cl)NNC(=O)C(=O)NC1CC1,C63407065_decoy,TRY1,Decoy,0,-7.89226,-6.82,-2.07,-5.716933072932157
C#CCNC(=O)c1ccccc1NCC(=O)NN1C(=O)NC2(CCCCC2)C1=O,C63461994_decoy,TRY1,Decoy,0,-7.96044,-5.38,-3.19,-5.0604104091292506
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NC[C@H](O)c2ccccc2F)cc1,C65479914_decoy,TRY1,Decoy,0,-8.65462,-7.0,-3.07,-7.325498611978799
CC(=O)Nc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)c1,C41919993_decoy,TRY1,Decoy,0,-9.1931,-8.08,-2.19,-6.428881844385293
N#Cc1cnn(-c2ccc(C(=O)NCc3nc(-c4cccs4)n[nH]3)cc2)c1N,C66428504_decoy,TRY1,Decoy,0,-9.51815,-8.87,-3.31,-8.133453070381282
Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)Nc1ccc(/C=C(/C#N)C(N)=O)cc1,C67019718_decoy,TRY1,Decoy,0,-8.74686,-7.38,-2.08,-6.300290625735356
CCn1c(CNC(=O)C(=O)NNc2ccc(Cl)cc2Cl)n[nH]c1=S,C67050593_decoy,TRY1,Decoy,0,-9.13247,-5.7,-2.24,-5.475049415601561
CCNC(=O)c1ccccc1NC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21,C67163301_decoy,TRY1,Decoy,0,-7.74643,-7.54,-1.63,-7.490211407430134
CC(=O)N[C@@H](CC(=O)NNC(=O)Nc1ccccc1C)c1c(F)cccc1F,C67193466_decoy,TRY1,Decoy,0,-7.88294,-8.32,-1.06,-8.086485196249159
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)c1c[nH]c(=O)c(Cl)c1,C67337254_decoy,TRY1,Decoy,0,-7.77742,-7.12,-1.18,-6.165089052496996
CNC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)cc1Cl,C67396065_decoy,TRY1,Decoy,0,-8.75977,-8.2,-3.16,-7.181215972800533
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N[C@H]2c3ccccc3C[C@@H]2O)c1,C67469126_decoy,TRY1,Decoy,0,-8.33613,-6.7,-2.44,-5.878089320734612
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cc(C)oc2C)c1,C67469273_decoy,TRY1,Decoy,0,-8.1415,-5.25,-2.46,-5.366303041789606
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cccnc1-n1cccn1,C67475014_decoy,TRY1,Decoy,0,-7.29246,-6.01,-2.46,-5.122401353300847
Cc1cc(C)c(CNC(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c(=O)[nH]1,C67590756_decoy,TRY1,Decoy,0,-7.5595,-7.39,-1.69,-6.758611061212286
CC(C)(C)NC(=O)[C@@H](c1ccc(F)cc1)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06074508_decoy,TRY1,Decoy,0,-7.7163,-7.87,-3.01,-9.018161319027676
CCC(C)(C)NC(=O)[C@H](c1c[nH]c2ccccc12)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06462162_decoy,TRY1,Decoy,0,-9.82775,-7.49,-2.91,-10.690142774461302
CCC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(OC)cc1,C06462177_decoy,TRY1,Decoy,0,-7.26781,-6.81,-1.38,-8.572504395888993
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC(C)(C)C)c1ccc(C)cc1,C06631391_decoy,TRY1,Decoy,0,-8.34623,-7.57,-1.53,-9.689317157392155
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)o2)cc1,C06822063_decoy,TRY1,Decoy,0,-9.30847,-7.79,-1.77,-9.112152670036428
COCCNC(=O)[C@H](c1ccc(F)cc1)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06905047_decoy,TRY1,Decoy,0,-7.83977,-7.81,-1.52,-9.91611809021654
CNC(=S)NNC(=O)c1sc2nnc(-c3ccccc3)c(-c3ccccc3)c2c1N,C08636719_decoy,TRY1,Decoy,0,-7.69327,-6.6,-3.25,-6.370028929978964
NC(=O)c1c(NC(=O)COC(=O)c2cc(Cl)cc(Cl)c2N)sc2c1CCCC2,C08752508_decoy,TRY1,Decoy,0,-10.7172,-7.72,-4.05,-7.101970382828371
NC(=O)c1c(NC(=O)CSc2nnc(C3CCCCC3)n2N)sc2c1CCCC2,C10538063_decoy,TRY1,Decoy,0,-11.568,-6.18,-2.09,-7.50418474986113
NC(=O)c1c(NC(=O)CSc2nnc(-c3cccs3)n2N)sc2c1CCCC2,C10864507_decoy,TRY1,Decoy,0,-11.7843,-7.6,-3.24,-7.583108933650355
C[C@@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)c(Cl)c1,C12476555_decoy,TRY1,Decoy,0,-7.72985,-4.62,-1.71,-5.620071729803954
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2cccs2)c(C)c1,C12711016_decoy,TRY1,Decoy,0,-8.03157,-4.75,-3.44,-5.417410641800939
Cc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)c(C)c2)o1,C12714775_decoy,TRY1,Decoy,0,-7.85267,-7.39,-3.02,-7.029299087036616
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)o1,C12715523_decoy,TRY1,Decoy,0,-8.55009,-6.97,-1.92,-10.718896489670238
NC(=O)c1c(NC(=O)CSc2nnc(-c3ccc(F)cc3)n2N)sc2c1CCC2,C16788323_decoy,TRY1,Decoy,0,-10.3082,-8.81,-2.44,-9.588880604289804
CCCc1n[nH]c2c1[C@@H](c1ccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(CCC)c43)cc1)C(C#N)=C(N)O2,C12411423_decoy,TRY1,Decoy,0,-6.87703,-5.73,-2.1,-5.884362137106218
C/C(=N\Nc1nc(SCCC(=O)Nc2ccc(S(N)(=O)=O)cc2)n[nH]1)C12CC3CC(CC(C3)C1)C2,C20837437_decoy,TRY1,Decoy,0,-11.401,-5.85,-2.23,-7.532462682637255
CCc1nc(SCC(=O)Nc2sccc2C(N)=O)nc(N)c1-c1ccc(Cl)cc1,C24989587_decoy,TRY1,Decoy,0,-7.84763,-6.86,-1.21,-6.06269889774421
O=C(/C=C/c1ccc(Cl)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35405088_decoy,TRY1,Decoy,0,-8.22787,-7.94,-2.18,-12.337367205495562
CN(C(=O)c1cccc(O)c1O)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36531295_decoy,TRY1,Decoy,0,-9.05954,-5.99,-2.87,-6.138588474141601
CCCN(C(=O)c1c(O)cccc1O)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36570974_decoy,TRY1,Decoy,0,-7.53449,-4.84,-3.64,-5.236469912723816
CCCN(C(=O)c1cccc(O)c1O)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36571256_decoy,TRY1,Decoy,0,-8.1154,-5.96,-1.37,-6.282192030999036
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36597688_decoy,TRY1,Decoy,0,-7.78629,-5.93,-2.1,-6.195271764125233
CC(C)(O)[C@@H](O)CC[C@@H](CO)[C@H]1CC[C@]2(C)C3=C(C[C@H](O)[C@@]12C)[C@]1(C)C[C@H](O)[C@H](O)C(C)(C)[C@H]1CC3,C35271618_decoy,TRY1,Decoy,0,-10.4325,-7.8,-1.11,-6.974854651864968
COc1ccc2[nH]cc(CCN/C(=N\C(=O)CS[C@@H]3NN[C@@H](C)S3)Nc3nc(C)cc(C)n3)c2c1,C38787628_decoy,TRY1,Decoy,0,-9.78386,-7.2,-2.91,-6.826764005189972
Cc1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C38984631_decoy,TRY1,Decoy,0,-11.011,-9.75,-0.87,-11.040139588902276
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(Br)cc4)N3N)N=N2)cc1,C38989646_decoy,TRY1,Decoy,0,-9.9286,-6.58,-1.14,-7.141696966617969
Cc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4c(C)cc(C)cc4C)N3N)N=N2)cc1,C38994997_decoy,TRY1,Decoy,0,-10.3694,-9.73,-1.48,-11.568521815337798
Cc1cc(C)cc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)c1,C38995182_decoy,TRY1,Decoy,0,-8.25915,-8.2,-1.69,-8.833589212994141
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4cc(C)cc(C)c4)N3N)N=N2)cc1,C39007182_decoy,TRY1,Decoy,0,-9.08346,-7.84,-1.91,-6.515404535915985
NN1[C@@H](SCC(=O)Nc2ccc(Cl)cc2)NN[C@@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39007643_decoy,TRY1,Decoy,0,-10.1979,-6.65,-2.06,-6.712483118252544
Cc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C)N3N)N=N2)cc1,C39011876_decoy,TRY1,Decoy,0,-8.94654,-6.58,-2.7,-6.088214226606888
Cc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C)N3N)N=N2)cc1,C39011877_decoy,TRY1,Decoy,0,-9.7126,-7.8,-1.55,-6.591720672046175
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C)N3N)N=N2)cc1,C39011878_decoy,TRY1,Decoy,0,-8.37088,-7.69,-1.86,-5.744189858535265
Cc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C)N3N)N=N2)cc1,C39011879_decoy,TRY1,Decoy,0,-8.77818,-9.63,-2.52,-7.385290046748585
NN1[C@@H](SCC(=O)Nc2ccc(F)c(Cl)c2)NN[C@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39012502_decoy,TRY1,Decoy,0,-10.9223,-6.14,-0.82,-7.451602662773932
Cc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4cc(C)ccc4C)N3N)N=N2)cc1,C39012758_decoy,TRY1,Decoy,0,-9.3855,-9.31,-1.9,-10.409271004955489
O=C(N/N=C/c1ccc(/C=N/NC(=O)c2cc(O)cc(O)c2)cc1)c1cc(O)cc(O)c1,C02848943_decoy,TRY1,Decoy,0,-9.10057,-7.74,-3.65,-10.85088810608894
Cc1cccc(NC(=O)N[C@@H]2N/C(=C\C(=O)NCCc3c[nH]c4ccccc34)CS2)c1,C39709733_decoy,TRY1,Decoy,0,-7.13215,-8.8,-1.9,-6.420070534954794
Cc1cccc(NC(=O)N[C@H]2N/C(=C\C(=O)NCCc3c[nH]c4ccccc34)CS2)c1,C39709734_decoy,TRY1,Decoy,0,-7.64844,-7.88,-2.47,-7.481333963381014
CCOC(=O)CSc1nnc(N)n1[C@H](C)C(=O)Nc1scc(-c2ccc(C)cc2)c1C(N)=O,C40174560_decoy,TRY1,Decoy,0,-8.0875,-6.19,-2.81,-6.666581558415912
COc1ccc(C)cc1Nc1ncnc(NNC(=O)c2ccc(Br)cc2)c1N,C40684394_decoy,TRY1,Decoy,0,-7.87309,-6.76,-3.83,-5.288464532293133
CC(=O)c1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)cc1,C40782783_decoy,TRY1,Decoy,0,-7.85831,-6.39,-3.02,-5.54062510226462
Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1NNC(=O)c1ccc(Cl)cc1,C40784423_decoy,TRY1,Decoy,0,-9.61967,-6.92,-3.29,-6.3186130376361564
Nc1c(NCc2ccccc2Cl)ncnc1NNC(=O)c1ccc(Br)cc1,C40784561_decoy,TRY1,Decoy,0,-9.94456,-5.92,-2.22,-6.237730597306102
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCc1cccc(Br)c1,C20292298_decoy,TRY1,Decoy,0,-9.58439,-9.64,-1.85,-11.245094120576471
CC1=C2C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)S[C@@H]2N(c2ccccc2Cl)N1,C39936296_decoy,TRY1,Decoy,0,-8.03906,-9.56,-0.52,-6.897765304464917
CC1=C2C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)S[C@@H]2N(Cc2ccc(Cl)cc2)N1,C39939991_decoy,TRY1,Decoy,0,-10.7918,-9.02,-1.83,-8.039126351591019
CCc1ccc(C2=C[C@H](C(=O)N[C@@H]3S[C@@H](Nc4ccc(C)cc4)N[C@H]3C(N)=O)N=N2)cc1,C64728947_decoy,TRY1,Decoy,0,-10.1149,-7.53,-1.49,-7.6352193217065185
CCCNC(=O)O[C@@H]1CC[C@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)N2CC[C@@H](O)C2)[C@]1(C)CO,C04236697_decoy,TRY1,Decoy,0,-8.84238,-6.05,-1.44,-6.589070237974177
CC(=O)N(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc(Oc2ccc(Cl)cc2)cc1,C05760855_decoy,TRY1,Decoy,0,-6.71872,-8.09,-1.38,-5.816090737463687
CC(=O)N(O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc(Oc2ccc(Cl)cc2)cc1,C05760856_decoy,TRY1,Decoy,0,-6.51844,-5.75,-3.06,-4.429999157471877
COc1cc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NC4CCCC4)[C@H]3S2)cc(OC)c1,C08254688_decoy,TRY1,Decoy,0,-9.88406,-6.54,-0.43,-7.215582010436678
Nn1c(SCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)nnc1-c1ccco1,C09376203_decoy,TRY1,Decoy,0,-9.42285,-7.08,-2.17,-6.784540212510559
NC(=O)c1c(NC(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)sc2c1CCCC2,C03358442_decoy,TRY1,Decoy,0,-9.44983,-8.71,-2.65,-7.762016041389099
C[C@@H](Sc1nnnn1-c1ccc(O)cc1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C09882758_decoy,TRY1,Decoy,0,-9.34703,-8.05,-2.77,-6.900375231793641
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2c(O)c3sccc3[nH]c2=O)n1C,C12340411_decoy,TRY1,Decoy,0,-8.72338,-7.85,-2.97,-6.584856826325445
Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=S)Nc1ccccc1F,C14311553_decoy,TRY1,Decoy,0,-8.61358,-7.33,-3.7,-5.835995695854606
COc1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NCCN4CCOCC4)[C@H]32)cc1,C20504106_decoy,TRY1,Decoy,0,-9.08463,-5.67,-1.34,-6.651823149516763
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3ccc(N(C)C)cc3)n2N)n1,C20527637_decoy,TRY1,Decoy,0,-8.94343,-8.06,-2.57,-7.19168020657319
COc1cc([C@@H]2[C@H](C(=O)Nc3ccc(C)cc3C)[C@@H](C)Nc3ncnn32)ccc1OCC(N)=O,C20804102_decoy,TRY1,Decoy,0,-8.54055,-4.81,-2.65,-5.348715425622824
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc4c(c3)C(=O)NC4=O)n[nH]2)o1,C21080941_decoy,TRY1,Decoy,0,-8.58279,-8.69,-2.06,-6.98554101325518
CC[C@@](O)(C(=O)[O-])c1cc2n(c(=O)c1CO)Cc1cc3c(C[NH+](C)C)c(O)ccc3nc1-2,C22067027_decoy,TRY1,Decoy,0,-6.20616,-6.52,-3.62,-4.535768547914948
CCCCn1c(N)c(N(C)C(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)c(=O)[nH]c1=O,C23122254_decoy,TRY1,Decoy,0,-8.5831,-7.29,-3.61,-7.378628664807362
NS(=O)(=O)c1cccc(S(=O)(=O)NNc2ncc(C(F)(F)F)cc2Cl)c1,C23391383_decoy,TRY1,Decoy,0,-9.53674,-6.79,-0.12,-7.426036455918791
C=CCn1c(-c2ccc(C)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594266_decoy,TRY1,Decoy,0,-6.70121,-4.77,-3.37,-4.767757078795796
CC[C@@H](C)n1c(-c2ccc(C)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594324_decoy,TRY1,Decoy,0,-7.70049,-5.83,-3.3,-5.49222918215893
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@](C(=O)[O-])([C@@H](C)O)[NH2+][C@H]2c1cc(Br)ccc1O,C34380660_decoy,TRY1,Decoy,0,-7.14259,-6.73,-1.48,-5.620449438871615
Nc1c(C(=O)CSc2nc(-c3ccccc3Br)n[nH]2)c(=O)[nH]c(=O)n1C1CC1,C09713607_decoy,TRY1,Decoy,0,-7.95606,-7.39,-2.22,-5.92953713579578
COc1cc(/C=N/NC(=O)[C@H](C)N[C@H]2N=NC(=O)NC2=O)cc(Br)c1O,C38815400_decoy,TRY1,Decoy,0,-9.07601,-5.29,-1.94,-5.411911491936497
Cc1cccc(N2C(SCC(=O)Nc3nccs3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361760_decoy,TRY1,Decoy,0,-9.40688,-8.1,-1.69,-9.448221482486003
CC(C)S(=O)(=O)c1ccc(NS(=O)(=O)[O-])c(N2CC[NH2+][C@@H](c3ccccc3O)C2)c1,C39482863_decoy,TRY1,Decoy,0,-8.24598,-6.13,-0.89,-5.933694475173581
CC(C)S(=O)(=O)c1ccc(NS(=O)(=O)c2ccccc2[O-])c(N2CC[NH2+][C@H](O)C2)c1,C39482914_decoy,TRY1,Decoy,0,-8.29787,-6.74,-2.01,-7.4452680120366415
O=C(CCn1c(=O)oc2cc(Cl)ccc21)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558918_decoy,TRY1,Decoy,0,-7.99504,-8.8,-1.24,-6.601903584559103
O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558969_decoy,TRY1,Decoy,0,-7.48049,-8.53,-2.12,-7.371617335426397
CCc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CO)(C(=O)[O-])[NH2+][C@H]3c2cccc(OC)c2O)cc1,C33916412_decoy,TRY1,Decoy,0,-7.94126,-7.01,-1.54,-6.132157525970295
CCc1ccc(N2C(=O)[C@H]3[C@@H](c4ccc(O)c(OC)c4)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]3C2=O)cc1,C33925781_decoy,TRY1,Decoy,0,-7.9882,-5.63,-0.95,-5.650435827083007
CCNC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)N2CC[C@@H](O)C2)[C@]1(C)CO,C43553748_decoy,TRY1,Decoy,0,-8.53536,-5.73,-3.54,-6.242627550269277
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)N2CC[C@@H](O)C2)[C@]1(C)CO,C43553888_decoy,TRY1,Decoy,0,-8.65068,-1.65,-4.7,-4.0186462870870425
COc1ccc(Oc2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@@H](O)[C@H]4O)ccc3c2=O)cc1,C43740177_decoy,TRY1,Decoy,0,-7.56823,-7.21,-1.63,-5.80752303768292
CC[C@](O)(C(=O)[O-])C1=CC2=c3nc4c(cc3CN2C(O)=C1CO)=C(C[NH+](C)C)C(=O)C=C4,C44028970_decoy,TRY1,Decoy,0,-6.91363,-6.77,-3.03,-5.130008163853581
Nn1c(SCCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)nnc1-c1ccco1,C45697342_decoy,TRY1,Decoy,0,-9.00983,-7.26,-2.59,-6.652931624819817
NC(=O)CC[C@H]1N[C@@]2(C(=O)Nc3ccc(F)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]21,C16021328_decoy,TRY1,Decoy,0,-8.34287,-6.38,-1.36,-5.928553519264102
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3ccc(F)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C16021322_decoy,TRY1,Decoy,0,-8.71616,-7.98,-1.5,-8.940830119074905
COCCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C13572494_decoy,TRY1,Decoy,0,-7.46373,-6.56,-1.65,-5.769568661429391
COCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC(N)=O)C(=O)Nc2ccc(Br)cc21,C16022272_decoy,TRY1,Decoy,0,-9.23185,-4.8,-0.12,-5.943899172824604
NC(=O)c1c(NC(=O)COC(=O)c2n[nH]c(=O)c3ccccc23)sc2c1CCCC2,C57868769_decoy,TRY1,Decoy,0,-8.90145,-8.27,-2.07,-6.076126095900111
CC(C)c1ccc([C@@]2(C)NC(=O)N(CC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)C2=O)cc1,C59010326_decoy,TRY1,Decoy,0,-8.13594,-7.07,-3.82,-5.69439177225361
Nc1nnc(SCC(=O)N2CCN(C(=O)CSc3nnc(N)s3)CC2)s1,C15156303_decoy,TRY1,Decoy,0,-9.55875,-6.93,-2.46,-7.717765836638506
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3cccc([N+](=O)[O-])c3)n2N)n1,C20291916_decoy,TRY1,Decoy,0,-8.45415,-6.3,-1.33,-5.6703580441436285
C[C@@H](Sc1nc(N/N=C/c2ccc([N+](=O)[O-])cc2)n[nH]1)C(=O)NNC(=O)C1CCC1,C59878433_decoy,TRY1,Decoy,0,-8.37286,-6.38,-2.94,-5.969318705846956
COc1cc(N)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1,C60382666_decoy,TRY1,Decoy,0,-8.82136,-8.73,-1.48,-8.113144812647791
COC1=C/C(=C(\C)NNC(=O)c2nnn(-c3nonc3N)c2-c2cccs2)C=CC1=O,C15880027_decoy,TRY1,Decoy,0,-7.88044,-8.13,-4.25,-6.230764933167897
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](CCC(N)=O)N[C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C15958056_decoy,TRY1,Decoy,0,-8.69177,-7.86,-1.98,-7.161669671065669
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2cccs2)N1C1CC1,C39940128_decoy,TRY1,Decoy,0,-9.51132,-6.35,-1.85,-6.088080941492439
[NH3+][C@H]1/C(=C(\[O-])CSc2nnc(C3=c4ccccc4=[NH+]C3)n2C2CC2)C(=O)N=C([O-])N1C1CC1,C63896771_decoy,TRY1,Decoy,0,-8.12007,-7.83,-2.06,-7.594257412954685
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Cc2ccccc2)N1C,C64137911_decoy,TRY1,Decoy,0,-6.87145,-7.77,-2.1,-5.581480353178917
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(Cc2ccccc2)N1C,C64137912_decoy,TRY1,Decoy,0,-7.45056,-6.65,-1.75,-6.074453079055471
Cc1ccc2c(c1)S[C@@H](NC(=O)CSc1nnc(Cc3c(C)[nH]c(=O)[nH]c3=O)o1)N2,C64411389_decoy,TRY1,Decoy,0,-9.3879,-5.7,-2.13,-5.978290900561065
C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@]12C(=O)N(CC(N)=O)c1ccccc12,C02231151_decoy,TRY1,Decoy,0,-5.90965,-4.98,-1.2,-5.309480533533858
O=c1cc(C(F)(F)F)c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2o1,C04521883_decoy,TRY1,Decoy,0,-6.71316,-6.14,-2.08,-4.05241941349396
NNC(=O)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccc(Br)o1,C00854227_decoy,TRY1,Decoy,0,-8.61383,-6.53,-2.56,-5.887746952794846
CC1(C)CC(=O)C2=C(C1)OC1=C(C(=O)CC(C)(C)C1)C2[C@H](O)[C@H](O)[C@H](O)CO,C04743038_decoy,TRY1,Decoy,0,-7.76457,-4.83,-1.7,-5.242315998970319
CC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1C,C03522069_decoy,TRY1,Decoy,0,-9.49923,-7.54,-0.96,-6.039232910353919
CC(C)n1ncc2c(C(=O)NCCCc3n[nH]c(N)c3C#N)cc(C3CC3)nc21,C08013810_decoy,TRY1,Decoy,0,-8.5432,-7.52,-0.88,-7.617824252582097
CCNC(=O)NC(=O)COC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C11440472_decoy,TRY1,Decoy,0,-8.19828,-6.29,-3.49,-6.778189934984267
CNC(=O)NC(=O)[C@@H](C)OC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C11440507_decoy,TRY1,Decoy,0,-8.40002,-7.4,-3.56,-7.97166362145142
O=c1c(-c2ccc3ccccc3n2)coc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)ccc12,C16040850_decoy,TRY1,Decoy,0,-7.93824,-8.12,-2.09,-6.050612008300274
Cc1cc(=O)[nH]c(-n2nc(C)c(CCC(=O)Nc3ccccc3C(N)=O)c2C)n1,C16849722_decoy,TRY1,Decoy,0,-7.0634,-7.44,-2.01,-6.794652844813918
C/C(=N\Nc1nnc(SCC(=O)Nc2nccs2)n1N)c1cccs1,C21325357_decoy,TRY1,Decoy,0,-8.99877,-7.75,-5.65,-6.825525214389518
CNC(=O)NC(=O)[C@H](OC(=O)c1cc(S(N)(=O)=O)ccc1Cl)c1ccccc1,C25029375_decoy,TRY1,Decoy,0,-8.63299,-6.67,-3.83,-6.167763410705912
O=c1cc(C(F)(F)F)c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1,C25758475_decoy,TRY1,Decoy,0,-6.38583,-6.5,-4.16,-5.089058911410304
C[C@@H]1CC[C@@]23CC[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@]12C(C=O)=CC3(C)C,C31157778_decoy,TRY1,Decoy,0,-6.04495,-6.12,-3.04,-4.828708690803758
C[C@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2O)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@@H]21,C34380645_decoy,TRY1,Decoy,0,-7.42854,-6.07,-1.22,-5.216591351669123
C[C@@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2O)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@@H]21,C34380647_decoy,TRY1,Decoy,0,-7.44566,-6.11,-1.56,-5.426681328851315
Cc1cc([C@H]2[NH2+][C@@](C(=O)[O-])([C@@H](C)O)[C@@H]3C(=O)N(C(C)(C)C)C(=O)[C@@H]23)cc(C)c1O,C34388737_decoy,TRY1,Decoy,0,-7.79644,-6.87,-1.7,-6.329942910227458
C[C@@H](NC(=O)CCN1C(=O)N[C@@H]2NC(=O)N[C@@H]21)c1cc2cc(Cl)ccc2o1,C36748704_decoy,TRY1,Decoy,0,-8.60493,-8.18,-2.07,-7.1922719230423695
O=C(NC(=S)Nc1ccc2[nH]c(=O)[nH]c2c1)c1cncc(Br)c1,C13555383_decoy,TRY1,Decoy,0,-8.46594,-8.1,-0.11,-8.073537018373724
COC(=O)[C@](NC(C)=O)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C04177284_decoy,TRY1,Decoy,0,-8.80667,-4.89,-4.07,-6.16151221580513
NN1C(SCC(=O)Nc2ccc(Cl)cn2)=NN[C@H]1[C@@H]1N=NC2=C1CCC2,C38748428_decoy,TRY1,Decoy,0,-8.68743,-8.78,-2.25,-8.051732291581116
O=C(NNC(=O)c1cc(Br)c[nH]1)c1ccc(-n2cc[nH]c2=S)cc1,C40119777_decoy,TRY1,Decoy,0,-10.0723,-5.5,-0.9,-5.820388221282797
Nc1c(Nc2ccc(Br)cn2)ncnc1N1CCN(CCO)CC1,C40734335_decoy,TRY1,Decoy,0,-8.41703,-6.77,-0.29,-5.908993235614909
CC(=O)Nc1cccc(NC(=S)NNC(=O)/C=C/c2ccccc2[N+](=O)[O-])c1,C45156145_decoy,TRY1,Decoy,0,-6.26251,-7.31,-1.22,-5.720005948385719
O=C(Nc1cccc(Cl)c1)C(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C48591525_decoy,TRY1,Decoy,0,-8.52923,-6.01,-0.4,-5.751993750934612
O=C(Nc1cc(F)ccc1F)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C48591611_decoy,TRY1,Decoy,0,-7.23113,-8.48,-0.32,-6.920967593648747
O=C(Nc1c(F)cccc1F)C(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C48591624_decoy,TRY1,Decoy,0,-8.11385,-7.91,-3.32,-7.176264159439997
O=C(Nc1ccc(F)c(F)c1)C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C48591627_decoy,TRY1,Decoy,0,-8.65001,-8.56,-2.55,-8.0926486887458
O=C(Nc1cc(F)cc(F)c1)C(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C48591842_decoy,TRY1,Decoy,0,-7.8783,-8.44,-1.77,-7.242260676703049
CNC(=O)c1cc(NC(=O)C(=O)NC[C@@H](O)c2ccc(F)c(F)c2)ccc1F,C50165658_decoy,TRY1,Decoy,0,-8.74116,-7.57,-1.13,-6.242303415312067
COC(=O)[C@H](F)C(Nc1ccc(NC(C)=O)cc1)=C1C(=O)NC(=S)NC1=O,C54501400_decoy,TRY1,Decoy,0,-7.57112,-6.6,-0.89,-5.9676328635514535
O=C(NCc1cn2cc(Br)ccc2n1)NNC(=O)C(=O)NC1CC1,C57344549_decoy,TRY1,Decoy,0,-8.8688,-7.28,-2.01,-6.650064458147772
NC(=O)c1c(NC(=O)CN2C(=O)N[C@@]3(CCSC3)C2=O)sc2c1CCC2,C31646831_decoy,TRY1,Decoy,0,-9.52041,-6.11,-3.62,-6.231538242890435
NC(=O)Cn1cc(NC(=O)NC2(c3ccc(Br)cc3)CCC2)cn1,C56501197_decoy,TRY1,Decoy,0,-7.76793,-5.92,-0.83,-5.681882951036039
CCOC(=O)C1=C(C)OC(N)=C(C(N)=O)[C@@H]1c1cc(OC)c(OC)c(OC)c1,C58948570_decoy,TRY1,Decoy,0,-7.1549,-4.67,-3.45,-5.020977646279417
CCOC(=O)C1=C(C)OC(N)=C(C(N)=O)[C@H]1c1cc(OC)c(OC)c(OC)c1,C58948572_decoy,TRY1,Decoy,0,-6.39635,-4.29,-2.2,-4.724825075867922
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccccc1O,C61477180_decoy,TRY1,Decoy,0,-7.3625,-9.09,-1.83,-8.445480658083087
NC(=O)c1ccc(Cl)cc1OS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1,C63309906_decoy,TRY1,Decoy,0,-7.80775,-6.55,-2.66,-5.229963865960457
Cc1ccc(F)c(NC(=S)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1,C63344588_decoy,TRY1,Decoy,0,-7.54954,-6.16,-1.85,-5.802379171424269
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C20758694_decoy1,TRY1,Decoy,0,-6.64984,-5.09,,-4.485942486052874
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NCc2c(C)cc(C)[nH]c2=O)cc1,C65479339_decoy,TRY1,Decoy,0,-8.17084,-7.53,-2.74,-10.337074146878212
Cc1n[nH]c(-c2ccc(OC[C@@H]3CCCO3)c(Br)c2)c1C(=O)NN,C66135075_decoy,TRY1,Decoy,0,-8.1966,-6.34,-2.13,-6.393119858701202
O=C1COc2ccc(NC(=O)C(=O)NC[C@@]3(O)CCCc4ccccc43)cc2N1,C67000476_decoy,TRY1,Decoy,0,-9.1423,-8.16,-1.64,-6.134668712312667
NC(=O)[C@@H]1CCCN(c2ccc(NC(=O)c3cccc4c3OCC(=O)N4)cn2)C1,C67019679_decoy,TRY1,Decoy,0,-8.11069,-7.79,-1.02,-6.409617285401522
Cc1ccsc1C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O,C67041724_decoy,TRY1,Decoy,0,-8.23204,-6.62,-1.2,-6.285376904421779
CC(=O)Nc1cc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)ccc1F,C67143575_decoy,TRY1,Decoy,0,-7.6912,-7.29,-2.21,-5.793844006366054
CC(=O)Nc1ccc(F)c(NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)c1,C67145092_decoy,TRY1,Decoy,0,-8.20687,-6.61,-2.4,-5.920654431794081
CCNC(=O)c1cc(Cl)ccc1NC(=O)C1CCC2(CC1)NC(=O)NC2=O,C67313330_decoy,TRY1,Decoy,0,-7.80656,-7.0,-2.94,-5.28782921618095
Cc1ccc(NC(=O)C(=O)NCC2(c3ccc4c(c3)OCO4)CC2)cc1C(N)=O,C67565137_decoy,TRY1,Decoy,0,-7.99724,-6.92,-2.42,-5.9162724019367525
Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2oc3ccc(F)cc3c2C)cc1C(N)=O,C67565854_decoy,TRY1,Decoy,0,-8.38222,-7.47,-1.04,-6.901943245532109
NNC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccc(Br)cc1,C04549094_decoy,TRY1,Decoy,0,-7.25287,-5.99,-1.07,-5.043776011281796
NNC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccccc1Br,C04592765_decoy,TRY1,Decoy,0,-8.03338,-5.97,-1.85,-5.371027452374762
CNc1nc(SCc2ccccc2)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04946635_decoy,TRY1,Decoy,0,-6.58213,-8.25,-1.31,-6.879483400985852
COCCNC(=O)c1c(N)n(/N=C/c2cccc(O)c2)c2nc3ccccc3nc12,C05063860_decoy,TRY1,Decoy,0,-9.17648,-6.35,-4.19,-7.23342380294751
COc1ccc([C@@H]2C(C(N)=S)=C(N)Oc3c2c(=O)oc2ccccc32)cc1OC,C05514401_decoy,TRY1,Decoy,0,-7.09445,-5.72,-3.22,-4.6579460001623
O=c1c(-c2ccccc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C05667885_decoy,TRY1,Decoy,0,-6.79818,-7.07,-1.79,-4.611940537874076
NC(=O)c1c(NC(=O)COC(=O)CNC(=O)c2ccco2)sc2c1CCCC2,C06974653_decoy,TRY1,Decoy,0,-9.57532,-7.1,-5.23,-7.088968978967038
COc1ccc(N2C(=S)N(Cc3cccs3)[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(N)=O)[C@H]32)cc1,C08253708_decoy,TRY1,Decoy,0,-9.44052,-5.58,-2.11,-6.402094396083105
Cc1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCc4cccnc4)[C@H]3S2)cc1,C08636433_decoy,TRY1,Decoy,0,-9.68813,-7.99,-2.27,-6.691288160421491
C[C@@]1(c2cc(F)ccc2F)NC(=O)N(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)C1=O,C09254720_decoy,TRY1,Decoy,0,-7.48118,-6.82,-1.73,-6.158076898809112
O=C(Nc1ccc(NC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)cc1)c1ccco1,C12414544_decoy,TRY1,Decoy,0,-8.04606,-6.71,-1.43,-5.89634434961573
O=C(Nc1ccc(NC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)cc1)c1ccco1,C12414545_decoy,TRY1,Decoy,0,-7.55737,-5.48,-1.21,-5.8327554244367095
C[C@@H](OC(=O)C[C@H]1Sc2ccc(C(F)(F)F)cc2NC1=O)C(=O)NC(N)=O,C12426391_decoy,TRY1,Decoy,0,-8.2022,-7.05,-1.48,-6.446186993204346
C[C@@H]1CCc2c(sc3nc(SCC(=O)Nc4c[nH]c(=O)[nH]c4=O)[nH]c(=O)c23)C1,C12494170_decoy,TRY1,Decoy,0,-7.90023,-6.68,-1.95,-5.213369279512775
C[C@H]1CCc2c(sc3nc(SCC(=O)Nc4c[nH]c(=O)[nH]c4=O)[nH]c(=O)c23)C1,C12494175_decoy,TRY1,Decoy,0,-8.31129,-7.45,-1.51,-7.184453101367778
CC(=O)Nc1ccc(NC(=O)Cc2csc(NC(=O)[C@H]3CCC(=O)N3)n2)cc1,C12879804_decoy,TRY1,Decoy,0,-9.01384,-7.71,-1.98,-6.149743289750603
Cc1oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc2c(=O)c1-c1ccccn1,C06571235_decoy,TRY1,Decoy,0,-6.58061,-7.62,-1.77,-4.897818524414311
NC(=O)c1c(NC(=O)CN2C(=O)N[C@]3(CCCc4sccc43)C2=O)sc2c1CCCC2,C14142348_decoy,TRY1,Decoy,0,-9.94213,-7.89,-3.81,-6.380550253609416
CN(C)c1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NC4CCCC4)[C@H]32)cc1,C08636368_decoy,TRY1,Decoy,0,-9.1194,-5.26,-0.34,-6.327614391379416
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1n1nc(-c2ccccc2)n(-c2ccccc2)c1=S,C16890428_decoy,TRY1,Decoy,0,-6.07637,-4.86,-1.68,-4.551569423523783
Cc1c(/N=N/c2ccccc2)c(C)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=S)c1C#N,C17252489_decoy,TRY1,Decoy,0,-6.09918,-5.49,-1.75,-4.439390541089896
Cc1c(/N=N/c2ccc(Cl)cc2)c(C)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=S)c1C#N,C17252514_decoy,TRY1,Decoy,0,-7.48495,-7.42,-2.84,-7.470158471890248
NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)c1c(Cl)cccc1Cl,C22206714_decoy,TRY1,Decoy,0,-8.0433,-6.26,-1.22,-5.774501903506824
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2O)C1=O,C23751425_decoy,TRY1,Decoy,0,-6.92509,-9.18,-2.28,-9.639843113040936
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@@H]1CS[C@H](Cc2ccc(F)cc2)C(=O)N1,C25607193_decoy,TRY1,Decoy,0,-8.28296,-9.21,-2.14,-8.474370006184
COc1cc([C@@H]2NC(=O)N[C@](O)(c3ccccc3)[C@@H]2C(=O)C(F)(F)F)ccc1O,C27753880_decoy,TRY1,Decoy,0,-7.718,-6.37,-1.99,-5.440317008802795
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1,C32823468_decoy,TRY1,Decoy,0,-8.35412,-6.74,-2.09,-6.473510313328809
O=C(NNC1=c2cc(Br)ccc2=[NH+]C1=O)C(=O)Nc1ccccc1C(=O)[O-],C01851838_decoy,TRY1,Decoy,0,-6.87143,-6.56,-1.72,-5.880420847502768
Nc1ccc(S(=O)(=O)NC2=NC(=O)/C(=C\C(=O)c3ccc(Br)cc3)N2)cc1,C01414617_decoy,TRY1,Decoy,0,-8.63795,-8.0,-2.0,-9.385473086095065
C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C[C@@H]1CCCO1)C(=O)NC(N)=O,C36796426_decoy,TRY1,Decoy,0,-8.4347,-8.18,-0.83,-8.741474582600196
COc1ccc(-c2coc3cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)ccc3c2=O)cc1,C08844373_decoy,TRY1,Decoy,0,-7.60838,-8.31,-1.77,-5.307010532120907
C[C@@H]1C(=O)O[C@@H](C[C@@H](C)O)CC[C@@H](O)[C@@H](C)C(=O)O[C@@H](C[C@@H](C)O)CC[C@@H]1O,C36375422_decoy,TRY1,Decoy,0,-7.43753,-5.96,-3.62,-5.1700253179419695
C[C@@H](O)C[C@H]1CC[C@H](O)[C@@H](C)C(=O)O[C@@H](C[C@@H](C)O)CC[C@@H](O)[C@@H](C)C(=O)O1,C36375420_decoy,TRY1,Decoy,0,-7.9539,-5.35,-2.56,-5.717478369749193
O=C(CSc1ncn[nH]1)N[C@H]1NN[C@H](SCc2ccc(Cl)cc2)S1,C39152730_decoy,TRY1,Decoy,0,-8.67656,-7.15,-2.02,-6.157275473699959
CC[NH+]1[C@@H](SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)NN[C@@H]1c1ccco1,C39722743_decoy,TRY1,Decoy,0,-8.25815,-5.81,-4.13,-5.243039060949059
NNc1ncc(Br)cc1S(=O)(=O)NC1CCS(=O)(=O)CC1,C41070134_decoy,TRY1,Decoy,0,-7.86718,-5.67,-2.94,-4.967390610849718
O=c1cc(-c2ccccc2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc12,C02566201_decoy,TRY1,Decoy,0,-7.53127,-8.6,-1.55,-7.752042525523701
CCOc1ccc(-n2c(=O)cc(Nc3ccc(S(N)(=O)=O)cc3)[nH]c2=O)cc1,C44019269_decoy,TRY1,Decoy,0,-8.29627,-4.93,-2.56,-4.971944269204694
O=C(CSc1nnc(NCc2ccco2)s1)Nc1ccc2[nH]c(=O)[nH]c2c1,C09951640_decoy,TRY1,Decoy,0,-8.6352,-7.56,-0.43,-6.441923903612186
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccc(Cl)c(Cl)c3)C(=O)[C@H]12,C16010138_decoy,TRY1,Decoy,0,-10.0548,-6.55,-0.89,-6.193028277284892
Cc1cccc2c1NC(=O)[C@@]21N[C@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C16033991_decoy,TRY1,Decoy,0,-7.26245,-7.1,-1.49,-5.498510909928152
CC(C)(C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2c(Cl)cccc21,C20549011_decoy,TRY1,Decoy,0,-8.86235,-7.13,-1.04,-6.376530841480974
CC[C@@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC(N)=O)C(=O)Nc2c(Cl)cccc21,C35375510_decoy,TRY1,Decoy,0,-7.95966,-5.67,-3.42,-5.672114850711519
CCNc1ccc(S(=O)(=O)N(C)C)cc1NCC(=O)NC(=O)NC(C)(C)C,C15366030_decoy,TRY1,Decoy,0,-8.64555,-7.17,-2.02,-7.902200663184926
COc1cc(-c2n[nH]c3c2[C@H](c2cccc(O)c2)C(C#N)=C(N)O3)cc(OC)c1OC,C02483951_decoy,TRY1,Decoy,0,-7.03672,-6.8,-2.59,-6.195603482223823
CC(=O)NCC(=O)NCC(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C,C58836980_decoy,TRY1,Decoy,0,-8.66852,-6.64,-2.88,-6.640411747132777
CC(=O)Nc1cccc(NC(=O)CCSc2nnc(NN=C3CCCC3)[nH]2)c1,C21084793_decoy,TRY1,Decoy,0,-8.26593,-7.93,-4.61,-6.279271632063748
Cc1cccc(CSc2nnc(N/N=C/c3c(C)nn(CCO)c3C)n2N)c1,C59914457_decoy,TRY1,Decoy,0,-9.77175,-8.07,-1.44,-8.063308913796883
NC(=O)[C@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CSc1nc2c(c(=O)[nH]1)CCC2,C63766505_decoy,TRY1,Decoy,0,-8.25727,-7.95,-1.95,-6.225774258459306
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3c(Cl)cccc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C13591850_decoy1,TRY1,Decoy,0,-8.07652,-7.82,,-8.864731353521869
O=c1cc(-c2ccccc2)oc2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc12,C04349273_decoy,TRY1,Decoy,0,-7.2929,-7.73,-1.7,-5.213744979034727
O=c1cc(-c2ccccc2)oc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc12,C04349275_decoy,TRY1,Decoy,0,-6.51606,-7.01,-1.53,-4.82233571096002
COC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C04751280_decoy,TRY1,Decoy,0,-5.54226,-5.43,-1.91,-4.295778005954211
CC1=NN(c2nc(N)nc(CSCc3nc(N)nc(N(C)C)n3)n2)C(C)(C)C1,C05836212_decoy,TRY1,Decoy,0,-8.93211,-6.18,-2.93,-5.759625430515544
O=c1c(-c2ccc3c(c2)OCCO3)coc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc12,C08637092_decoy,TRY1,Decoy,0,-8.22534,-6.27,-1.85,-5.809229150821048
Cc1csc(-c2coc3cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)ccc3c2=O)n1,C08844380_decoy,TRY1,Decoy,0,-8.03144,-8.39,-2.77,-5.504113918899424
CNC(=O)NC(=O)[C@H](C)OC(=O)[C@@H](NS(=O)(=O)c1ccc(F)cc1)[C@H](C)O,C09120277_decoy,TRY1,Decoy,0,-6.9273,-7.21,-1.72,-6.534299480088989
CNC(=O)NC(=O)[C@H](C)OC(=O)[C@H](NS(=O)(=O)c1ccc(F)cc1)[C@@H](C)O,C09120279_decoy,TRY1,Decoy,0,-7.29292,-7.41,-1.85,-7.491272737511261
CC(=O)Nc1ccc(NC(=O)Cc2csc(NC(=O)NCc3ccco3)n2)cc1,C09785894_decoy,TRY1,Decoy,0,-8.77577,-6.74,-3.8,-5.692043596359836
CCCn1c(N)c(C(=O)CSc2nnc3[nH]c4ccccc4n23)c(=O)[nH]c1=O,C09672556_decoy,TRY1,Decoy,0,-7.02263,-7.51,-1.71,-5.35268124177269
O=c1c(-c2ccccc2)coc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)ccc12,C11666991_decoy,TRY1,Decoy,0,-6.4987,-7.33,-1.83,-5.426581922901648
CNC(=O)NC(=O)[C@@H](C)OC(=O)[C@H](NS(=O)(=O)c1ccc(F)cc1)[C@@H](C)O,C12637940_decoy,TRY1,Decoy,0,-6.63029,-6.57,-4.34,-5.514009924711556
C=CCn1c(-c2ccccc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C12898957_decoy,TRY1,Decoy,0,-5.3035,-5.77,-1.3,-4.496180041813167
O=c1cc(-c2ccccc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C13424724_decoy,TRY1,Decoy,0,-6.5296,-8.36,-2.22,-6.720414753519142
Cc1cc(N2C(=O)C(=O)/C(=C(/O)c3c(C)[nH]c(C(N)=O)c3C)[C@@H]2c2cccnc2)no1,C13569670_decoy,TRY1,Decoy,0,-8.68497,-8.6,-0.55,-12.186554580269702
CSc1ccc(C(c2c(N)n(C)c(=O)n(C)c2=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1,C14075008_decoy,TRY1,Decoy,0,-7.08398,-5.97,-1.79,-5.109985219374514
CCCCn1c(N)c(N(C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)c(=O)[nH]c1=O,C14656956_decoy,TRY1,Decoy,0,-7.00721,-5.62,-3.6,-5.643904827618614
COc1ccc([C@@H]2CC(=O)C3=C(C2)Nc2[nH]nc(O)c2[C@@H]3c2ncc[nH]2)cc1OC,C18197117_decoy,TRY1,Decoy,0,-8.78683,-5.59,-1.97,-5.029271346080225
O=C(CSc1n[nH]c(N/N=C/c2ccc(F)cc2)n1)NNC(=O)C(F)(F)F,C20833266_decoy,TRY1,Decoy,0,-7.3086,-7.24,-4.16,-5.8705601305515
Cc1ccc(/C=N/Nc2nnc(SCC(=O)Nc3nnc(C)s3)n2N)cc1,C20918504_decoy,TRY1,Decoy,0,-7.9445,-8.66,-1.82,-6.678536807563889
C/C(=N\Nc1nnc(SCC(=O)Nc2nc(C)cs2)n1N)c1ccncc1,C21324558_decoy,TRY1,Decoy,0,-8.49911,-8.55,-2.07,-7.2065950354584976
C/C(=N\Nc1nnc(SCC(=O)Nc2nc(C)cs2)n1N)c1ccccn1,C21324957_decoy,TRY1,Decoy,0,-8.40161,-5.58,-2.25,-4.986835536303562
Cc1nc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)Nc3ncnc4nc[nH]c34)sc2n1,C23076888_decoy,TRY1,Decoy,0,-6.85261,-6.53,-0.99,-5.079597829145767
COc1ccc(N2C(=O)Cc3c2nc(N)c2c(N)nc(N4CCOCC4)c(C#N)c32)cc1OC,C25246898_decoy,TRY1,Decoy,0,-7.195,-6.15,-1.98,-5.632439966476983
CC(=O)N[C@H](CC(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccc(C)cc1,C28717497_decoy,TRY1,Decoy,0,-8.57338,-6.64,-1.06,-6.457923449384418
O=c1c(-c2ccc3c(c2)OCCCO3)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)ccc12,C04257541_decoy,TRY1,Decoy,0,-8.46491,-7.3,-0.85,-4.96081116042338
N#Cc1c(-c2nc3ccccc3o2)c(=O)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C35395280_decoy,TRY1,Decoy,0,-7.36328,-7.03,-1.94,-4.888987865761656
Cc1ccc(S(=O)(=O)O[C@@H]2[C@H](O)[C@H](CO)O[C@@H]2n2cnc3c(N)ncnc32)cc1,C35395405_decoy,TRY1,Decoy,0,-6.60061,-6.73,-2.11,-5.515254932201547
Cc1ccc(S(=O)(=O)O[C@@H]2[C@@H](O)[C@H](CO)O[C@@H]2n2cnc3c(N)ncnc32)cc1,C35395409_decoy,TRY1,Decoy,0,-7.34304,-8.44,-2.48,-7.881677156808528
COCC(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36505394_decoy,TRY1,Decoy,0,-6.24901,-6.34,-2.14,-6.230300297918448
CCOc1ccc(-n2c(Cc3cc(=O)[nH]c(=O)[nH]3)nnc2SCC(N)=O)cc1,C04030359_decoy,TRY1,Decoy,0,-7.94609,-7.57,-0.65,-7.6367090359468595
Nc1c(C(=O)CSc2nnnn2-c2ccc(O)cc2)c(=O)[nH]c(=O)n1C1CC1,C09713772_decoy,TRY1,Decoy,0,-7.77258,-7.7,-2.03,-5.848755562043689
C[C@H]1C(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)=CNN1c1ccc(=O)[nH]n1,C38791207_decoy,TRY1,Decoy,0,-8.12423,-8.44,-2.44,-7.05618009033633
COc1cc([C@H]2C3=C(CCCC3=O)Nc3[nH]c(=S)nc(N)c32)cc(OC)c1OC,C08487022_decoy,TRY1,Decoy,0,-8.26416,-6.98,-1.32,-14.271888301082289
Cc1ccc(N2C(=O)[C@@H]3[C@H](ON(CC(N)=O)[C@@H]3c3ccc(O)c(O)c3)C2=O)cc1Cl,C33893510_decoy,TRY1,Decoy,0,-8.74194,-7.01,-2.09,-6.023394481900905
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CO)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)cc1Cl,C33916511_decoy,TRY1,Decoy,0,-8.11449,-7.32,-1.57,-6.701026742997503
Cc1cc([C@H]2[NH2+][C@](CO)(C(=O)[O-])[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@@H]23)cc(C)c1O,C33931116_decoy,TRY1,Decoy,0,-8.31801,-6.75,-2.33,-6.399068054144951
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3ccccc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]12,C20758694_decoy2,TRY1,Decoy,0,-7.36097,-8.46,,-7.805215389018985
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3c(Cl)cccc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]12,C13591850_decoy2,TRY1,Decoy,0,-8.58333,-8.07,,-10.031564141527326
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3ccc(F)cc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]12,C20573661_decoy,TRY1,Decoy,0,-7.26143,-8.56,-0.86,-8.423459549444775
CC(C)CNC(=O)NC(=O)CN1CCN(CC(=O)NC(=O)NCC(C)C)CC1,C57832903_decoy,TRY1,Decoy,0,-8.75745,-6.0,-2.78,-7.095845391931158
CN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1c[nH]c3ccccc13)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C59086920_decoy,TRY1,Decoy,0,-6.84215,-6.49,-2.04,-5.409171238856456
Cc1cc(NC(=O)CSc2cn[nH]n2)cc(NC(=O)CSc2cn[nH]n2)c1,C35148252_decoy,TRY1,Decoy,0,-8.63217,-7.24,-4.65,-7.18292104882203
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@H]12,C16012584_decoy,TRY1,Decoy,0,-7.71644,-8.35,-3.6,-6.775603566873983
CC(=O)N[C@H]1[C@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@@H](CO)[C@@H](O)[C@H]1O,C62725249_decoy,TRY1,Decoy,0,-7.90395,-6.07,-3.26,-5.087093914449626
CC(=O)N[C@@H]1[C@@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@@H](CO)[C@@H](O)[C@H]1O,C62725251_decoy,TRY1,Decoy,0,-6.86536,-5.62,-2.8,-4.299916525176736
CC(=O)N[C@H]1[C@@H](Oc2cc3sc(=O)oc3c(Cl)c2Cl)O[C@@H](CO)[C@@H](O)[C@H]1O,C62725255_decoy,TRY1,Decoy,0,-7.63851,-5.98,-2.6,-4.967112937174033
CCCN1C(=O)NC([O-])=C(C(=O)CS[C@@H]2N=Nc3nc4ccccc4n32)[C@@H]1[NH3+],C63217591_decoy,TRY1,Decoy,0,-8.1631,-6.84,-2.39,-5.632003245575852
Cc1cc(C(=O)CO/N=C(\N)C2=C(N)C3(CCCC3)N(C)C2=O)c(C)n1C1CC1,C63456289_decoy,TRY1,Decoy,0,-9.28763,-7.96,-1.97,-8.840916890966218
Cn1ccnc1[C@](O)(CCNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)C(F)(F)F,C66333541_decoy,TRY1,Decoy,0,-8.57338,-7.94,-1.49,-7.596821086441062
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C/c1ccc(Cl)cc1)n2C[C@H](O)CO,C04135559_decoy,TRY1,Decoy,0,-9.28669,-5.25,-1.59,-4.923328648129233
CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)Nc1sccc1C(N)=O,C05206289_decoy,TRY1,Decoy,0,-7.99848,-6.81,-1.96,-7.555518988647503
CC(=O)N[C@@H]1[C@@H](OCc2cccc(Br)c2)O[C@@H](CO)[C@@H](O)[C@H]1O,C05378256_decoy,TRY1,Decoy,0,-6.5899,-4.9,-1.81,-4.290152065459545
CCC(Nc1ccc(S(=O)(=O)NC(C)C)cc1)=C1C(=O)NC(=S)NC1=O,C09876250_decoy,TRY1,Decoy,0,-8.12843,-6.64,-1.54,-5.744926138723894
CCN1C(=O)/C(=N/O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2NC(C)=O)c2ccccc21,C04393736_decoy,TRY1,Decoy,0,-5.83567,-6.25,-2.88,-4.868483208490691
COc1cc2ccc(=O)oc2c(OC)c1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C12419748_decoy,TRY1,Decoy,0,-6.10277,-5.98,-0.9,-4.1381126560382
COc1cccc([C@H]2[NH2+][C@](C)(C(=O)[O-])[C@H]3C(=O)N(c4ccc(NC(C)=O)cc4)C(=O)[C@H]23)c1O,C15306760_decoy,TRY1,Decoy,0,-8.15996,-5.62,-0.52,-5.952989780324105
CC(=O)N[C@@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1n1nc(-c2ccccc2)n(C2CC2)c1=S,C16890423_decoy,TRY1,Decoy,0,-5.75683,-5.81,-3.43,-4.330028988042702
Nn1c(N/N=C/c2ccccc2F)nnc1SCC(=O)NCc1ccco1,C20528159_decoy,TRY1,Decoy,0,-8.14312,-7.53,-3.57,-7.204141460233603
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NC2CC2)n1N,C20911543_decoy,TRY1,Decoy,0,-8.28903,-7.7,-2.27,-10.521962233290346
COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)Nc2nc(CC(N)=O)cs2)cc1,C21040592_decoy,TRY1,Decoy,0,-9.97687,-8.51,-0.54,-7.817136567294037
O=C(CCNC(=O)c1cccs1)NNC(=O)c1cc(Br)c[nH]1,C24123463_decoy,TRY1,Decoy,0,-8.15366,-6.92,-1.27,-5.700828254776225
O=C(O[C@@H]1[C@@H](O)[C@H](Oc2ccccc2CO)O[C@H](CO)[C@H]1O)c1ccccc1,C31167890_decoy,TRY1,Decoy,0,-7.60659,-7.55,-1.54,-7.16027371383009
CC(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1n1nc(-c2ccccc2)n(C2CC2)c1=S,C35590911_decoy,TRY1,Decoy,0,-6.26428,-4.42,-0.89,-4.273112310308814
Nc1c(C(=O)CSc2nc(-c3ccccc3)n[nH]2)c(=O)[nH]c(=O)n1C1CC1,C08230696_decoy,TRY1,Decoy,0,-7.87258,-7.68,-1.8,-6.251655473445214
Nc1cc(N)nc(SCC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)n1,C06977930_decoy,TRY1,Decoy,0,-7.63924,-7.61,-3.11,-8.199652258717453
O=C1N=CN=C2C1=N[C@H](NCCc1ccccc1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39937913_decoy,TRY1,Decoy,0,-6.63698,-7.1,-2.3,-5.779184962126762
CS[C@@H]1O[C@H]([C@H](NC(=O)c2cccc(C)n2)[C@@H](C)Cl)[C@H](O)[C@H](O)[C@@H]1O,C40447427_decoy,TRY1,Decoy,0,-7.84598,-6.92,-2.41,-7.808955687991818
CS[C@@H]1O[C@H]([C@@H](NC(=O)c2cccc(C)n2)[C@@H](C)Cl)[C@H](O)[C@H](O)[C@@H]1O,C40447429_decoy,TRY1,Decoy,0,-6.94354,-6.52,-4.12,-6.519309401000166
NC(=O)CCCNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2,C42044408_decoy,TRY1,Decoy,0,-9.63402,-6.55,-1.22,-6.355314052740307
O=C(CCC(=O)Nc1nccs1)NNC(=O)c1cc(Br)c[nH]1,C45077444_decoy,TRY1,Decoy,0,-7.64447,-5.02,-1.75,-6.351670336011574
Cc1ccc([C@@H](CNC(=O)Nc2ccccc2CC(N)=O)N2CCOCC2)o1,C45724669_decoy,TRY1,Decoy,0,-8.79934,-6.94,-2.56,-8.308810148623833
Cc1c([C@@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)cnn1-c1ccc(F)cc1,C46983849_decoy,TRY1,Decoy,0,-7.68282,-7.86,-1.77,-7.279557674186114
Cc1ccc(C)c(NC(=O)C(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c1,C48591434_decoy,TRY1,Decoy,0,-8.14492,-6.85,-1.29,-6.511459193279032
COc1ccc(Br)cc1CNC(=O)NNC(=O)C(=O)NC1CC1,C50134775_decoy,TRY1,Decoy,0,-8.66956,-6.45,-2.37,-6.239841643474645
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]12,C15958569_decoy,TRY1,Decoy,0,-8.94532,-8.08,-1.01,-7.449229266403719
C[C@H](c1ccccc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2ccccc21,C35365993_decoy,TRY1,Decoy,0,-7.3128,-6.45,-2.76,-5.732660986460043
COCCCN1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C20548445_decoy,TRY1,Decoy,0,-7.25336,-4.13,-1.23,-4.617944289903411
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2ccc(F)cc21,C20567177_decoy,TRY1,Decoy,0,-7.24496,-5.3,-2.92,-5.756613444730764
C#CCNC(=O)CNC(=O)C(=O)Nc1cccc(NC(=O)c2cccs2)c1,C51808067_decoy,TRY1,Decoy,0,-7.90618,-6.65,-2.53,-6.1752770245429645
CSCC[C@H](NC(N)=O)C(=O)NC[C@H](c1ccc(C)cc1)N1CCOCC1,C55808053_decoy,TRY1,Decoy,0,-8.79329,-6.05,-3.81,-7.634931791218777
Cc1occc1-c1nnc(S[C@H](C)C(=O)NC(=O)NC[C@H]2CCCO2)n1N,C55984650_decoy,TRY1,Decoy,0,-9.14364,-7.45,-2.77,-6.675891055897527
O=C(NNC(=S)NC1CC1)c1cccc(S(=O)(=O)NCc2ccco2)c1,C58189474_decoy,TRY1,Decoy,0,-7.94988,-6.61,-0.78,-5.781050677189887
O=C(CCNC(=O)c1cccs1)NNC(=O)c1n[nH]c(=O)c2ccccc12,C19596708_decoy,TRY1,Decoy,0,-7.7132,-7.39,-0.99,-6.178053578846076
Nc1c(C(=O)CSc2nc(-c3cccnc3)n[nH]2)c(=O)[nH]c(=O)n1C1CC1,C60531495_decoy,TRY1,Decoy,0,-8.06612,-7.4,-2.55,-5.79891032928621
O=C(NC[C@H](O)c1ccccc1F)C(=O)Nc1cccc(N2CCNC2=O)c1,C62132268_decoy,TRY1,Decoy,0,-7.9337,-6.68,-2.66,-5.620067703346481
NC(=O)c1ccsc1NC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1,C63227034_decoy,TRY1,Decoy,0,-8.72997,-7.66,-0.05,-5.677837360461353
C[C@@H](NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C63985160_decoy,TRY1,Decoy,0,-7.01816,-5.54,-1.82,-6.600382405734815
O=C(CCCN1C(=O)NC2(CCCC2)C1=O)NNC(=S)NCC(F)(F)F,C64081345_decoy,TRY1,Decoy,0,-7.57326,-6.42,-1.59,-6.214048264051096
O=C([O-])CNC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O,C64197866_decoy,TRY1,Decoy,0,-7.16848,-7.8,-1.34,-7.140663585523623
NC(=O)[C@@H]1CN(C(=O)NCCNc2ncc(C(F)(F)F)cc2Cl)CCO1,C51686894_decoy,TRY1,Decoy,0,-7.53853,-5.67,-1.02,-6.167217500342297
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)NC[C@@H]1CCCO1,C65622755_decoy,TRY1,Decoy,0,-6.87944,-7.03,-3.29,-5.828326672733225
NC(=O)CN1CCC[C@H](NC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C1,C66451815_decoy,TRY1,Decoy,0,-8.92739,-6.43,-1.96,-5.7779103000584335
Cn1c(CCNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)n[nH]c1=S,C67051595_decoy,TRY1,Decoy,0,-7.93293,-5.74,-3.34,-7.506663147634646
Cc1sc(C(=O)NCCc2n[nH]c(=S)n2C(C)C)cc1S(N)(=O)=O,C67074875_decoy,TRY1,Decoy,0,-10.231,-6.78,-3.63,-6.263505834457042
Cc1ccc(OCC(=O)NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1C,C67245703_decoy,TRY1,Decoy,0,-7.98479,-6.96,-1.31,-5.574773695870838
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NCCNC(=O)c2ccco2)c1,C67388975_decoy,TRY1,Decoy,0,-7.7192,-6.61,-5.25,-5.601500577247778
C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)Cn1nnc(-c2ccc(C(N)=O)cc2)n1,C18655045_decoy,TRY1,Decoy,0,-7.52345,-9.15,-0.63,-11.070259333720273
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)Cn1nnc(-c2ccc(C(N)=O)cc2)n1,C18655051_decoy,TRY1,Decoy,0,-7.67015,-9.28,-2.16,-6.88095402820416
COC(=O)Nc1cc(NC(=O)C(=O)NCCNC(=O)c2ccco2)ccc1F,C67495522_decoy,TRY1,Decoy,0,-7.70966,-6.01,-3.7,-5.268349452784269
CC(C)[C@H](OC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)C(=O)NC(N)=O,C04292840_decoy,TRY1,Decoy,0,-7.72953,-6.26,-1.3,-6.778574004488233
Cc1cc(C)c(NC(=O)CNC(=O)CSc2nnc(-c3ccco3)n2N)c(C)c1,C04537530_decoy,TRY1,Decoy,0,-7.63925,-7.67,-2.07,-6.9004507730469165
Cn1c(=O)[nH]c(=O)c2c1nc(N)n2C[C@@H](O)COc1ccc(Cl)cc1Cl,C00824775_decoy,TRY1,Decoy,0,-7.46414,-7.57,-2.13,-7.866064987107519
O=S(=O)(CCCCS(=O)(=O)Nc1cccc(O)c1)Nc1cccc(O)c1,C05260227_decoy,TRY1,Decoy,0,-9.31536,-6.87,-2.8,-7.438236262845427
CC(=O)Nc1nnc(S[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)s1,C02882167_decoy,TRY1,Decoy,0,-10.5968,-5.81,-1.0,-6.374555962321042
[NH3+][C@@H](CCCCNC(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O)C(=O)[O-],C06476153_decoy,TRY1,Decoy,0,-7.58058,-6.17,-1.42,-5.362176451112547
Cc1ccc(S(=O)(=O)c2ccc(NNC=C3C(=O)NC(=O)NC3=O)cc2)cc1,C06561605_decoy,TRY1,Decoy,0,-7.58901,-8.54,-1.68,-6.873929396240481
NC(=O)c1ccsc1NC(=O)COC(=O)c1ccccc1NC(=O)c1ccco1,C03491299_decoy,TRY1,Decoy,0,-7.3416,-7.31,-1.05,-6.270466190946794
COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)ccc1OCC(N)=O,C06906894_decoy,TRY1,Decoy,0,-6.54815,-5.42,-0.78,-4.521785379821465
C[C@]1(c2ccccc2)NC(=O)N(NC(=O)CSc2nc(-c3ccccc3)cn2N)C1=O,C08757786_decoy,TRY1,Decoy,0,-6.70025,-8.1,-1.8,-6.9110480340206495
CC(=O)N[C@H](CC(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccccc1,C09613294_decoy,TRY1,Decoy,0,-8.40441,-7.44,-2.36,-7.725548971524805
Nc1nc(SCC(=O)Nc2nccs2)sc1C(=O)Nc1nccs1,C12360684_decoy,TRY1,Decoy,0,-9.14386,-6.05,-2.26,-5.918772275752096
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1=O,C12691730_decoy,TRY1,Decoy,0,-8.75333,-7.01,-1.25,-10.731817724365309
NC(=O)CSc1ccccc1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O,C12914396_decoy,TRY1,Decoy,0,-7.7232,-7.84,-2.25,-7.559931097806206
O=C(NC(=S)Nc1ccccc1C(=O)NCCCO)c1ccc([N+](=O)[O-])cc1,C08928356_decoy,TRY1,Decoy,0,-8.44296,-6.69,-2.17,-8.780493672512376
NS(=O)(=O)c1ccc(NNS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1,C13835295_decoy,TRY1,Decoy,0,-10.8122,-6.14,-0.99,-7.5069663139120175
Cc1nn(-c2nc(C)c(C)c(=O)[nH]2)c(C)c1CCC(=O)Nc1ccccc1C(N)=O,C16981279_decoy,TRY1,Decoy,0,-7.06742,-7.36,-3.39,-4.95895073766197
O=C(N/N=C\C=C/c1ccccc1)[C@@H](O)[C@@H](O)C(=O)N/N=C\C=C\c1ccccc1,C17315572_decoy,TRY1,Decoy,0,-7.50191,-6.26,-3.7,-6.470451031210057
Nn1c(N/N=C/c2ccc(Cl)cc2)nnc1SCC(=O)NCc1ccco1,C20528312_decoy,TRY1,Decoy,0,-9.11656,-8.31,-1.66,-8.782544198881789
COc1cc([C@@H]2C(C(=O)Nc3ccccn3)=C(C)NC3=C2C(=O)CCC3)ccc1OCC(N)=O,C08567649_decoy,TRY1,Decoy,0,-8.25497,-5.41,-2.44,-4.958530929855906
Nn1c(N/N=C/C=C/c2ccccc2)nnc1SCC(=O)Nc1nccs1,C21317618_decoy,TRY1,Decoy,0,-8.24451,-7.22,-1.42,-6.137452160814042
COC(=O)[C@@H]1O[C@@H](Oc2ccc3c(c2)OC[C@@H](c2ccc(O)cc2)C3)[C@@H](O)[C@@H](O)[C@@H]1O,C22058402_decoy,TRY1,Decoy,0,-7.39572,-8.5,-2.88,-6.724194912254491
[H]/N=C1/CSC(=S)N1Nc1nc(C)nc(N[C@H](O)C(Cl)(Cl)Cl)n1,C26949998_decoy,TRY1,Decoy,0,-10.372,-4.36,-1.26,-5.569491776961191
C=CCNC(=O)NC(=O)CSc1nnc(Nc2cccc(NC(C)=O)c2)s1,C28969352_decoy,TRY1,Decoy,0,-8.03837,-7.23,-1.84,-6.633822593513446
CC(=O)Nc1cc(-c2csc(C)n2)ccc1OCC(=O)Nc1sccc1C(N)=O,C32830392_decoy,TRY1,Decoy,0,-8.9604,-7.14,-1.04,-7.252318153064174
COc1cc([C@H]2[NH2+][C@](C(=O)[O-])([C@@H](C)O)[C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)C(=O)[C@@H]23)ccc1O,C34388725_decoy,TRY1,Decoy,0,-7.93228,-7.21,-3.77,-6.594031156212868
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1n1nc(-c2ccccc2)n(-c2ccccc2)c1=S,C35590872_decoy,TRY1,Decoy,0,-5.52599,-5.66,-1.71,-4.300923934049763
C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C[C@@H]1CCCO1)C(=O)NC(N)=O,C36796425_decoy,TRY1,Decoy,0,-7.90514,-8.44,-1.71,-8.165534245925798
C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C[C@H]1CCCO1)C(=O)NC(N)=O,C36796427_decoy,TRY1,Decoy,0,-8.3174,-8.35,-2.11,-9.092750616678092
CCc1cccc(C)c1NC(=O)CSC1=NN[C@H]([C@H]2N=NC3=C2CCC3)N1N,C38985016_decoy,TRY1,Decoy,0,-7.65728,-7.66,-1.06,-6.03082970534664
Cc1cc(C)c(NC(=O)CSC2=NN[C@H]([C@@H]3N=NC4=C3CCC4)N2N)c(C)c1,C39006740_decoy,TRY1,Decoy,0,-8.00083,-8.05,-1.79,-6.804570538122077
COC(=O)C1=C(C)Nc2sc(C(=O)Nc3cc(C)on3)c(N)c2[C@H]1c1ccncc1,C39327006_decoy,TRY1,Decoy,0,-7.82814,-5.04,-2.17,-5.166703596344467
CCc1ccc(C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)nc1,C40663193_decoy,TRY1,Decoy,0,-7.21333,-7.06,-2.52,-7.658558944440564
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NCCCNS(C)(=O)=O,C41854470_decoy,TRY1,Decoy,0,-7.57852,-6.68,-2.91,-6.106726736027834
Cc1cc(NC(=O)CSCC(=O)NNC(=S)N[C@H]2CCCC[C@@H]2C)no1,C42085074_decoy,TRY1,Decoy,0,-9.14922,-6.18,-2.33,-5.906490123871374
COc1ccc([C@@H]2CC(=O)c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1,C49601392_decoy,TRY1,Decoy,0,-8.88893,-6.46,-0.61,-5.5577892796501125
CC[C@@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2ccc(F)cc21,C35375531_decoy,TRY1,Decoy,0,-7.15376,-7.71,-2.28,-8.262993578676884
NC(=O)[C@@H]1CN(C(=O)CCNC(=O)Nc2ccc(Br)cc2)CCO1,C50845378_decoy,TRY1,Decoy,0,-7.97416,-5.3,-2.16,-5.291268181864698
NC(=O)[C@@H]1CN(C(=O)NCCNC(=O)c2ccc(Br)cc2)CCO1,C51711318_decoy,TRY1,Decoy,0,-8.49817,-7.32,-1.52,-6.234001207932322
NC(=O)[C@H]1CN(C(=O)NCCNC(=O)c2ccc(Br)cc2)CCO1,C51711319_decoy,TRY1,Decoy,0,-8.24933,-6.08,-1.78,-5.867916865429042
COc1cccc([C@H]2[NH2+][C@@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@@H]3C(=O)N(C)C(=O)[C@@H]23)c1O,C59086929_decoy,TRY1,Decoy,0,-7.79897,-8.71,-1.87,-6.713347691662306
CC1=CC(SCC(=O)NN)=C2N(Cc3ccc(Cl)cc3Cl)N=CN2N1,C59597087_decoy,TRY1,Decoy,0,-8.54305,-7.18,-1.39,-8.448663094058649
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)C(=O)Nc1ccc(-c2cc(=O)[nH]c(C)n2)cc1,C62631644_decoy,TRY1,Decoy,0,-7.30969,-6.49,-2.62,-5.435746670346505
NC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)COC(=O)c1[nH]nc2ccccc12,C40014262_decoy,TRY1,Decoy,0,-9.61113,-7.2,-1.71,-6.217252711224355
C[C@@H](C(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-])N1NNc2ccccc2C1=O,C64165176_decoy,TRY1,Decoy,0,-7.50393,-8.49,-3.15,-6.456480057766727
NC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSc1nc(C2CCCC2)n[nH]1,C64181838_decoy,TRY1,Decoy,0,-8.67195,-6.15,-1.47,-6.363308688463939
COc1ccc(Cl)cc1N1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C35851539_decoy,TRY1,Decoy,0,-7.61042,-6.19,-1.28,-5.593962264998894
CCCCNC(=O)NNC(=O)c1cccc(N2NC(=O)[C@H]3CC=CC[C@@H]3C2=O)c1,C67235958_decoy,TRY1,Decoy,0,-7.8985,-7.13,-2.9,-5.860239958409959
CCCCNC(=O)NNC(=O)c1cccc(N2NC(=O)[C@@H]3CC=CC[C@H]3C2=O)c1,C67235959_decoy,TRY1,Decoy,0,-8.3617,-8.33,-1.14,-6.220730379990188
Cc1ccc(NC(=O)C(=O)Nc2cnn(CC(N)=O)c2)c(OCC(F)(F)F)c1,C67375541_decoy,TRY1,Decoy,0,-7.34565,-6.9,-1.85,-5.99686586231362
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C04104826_decoy,TRY1,Decoy,0,-7.54009,-6.49,-1.94,-5.3406520687644905
NC(=O)c1nnn([C@H]2CCN(C(=O)c3ccc(F)c(Cl)c3)[C@@H]2C(N)=O)c1C(N)=O,C04151724_decoy,TRY1,Decoy,0,-9.82587,-7.54,-0.95,-7.056780302063287
Nc1nc(SCc2ccccn2)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04705718_decoy,TRY1,Decoy,0,-6.7696,-4.89,-1.53,-4.3827979821087455
O=c1[nH]c(=O)c2nc(OCc3ccccc3)n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C04775789_decoy,TRY1,Decoy,0,-5.39002,-5.89,-1.91,-4.879778048197728
O=c1[nH]c(=O)c2nc(OCc3ccccc3)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C04775790_decoy,TRY1,Decoy,0,-6.88777,-7.56,-1.35,-8.711269544056808
O=c1nc(NCCc2c[nH]c3ccccc23)ccn1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05496491_decoy,TRY1,Decoy,0,-7.31775,-8.44,-2.02,-7.708472766431824
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C05759933_decoy,TRY1,Decoy,0,-8.59459,-5.73,-1.13,-5.578105916716226
Nc1ncnc2c1nc(N/N=C/c1cccc(O)c1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08964830_decoy,TRY1,Decoy,0,-7.91083,-7.99,-1.47,-7.6217289113482
C/C(=N\Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)c1ccccn1,C09975199_decoy,TRY1,Decoy,0,-6.82604,-7.7,-3.21,-6.894188842518815
Nc1ncnc2c1nc(N/N=C/c1cccc(O)c1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004153_decoy,TRY1,Decoy,0,-7.58232,-8.27,-1.42,-11.497392964428832
Nc1nc2c(nc(NOCc3ccccc3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C12376522_decoy,TRY1,Decoy,0,-7.29661,-8.78,-2.06,-9.136205429422766
Nc1nc(N/N=C/c2ccccn2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C12405497_decoy,TRY1,Decoy,0,-6.74444,-6.04,-2.44,-4.64668040713048
Nc1ncnc2c1nc(N/N=C/c1cccc(O)c1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08964831_decoy,TRY1,Decoy,0,-8.13805,-7.97,-1.67,-9.302833775304745
Nc1ncnc2c1nc(N/N=C/c1cccc(O)c1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08964833_decoy,TRY1,Decoy,0,-8.46012,-8.1,-1.67,-9.090286666736326
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C13407262_decoy,TRY1,Decoy,0,-7.17805,-6.24,-3.54,-5.322517296894189
C[C@@H](/C=C/[C@@]1(O)[C@@H](C)CC(=O)CC1(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13660208_decoy,TRY1,Decoy,0,-6.84916,-6.99,-1.65,-7.96770738036784
Nc1nc2c(nc(NOCc3ccccc3)n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C15220819_decoy,TRY1,Decoy,0,-7.47535,-9.35,-2.41,-9.46010670056588
O=c1[nH]c(=O)c2nc(OCc3ccccc3)n([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C17380522_decoy,TRY1,Decoy,0,-5.9321,-7.83,-3.02,-6.237438984123274
O=c1[nH]c(=O)c2nc(OCc3ccccc3)n([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C17380524_decoy,TRY1,Decoy,0,-6.13179,-7.79,-2.38,-7.721290002859658
C/C(=N\Nc1nnc(SCC(N)=O)n1N)c1ccc(Br)cc1,C21322923_decoy,TRY1,Decoy,0,-9.31103,-7.19,-1.2,-8.120218596153451
C=C1[C@@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OC)[C@H]2C[C@H]1O,C31156417_decoy,TRY1,Decoy,0,-8.13251,-4.73,-1.62,-5.064706141517839
C=C1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OC)[C@H]2C[C@H]1O,C31156421_decoy,TRY1,Decoy,0,-7.46786,-6.37,-2.2,-5.629025659713907
C=C1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OC)[C@@H]2C[C@H]1O,C31156431_decoy,TRY1,Decoy,0,-7.18798,-5.01,-1.89,-4.910984513651652
CC1=CC(=O)CC(C)(C)[C@H]1/C=C/[C@@H](CO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31161212_decoy,TRY1,Decoy,0,-6.96101,-5.79,-2.16,-5.26094706339584
NC(=O)c1c(NC(=O)CSc2nnc(N)n2C2CC2)sc2c1CCCC2,C31453562_decoy,TRY1,Decoy,0,-10.6686,-6.44,-1.38,-6.741009473004912
CC(=O)/C=C/[C@]1(O)[C@@H](C)C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC1(C)C,C35271341_decoy,TRY1,Decoy,0,-8.04011,-7.24,-3.97,-6.02849152583826
CC1=CC(=O)C[C@](C)(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1/C=C/[C@@H](C)O,C35456133_decoy,TRY1,Decoy,0,-7.48466,-6.82,-1.21,-5.14128950190926
COc1cc(/C=N/N=C(/N)c2nc3ccccc3[n+]([O-])c2N)cc([N+](=O)[O-])c1O,C16195093_decoy,TRY1,Decoy,0,-6.14126,-5.72,-1.04,-4.5337446563084205
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CO,C36503737_decoy,TRY1,Decoy,0,-7.42702,-5.01,-2.48,-5.600185841597882
CC(=O)OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]12,C14858003_decoy,TRY1,Decoy,0,-7.16489,-6.72,-1.59,-6.360507008942008
C=C1[C@@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OC)[C@@H]2C[C@@H]1O,C35455098_decoy,TRY1,Decoy,0,-7.9525,-5.59,-2.86,-5.488183527105946
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@H](O)C[C@@H]12,C04268364_decoy,TRY1,Decoy,0,-7.88635,-5.85,-3.47,-5.383277585091207
O=C(/C=C/c1ccccc1)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C03978972_decoy,TRY1,Decoy,0,-6.74215,-7.17,-3.3,-5.200361547260059
CC1=CC(=O)CC(C)(C)[C@]1(O)/C=C/[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C38318983_decoy,TRY1,Decoy,0,-7.04434,-6.36,-0.87,-5.279115092057354
CCCN1C(=O)NC([O-])=C(C(=O)CSc2nc(-c3ccccc3)n[nH]2)[C@H]1[NH3+],C38478915_decoy,TRY1,Decoy,0,-7.73074,-5.71,-2.26,-5.531126295462486
CCSc1nnc(N)n1[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCCC2,C40172444_decoy,TRY1,Decoy,0,-7.78711,-6.41,-2.72,-5.7889302963604745
CCN(CCO)c1ncnc(NNC(=O)c2ccc(Br)cc2)c1N,C40736236_decoy,TRY1,Decoy,0,-8.58182,-4.55,-0.49,-6.093967500619105
CCc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C,C43763776_decoy,TRY1,Decoy,0,-7.70551,-5.7,-1.02,-5.230802421010154
Nc1nc(N/N=C/c2cccnc2)nc2c1ncn2[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C49019916_decoy,TRY1,Decoy,0,-7.09731,-7.17,-0.78,-5.326134726679211
CC(=O)CCC1=C(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)CC1(C)C,C49601627_decoy,TRY1,Decoy,0,-7.29885,-7.35,-3.77,-5.683455546867675
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C1/C(=O)Nc3ccccc31)n2C[C@H](O)CO,C08926345_decoy,TRY1,Decoy,0,-9.2603,-6.67,-2.5,-6.874063910721262
NC(=O)c1ccsc1NC(=O)CCSc1nnc(-c2cccs2)n1N,C54427607_decoy,TRY1,Decoy,0,-7.18661,-7.27,-2.82,-9.5172091287661
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)O[C@@H](O)C[C@H]12,C56874303_decoy,TRY1,Decoy,0,-7.20494,-5.9,-0.71,-5.055454026476324
O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C\NC(CO)(CO)CO,C06198216_decoy1,TRY1,Decoy,0,-8.53238,-6.97,,-5.789320402618003
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC=C1C(=O)NC(=S)NC1=O,C60865340_decoy,TRY1,Decoy,0,-8.50549,-7.38,-1.3,-9.70939368860686
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(NC2CC2)S1,C39939633_decoy,TRY1,Decoy,0,-9.0771,-6.85,-1.76,-5.9753723886718975
CCN[C@H]1N[C@@H](C(N)=O)[C@H](NC(=O)[C@H]2C=C(c3ccc(CC)cc3)N=N2)S1,C64580161_decoy,TRY1,Decoy,0,-9.00144,-7.56,-1.07,-6.86338515871276
CCN[C@H]1N[C@@H](C(N)=O)[C@H](NC(=O)[C@@H]2C=C(c3ccc(CC)cc3)N=N2)S1,C64580162_decoy,TRY1,Decoy,0,-8.88066,-7.55,-1.48,-7.0811058213643125
O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C/NC(CO)(CO)CO,C06198216_decoy2,TRY1,Decoy,0,-8.08283,-5.03,,-4.755247461587123
C=CCNC(=O)Nc1ccc(NC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1,C67246593_decoy,TRY1,Decoy,0,-7.64282,-7.31,-2.12,-5.924376659356767
CNC(=O)[C@@H]1O[C@@H](n2cnc3c(NCc4cccc(I)c4)ncnc32)[C@@H](O)[C@H]1O,C03872875_decoy,TRY1,Decoy,0,-7.76205,-5.39,-1.79,-5.569608745500977
COc1ccc(-c2cc(-c3ccccc3)c(C#N)c(=O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05808714_decoy,TRY1,Decoy,0,-6.99943,-6.03,-1.86,-5.134699917628518
O=c1c(-c2ccc3c(c2)OCCO3)coc2cc(O[C@H]3C[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)ccc12,C06142525_decoy,TRY1,Decoy,0,-9.99436,-9.12,-1.89,-6.1486531042405765
C[C@@H]1O[C@@H](O[C@H]2CC[C@@]3(C=O)[C@@H](CC[C@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)[C@H](O)[C@H](O)[C@H]1O,C08214729_decoy,TRY1,Decoy,0,-7.50776,-7.04,-2.21,-5.038856543747224
O=C(NCc1cccnc1)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3cccc(C(F)(F)F)c3)[C@@H]21,C08636427_decoy,TRY1,Decoy,0,-8.8587,-6.6,-1.5,-6.208454461917916
COc1ccc(-c2c3c(n([C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)c(=S)c2C#N)CCC3)cc1,C16958609_decoy,TRY1,Decoy,0,-7.14927,-4.82,-1.75,-4.520601526660026
CC(=O)c1c(-c2ccc(Cl)cc2)c(C#N)c(=S)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1C,C05956219_decoy,TRY1,Decoy,0,-7.26832,-4.96,-2.41,-5.040417815213526
COc1ccc([C@H]2C3=C(C[C@@H](c4ccc(OC)c(OC)c4)CC3=O)Nc3nc(N)nn32)cc1O,C18198998_decoy,TRY1,Decoy,0,-9.47938,-6.11,-4.35,-5.945248516212756
Cc1cc(C)cc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NCCN4CCOCC4)[C@H]32)c1,C20504114_decoy,TRY1,Decoy,0,-10.1351,-6.04,-2.49,-6.517459125183068
COc1cc(OC)cc(N2C(=O)Cc3c2nc(N)c2c(N)nc(N4CCCC4)c(C#N)c32)c1,C25437022_decoy,TRY1,Decoy,0,-7.75059,-7.44,-2.53,-5.04066764770829
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C15998949_decoy,TRY1,Decoy,0,-7.92874,-6.53,-1.67,-6.007468802232361
O=C(NC(CO)(CO)CO)c1cc2cc(Br)cc(Br)c2oc1=O,C27529331_decoy,TRY1,Decoy,0,-8.89014,-5.05,-2.51,-5.173051357615558
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(-c2ccc(F)c(Cl)c2)n(C)c1=S,C32594293_decoy,TRY1,Decoy,0,-8.54621,-4.26,-1.24,-5.157935564919966
Cc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CO)(C(=O)[O-])[NH2+][C@H]2c1cc(Br)ccc1O,C33630640_decoy,TRY1,Decoy,0,-8.55464,-7.68,-3.74,-6.376591832115167
C[C@@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/CCO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493926_decoy,TRY1,Decoy,0,-8.76574,-7.51,-1.79,-6.318547821150045
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/CCO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493930_decoy,TRY1,Decoy,0,-8.40347,-7.63,-2.05,-5.6418661666022505
CC[C@@H](C)N1C(=O)[C@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C1=O,C35375330_decoy,TRY1,Decoy,0,-9.2982,-9.84,-2.55,-9.959872794295604
CC[C@H](C)N1C(=O)[C@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccc(Br)cc43)[C@@H]2C1=O,C35375384_decoy,TRY1,Decoy,0,-8.18276,-6.6,-0.88,-6.52022862936106
Cc1occc1C(=O)N/N=C/[C@@]12CC[C@@H](O)C[C@]1(O)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C36185435_decoy,TRY1,Decoy,0,-9.43703,-6.14,-1.04,-5.641611184842242
CC(C)(O)CCC(=O)[C@](C)(O)[C@@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C,C31159432_decoy,TRY1,Decoy,0,-9.02528,-6.9,-3.67,-5.619886107558817
Cc1[nH+]cc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=N[C@H]2O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]1O,C39937150_decoy,TRY1,Decoy,0,-7.12215,-7.92,-1.82,-6.398772252891013
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@@]34/C=N/CCO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43736928_decoy,TRY1,Decoy,0,-8.87126,-8.01,-2.74,-7.250096922480595
CC[C@H](CO)/N=C/[C@@]12CC[C@H](O)C[C@]1(O)CC[C@H]1[C@H]2CC[C@@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O,C43737423_decoy,TRY1,Decoy,0,-9.5425,-7.56,-1.6,-6.366356608714936
CC(=O)N[C@H]1[C@H](Oc2ccc3c(c2)CC[C@H]2[C@@H]3CC[C@@]3(C)C(=O)CC[C@H]23)O[C@H](CO)[C@@H](O)[C@@H]1O,C43743789_decoy,TRY1,Decoy,0,-7.02769,-8.09,-0.55,-5.001513444804934
OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3nnc(-c4ccncc4)s3)c2)[C@H](O)[C@@H](O)[C@@H]1O,C45368291_decoy,TRY1,Decoy,0,-7.11574,-7.92,-1.85,-7.115276275153529
O=C1[C@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@H]2C(=O)N1C[C@@H]1CCCO1,C16026536_decoy,TRY1,Decoy,0,-7.9744,-8.07,-0.46,-7.125271149523575
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C15998950_decoy,TRY1,Decoy,0,-6.41938,-6.92,-1.24,-4.966144317329368
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C1/C(=O)Nc3ccccc31)n2C[C@@H](O)c1ccccc1,C09292648_decoy,TRY1,Decoy,0,-8.32949,-6.59,-1.31,-6.430639088304437
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]12,C16011544_decoy,TRY1,Decoy,0,-8.07014,-5.38,-0.9,-5.629271075399605
NC(=O)C[C@H]1N[C@@]2(C(=O)Nc3ccc(F)cc32)[C@@H]2C(=O)N(Cc3ccccc3Cl)C(=O)[C@@H]21,C16012641_decoy,TRY1,Decoy,0,-7.58799,-6.12,-2.72,-5.276800909028381
Cc1cccc2c1NC(=O)[C@@]21N[C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C16013372_decoy,TRY1,Decoy,0,-8.56721,-4.75,-1.71,-5.061127224303744
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@H](CCC(N)=O)[C@H]3C(=O)N(C4CCCC4)C(=O)[C@H]31)C(=O)N2,C16020145_decoy,TRY1,Decoy,0,-9.27486,-8.14,-0.64,-7.193446180938335
NC(=O)CC[C@@H]1N[C@]2(C(=O)Nc3ccc(F)cc32)[C@@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]12,C16020621_decoy,TRY1,Decoy,0,-7.46352,-6.88,-1.04,-5.669107933269628
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1Cc1ccc(F)cc1,C16034081_decoy,TRY1,Decoy,0,-9.65129,-6.79,-1.33,-6.253027010008195
CC(C)(C)N1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@]3(C(=O)Nc4ccc(Br)cc43)[C@@H]2C1=O,C16022200_decoy,TRY1,Decoy,0,-9.52597,-5.23,-1.6,-5.669940364410838
COCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C16025034_decoy,TRY1,Decoy,0,-10.0565,-9.3,-1.17,-9.88531120758377
C=CCN1C(=O)[C@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccc(Br)cc43)[C@H]2C1=O,C16033244_decoy,TRY1,Decoy,0,-8.45606,-6.8,-0.98,-6.594201262042816
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3ccc(Br)cc32)[C@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]12,C15971878_decoy,TRY1,Decoy,0,-8.74141,-7.23,-1.63,-9.284910383631749
NC(=O)C[C@@H]1N[C@@]2(C(=O)Nc3ccc(Br)cc32)[C@H]2C(=O)N(C[C@H]3CCCO3)C(=O)[C@@H]12,C13591777_decoy,TRY1,Decoy,0,-7.69227,-4.88,-0.65,-4.518240697994783
Cc1cc(Cl)cc2c1NC(=O)[C@@]21N[C@@H](Cc2ccc(O)c(O)c2)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@@H]21,C15972295_decoy,TRY1,Decoy,0,-9.86096,-8.64,-1.55,-8.747037810588628
CC(=O)N[C@@]1(C(F)(F)F)C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1c[nH]c2ccc(F)cc12,C09088098_decoy,TRY1,Decoy,0,-7.16316,-7.34,-1.46,-6.411130297864784
C/C(=N\N=C1\NC(=O)[C@@H](CC(=O)Nc2ccccc2[N+](=O)[O-])S1)c1ccc(O)cc1O,C16136746_decoy,TRY1,Decoy,0,-8.1153,-9.27,-1.93,-11.569970851347197
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C1/C(=O)Nc3ccc(Br)cc31)n2CCO,C05318016_decoy,TRY1,Decoy,0,-8.9358,-7.23,-1.89,-7.645291775031175
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN(c2ccccc2)C(=S)S1,C39781270_decoy,TRY1,Decoy,0,-9.52213,-5.79,-2.67,-5.435268429672628
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1Nc2sc3c(c2C(=O)N1C)CCC3,C39782098_decoy,TRY1,Decoy,0,-10.0804,-8.48,-1.62,-6.811643194827706
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1Nc2sc3c(c2C(=O)N1C)CCCC3,C38639432_decoy,TRY1,Decoy,0,-9.07824,-8.82,-1.56,-5.832380223930696
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C2C(Cl)=CC(Cl)=CN21,C38639834_decoy,TRY1,Decoy,0,-8.37144,-7.23,-2.79,-5.552723317662811
CC[C@H](C)N1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@@]3(C(=O)Nc4ccc(Br)cc43)[C@@H]2C1=O,C35375479_decoy,TRY1,Decoy,0,-6.65724,-5.51,-2.87,-7.211912773491054
COCc1cc(C)nc2c1[C@H](N)[C@H](C(=O)/N=c1/[nH]c3ccc(NC(C)=O)cc3s1)S2,C39272630_decoy,TRY1,Decoy,0,-9.29295,-4.7,-2.94,-4.754855261506179
CC(=O)N[C@H]1[C@@H](O[C@]2(Br)C=Nc3cccc(Cl)c32)O[C@H](CO)[C@H](O)[C@@H]1O,C65356729_decoy,TRY1,Decoy,0,-6.7109,-5.79,-3.19,-5.0562217879152245
CN(CC(N)=O)C(=O)[C@@H]1C[C@H](NC(=O)Nc2ccc(F)cc2F)CN1C(=O)c1ccco1,C03839052_decoy,TRY1,Decoy,0,-7.23487,-4.81,-2.1,-5.214312208828635
Cc1ccccc1OC[C@H](O)Cn1c(SCC(N)=O)nc2c1c(=O)[nH]c(=O)n2C,C01791386_decoy,TRY1,Decoy,0,-8.31156,-7.15,-2.5,-9.624499769270557
CSCC(=O)N1C[C@@H](NC(=O)Nc2cccc(SC)c2)C[C@H]1C(=O)N(C)CC(N)=O,C04200840_decoy,TRY1,Decoy,0,-10.0016,-6.5,-2.68,-7.599941020750626
Cc1cn([C@H](CO)O[C@H](CO)CN(O)C2C3CC4CC(C3)CC2C4)c(=O)[nH]c1=O,C01635326_decoy,TRY1,Decoy,0,-7.45042,-6.73,-2.87,-6.720432676986308
CCOC(=O)[C@]1(C#N)[C@@H]2C=CC(C(N)=O)=CN2[C@@H](C(N)=O)[C@@H]1c1ccccc1Cl,C04772804_decoy,TRY1,Decoy,0,-7.89642,-5.13,-3.28,-5.569263317882027
CN(CCc1cn([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cn1)C(=O)/C=C/c1ccccc1,C05052826_decoy,TRY1,Decoy,0,-6.19327,-7.61,-3.73,-5.809692295560041
C[C@H]1CCc2c(sc(NC(=O)COC(=O)CNC(=O)c3ccco3)c2C(N)=O)C1,C06083899_decoy,TRY1,Decoy,0,-8.37325,-7.56,-2.01,-6.685268580354999
NC(=O)c1c(NC(=O)CSc2nnnn2-c2ccc(O)cc2)sc2c1CCC2,C09315718_decoy,TRY1,Decoy,0,-10.5184,-8.28,-1.11,-7.16501674995415
O=C1CSC(NC(=O)NC[C@@H]2CCC[C@@H](CNC(=O)NC3=NC(=O)CS3)C2)=N1,C03359274_decoy,TRY1,Decoy,0,-9.4647,-6.08,-2.35,-5.800865318687408
COc1cc(OC)c2c(=O)c(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)coc2c1,C11865366_decoy,TRY1,Decoy,0,-7.4433,-7.77,-1.75,-5.281026161958769
CC(=O)Nc1ccc(NC(=O)Cc2csc(NC(=O)c3ccc(=O)[nH]c3)n2)cc1,C12440100_decoy,TRY1,Decoy,0,-9.0225,-8.03,-2.21,-6.724027720246786
NC(=O)NCCC(=O)NCCN1C(=O)S/C(=C\c2ccc(Cl)cc2Cl)C1=O,C12693748_decoy,TRY1,Decoy,0,-8.82459,-7.32,-2.43,-6.592720006070895
CC(=O)Nc1ccc(NC(=O)Cc2csc(NC(=O)c3ccc[nH]c3=O)n2)cc1,C12880276_decoy,TRY1,Decoy,0,-9.00579,-8.07,-2.51,-6.979494305182412
Cc1ccc(OC[C@H](O)Cn2c(NC[C@@H](C)O)nc3c2c(=O)[nH]c(=O)n3C)cc1C,C04371097_decoy,TRY1,Decoy,0,-8.39343,-6.74,-1.6,-7.708030070242695
Cc1ccc(OC[C@@H](O)Cn2c(NC[C@@H](C)O)nc3c2c(=O)[nH]c(=O)n3C)cc1C,C04371100_decoy,TRY1,Decoy,0,-8.25473,-7.72,-1.96,-7.469936434366846
CSCC(=O)N1C[C@@H](NC(=O)Nc2ccc(F)cc2F)C[C@H]1C(=O)N(C)CC(N)=O,C15708777_decoy,TRY1,Decoy,0,-9.93633,-4.68,-1.57,-6.756212405840761
Cc1cccc(Cn2nnc(-c3nnc(SCC(N)=O)n3C[C@H]3CCCO3)c2N)c1,C19897436_decoy,TRY1,Decoy,0,-9.54894,-7.44,-1.06,-8.113566279639793
CN(C)c1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccco3)n2N)cc1,C20527634_decoy,TRY1,Decoy,0,-8.58028,-7.4,-0.51,-6.896760400894292
C[C@@H](OC(=O)COc1ccc2c(c1)CCC(=O)N2)C(=O)Nc1sccc1C(N)=O,C22520617_decoy,TRY1,Decoy,0,-8.0785,-7.16,-1.21,-7.040413242976648
COCCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n[nH]c1=O,C24715479_decoy,TRY1,Decoy,0,-9.89732,-6.6,-4.75,-7.10693664204275
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1,C24865894_decoy,TRY1,Decoy,0,-8.49726,-6.76,-3.61,-6.162260226758373
COCCNc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)s1,C36803356_decoy,TRY1,Decoy,0,-11.9882,-5.6,-2.28,-6.822026375516722
CCOc1cc([C@@H]2NC(=O)NC(c3ccccc3)=C2C(C)=O)ccc1OCC(N)=O,C00814177_decoy,TRY1,Decoy,0,-7.28216,-6.03,-1.31,-5.29771068277943
CCCCN1C(=O)[C@@H](C(=O)Nc2nnc(S(N)(=O)=O)s2)[C@@H](O)c2ccccc21,C38979958_decoy,TRY1,Decoy,0,-9.77695,-5.56,-2.66,-6.437733718743713
CCOC(=O)[C@@H]1[C@H](C)[C@H](C(N)=O)S[C@@H]1NC(=O)CSc1nc(C(C)C)n[nH]1,C39419753_decoy,TRY1,Decoy,0,-9.01875,-5.47,-1.62,-6.042979792474388
CCCN(C(=O)CSc1nc(C2CC2)n[nH]1)[C@H]1C(=O)N=C([O-])N(Cc2ccccc2)[C@@H]1[NH3+],C39470446_decoy,TRY1,Decoy,0,-7.05069,-6.39,-3.3,-6.317366329195846
CC(C)[C@H](OC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O)C(=O)NC(N)=O,C05365061_decoy,TRY1,Decoy,0,-8.63068,-8.02,-3.82,-7.786112964513901
COc1ccccc1CCNC(=O)/C=C1/CS[C@H](NC(=O)c2ccc[nH]c2=O)N1,C39590224_decoy,TRY1,Decoy,0,-7.37779,-7.81,-2.26,-6.602373312899308
COc1ccc(NC(=O)/C=C2\CS[C@@H](NC(=O)c3ccc[nH]c3=O)N2)c(OC)c1,C39590259_decoy,TRY1,Decoy,0,-9.41973,-7.24,-0.91,-6.824880218407595
CCCCCN1C(=O)[C@@H](C(=O)Nc2nnc(S(N)(=O)=O)s2)[C@H](O)c2ccccc21,C39928814_decoy,TRY1,Decoy,0,-9.28202,-6.3,-3.95,-5.9035136431268045
CCCCCN1C(=O)[C@H](C(=O)Nc2nnc(S(N)(=O)=O)s2)[C@@H](O)c2ccccc21,C39928815_decoy,TRY1,Decoy,0,-9.84156,-5.74,-3.67,-6.299197952699025
COc1ccc(-c2n[nH]c(SCC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)n2)cc1,C12599200_decoy,TRY1,Decoy,0,-8.10616,-8.74,-2.47,-7.023034724346625
Cc1cc(NC(=O)CSCC(=O)Nc2cccc([C@@]3(C)NC(=O)NC3=O)c2)no1,C40110832_decoy,TRY1,Decoy,0,-7.04241,-6.03,-2.89,-4.906304098715091
CCCN1C(=O)N(C)C([O-])=C(C(=O)CSc2nc(-c3cccs3)n[nH]2)[C@@H]1[NH3+],C44658216_decoy,TRY1,Decoy,0,-9.97807,-7.26,-2.45,-8.335769457546435
O=C(NNC(=O)c1ccc(S(=O)(=O)NC2CC2)o1)c1cc(Br)c[nH]1,C46670042_decoy,TRY1,Decoy,0,-9.30278,-6.98,-3.45,-7.344927375268631
C[C@]1(c2cccc(C(F)(F)F)c2)NC(=O)N(CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C1=O,C46877309_decoy,TRY1,Decoy,0,-5.18878,-8.55,-3.22,-6.181755097374834
COc1ccc(CN2C(=O)[C@@H]3[C@H](CCC(N)=O)N[C@@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C20546612_decoy,TRY1,Decoy,0,-8.1956,-4.83,-0.72,-5.5339638877098265
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2c(Cl)cccc21,C16024702_decoy,TRY1,Decoy,0,-7.97789,-8.09,-1.79,-8.032223105914062
COCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C20566462_decoy,TRY1,Decoy,0,-6.76461,-5.24,-1.2,-4.703390501632889
COCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C16024704_decoy,TRY1,Decoy,0,-8.82348,-7.63,-1.45,-8.023800518656019
CCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2c(Cl)cccc21,C16024775_decoy,TRY1,Decoy,0,-8.6945,-7.75,-1.05,-7.820732763666403
CCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C16024777_decoy,TRY1,Decoy,0,-8.76535,-7.06,-1.04,-7.305130675448431
CCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(N)=O)C(=O)Nc2ccc(Cl)cc21,C20566827_decoy,TRY1,Decoy,0,-7.55701,-7.23,-1.66,-8.63427489570187
CCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C20566829_decoy,TRY1,Decoy,0,-8.28222,-5.09,-1.09,-5.456533917311965
CCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C16024958_decoy,TRY1,Decoy,0,-9.3184,-6.46,-0.76,-8.756337737005326
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCCNc1ccccc1[N+](=O)[O-],C58916145_decoy,TRY1,Decoy,0,-7.04219,-8.08,-3.09,-5.958004657326861
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=NN1Cc1ccccc1,C39937817_decoy,TRY1,Decoy,0,-7.70321,-7.76,-1.03,-5.945905978336498
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=NN1Cc1cccs1,C39940071_decoy,TRY1,Decoy,0,-8.75924,-6.79,-3.09,-7.349264265242357
COc1cc([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccncc4)[C@@H]32)ccc1OCC(N)=O,C04019826_decoy1,TRY1,Decoy,0,-6.66046,-5.06,,-4.866406282070328
COCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)N[C@@]3(C(=O)Nc4ccc(C)cc43)[C@H]2C1=O,C20565827_decoy,TRY1,Decoy,0,-8.38068,-6.45,-4.0,-6.811530634810198
O=C(COc1ccccc1)c1ccc(O)c(C[NH2+][C@@H](Cc2ccccc2)C(=O)[O-])c1O,C04026906_decoy,TRY1,Decoy,0,-8.04679,-7.86,-4.31,-6.052426402052864
Cc1ccccc1N1C(=O)c2cccc3c(NC(CO)(CO)CO)ccc(c23)C1=O,C03045186_decoy,TRY1,Decoy,0,-6.70373,-6.36,-2.64,-5.300148507043531
CC1(C)Cc2c(sc(NC(=O)N(CCO)Cc3ccccc3)c2C(N)=O)CO1,C06754851_decoy,TRY1,Decoy,0,-7.19572,-6.42,-0.65,-5.447706764273815
NC(=O)N[C@@H](CC(=O)OCC(=O)Nc1cc(F)ccc1F)c1ccc(Cl)cc1,C07508518_decoy,TRY1,Decoy,0,-8.50603,-8.24,-2.23,-7.281365890890319
COc1cccc(OC)c1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2,C08168525_decoy,TRY1,Decoy,0,-8.1342,-5.98,-2.6,-6.744411805526623
Cc1nc(SCC(=O)NCC(=O)Nc2ccc(F)cc2)c(C(N)=O)c(C)c1C,C08749017_decoy,TRY1,Decoy,0,-8.16588,-7.76,-2.45,-7.861094838957763
CCCCN(C(=O)CNc1ccc(Br)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C09587489_decoy,TRY1,Decoy,0,-8.76787,-6.72,-1.43,-6.443945806474382
Cc1oc(C23CC4CC(CC(C4)C2)C3)cc1C(=O)NCCNC(=O)c1nonc1N,C12372388_decoy,TRY1,Decoy,0,-9.09652,-8.36,-2.16,-8.986479291068303
CCOc1cc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)[C@@H]2C(=O)c2cccs2)ccc1O,C00909092_decoy,TRY1,Decoy,0,-8.98267,-4.96,-3.17,-5.298214575770013
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC(=S)Nc1ccc(S(N)(=O)=O)cc1,C12497613_decoy,TRY1,Decoy,0,-10.2806,-7.09,-1.68,-8.447228130355722
Cc1ccc(NC(=O)CCC(=O)NNC(=S)NC(=O)COc2ccccc2C)c(C)c1,C12503202_decoy,TRY1,Decoy,0,-8.05524,-9.17,-3.11,-7.224304921108104
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)c1ccccc1SCC(N)=O,C16333390_decoy,TRY1,Decoy,0,-8.02957,-6.62,-4.3,-7.558197130754573
COc1ccccc1NC(=O)C1=C(C)NC(SCC(N)=O)=C(C#N)[C@H]1c1ccccc1,C04019917_decoy,TRY1,Decoy,0,-6.88397,-6.79,-1.31,-5.691726305521973
O=C(N[C@H](C(=O)N/N=C/c1ccc(O)cc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1,C13785048_decoy,TRY1,Decoy,0,-7.89561,-6.18,-2.23,-5.696179070262748
CC1=C(C(N)=O)[C@@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2cccc(Cl)c2C)N1,C19882976_decoy,TRY1,Decoy,0,-9.30146,-5.53,-3.33,-5.8093960051802265
CCc1ccc(NC(=O)CSC2=C(C#N)[C@@H](c3ccco3)C(C(N)=O)=C(C)N2)cc1,C20025869_decoy,TRY1,Decoy,0,-8.74698,-6.52,-2.61,-5.874808865630836
CC1=C(C(N)=O)[C@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2ccc(C)c(Cl)c2)N1,C08623940_decoy,TRY1,Decoy,0,-9.148,-7.06,-1.63,-5.844695725195156
C/C(=N\Nc1nnc(SCC(=O)Nc2ccc(C)cc2)n1N)c1cccs1,C21325067_decoy,TRY1,Decoy,0,-9.05331,-8.11,-2.15,-6.981806332875848
C/C(=N\Nc1nnc(SCC(=O)Nc2cccc(C)c2)n1N)c1cccs1,C21325072_decoy,TRY1,Decoy,0,-7.41298,-7.77,-1.62,-6.445520152052449
N#Cc1c(NC(=O)CSc2nnc(NN=C3CCCC3)n2N)sc2c1CCCC2,C21327824_decoy,TRY1,Decoy,0,-8.62811,-7.45,-0.93,-6.17077524553369
CC(=O)N(c1nc(/C=C/C(=O)Nc2ccc(NC(N)=O)cc2)cs1)c1ccccc1F,C26354093_decoy,TRY1,Decoy,0,-8.40355,-7.05,-2.96,-5.887564552721993
Cc1cccc(NC(=O)CN(C)C(=O)C[C@@H](NC(N)=O)c2ccccc2F)c1C,C30111083_decoy,TRY1,Decoy,0,-6.77758,-7.96,-4.26,-5.789801461568427
C[C@]1(CSc2ccccc2C(=O)NCCc2c[nH]c3ccccc23)NC(=O)NC1=O,C32958329_decoy,TRY1,Decoy,0,-8.33906,-7.35,-1.41,-6.1765877804506335
CCOC(=O)[C@@H]1[C@@H](c2cc([N+](=O)[O-])ccc2O)NC(=S)N[C@]1(O)C(F)(F)F,C34909263_decoy,TRY1,Decoy,0,-6.76352,-5.5,-2.32,-4.970381219014875
CCCN(C(=O)c1cccc(O)c1O)[C@H](C(=O)NC(C)(C)C)c1ccc(O)cc1,C36571212_decoy,TRY1,Decoy,0,-8.63191,-5.49,-3.92,-6.1575004734722905
C[C@H](Sc1nnc(SCC(N)=O)s1)C(=O)NC(=O)NC1CCCCC1,C36849592_decoy,TRY1,Decoy,0,-9.1814,-7.0,-1.33,-8.46271944094653
C[C@@H](Sc1nnc(SCC(N)=O)s1)C(=O)NC(=O)NC1CCCCC1,C36849593_decoy,TRY1,Decoy,0,-9.65436,-6.18,-1.64,-7.957027428123876
CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)NCc2ccccc2)c(Cl)cc1O,C01135524_decoy,TRY1,Decoy,0,-7.06788,-6.39,-1.01,-5.992050383530057
NN1[C@@H](SCC(=O)c2ccccc2Cl)NN[C@@H]1[C@H]1C=C(c2ccccc2)N=N1,C38556193_decoy,TRY1,Decoy,0,-9.40239,-6.39,-1.49,-5.742983579655086
NN1[C@@H](SCc2ccc([N+](=O)[O-])cc2)NN[C@@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39012705_decoy,TRY1,Decoy,0,-7.59853,-8.68,-1.6,-7.182412709778474
CC[C@H](S[C@@H]1N=C(C)C(Cc2ccc(O)cc2)=N1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C39354011_decoy,TRY1,Decoy,0,-10.6096,-8.42,-3.6,-8.570587967136055
CC(C)[C@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F,C25075016_decoy,TRY1,Decoy,0,-7.62902,-6.68,-2.33,-6.141694826975358
CC(C)[C@@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F,C25075011_decoy,TRY1,Decoy,0,-7.67929,-6.2,-1.52,-6.614185657185399
N#Cc1c(CCCNC(=O)CCCNC(=O)c2ccsc2)nn(-c2ccccc2)c1N,C40087162_decoy,TRY1,Decoy,0,-8.99373,-6.4,-3.12,-5.974640623607745
CCOc1ccccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccc(F)cc3)[nH]c(=O)c21,C40399645_decoy,TRY1,Decoy,0,-7.96318,-8.55,-0.91,-7.652782668681938
CCOc1ccccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccc(C)cc3)[nH]c(=O)c21,C40400401_decoy,TRY1,Decoy,0,-8.30772,-7.05,-1.56,-5.935114045190144
CN(Cc1ccccc1)c1ncnc(NNC(=O)c2ccccc2Br)c1N,C40662495_decoy,TRY1,Decoy,0,-8.2365,-5.39,-2.67,-6.166050380319959
Nc1c(NCCCN2CCOCC2)ncnc1Nc1ccc(Br)cc1,C40756608_decoy,TRY1,Decoy,0,-7.94935,-5.12,-1.07,-4.777316626798862
NC(=O)c1ccc(COC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c([N+](=O)[O-])c1,C16804739_decoy,TRY1,Decoy,0,-8.25123,-7.73,-3.29,-10.14627471449664
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)Nc2ccc(C)c(C)c2)c1,C46772147_decoy,TRY1,Decoy,0,-9.11177,-7.45,-3.0,-7.915618182456804
Cc1ccccc1NC(=S)NNC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1,C46772565_decoy,TRY1,Decoy,0,-7.26368,-7.18,-1.42,-5.991222987861214
CC(C)[C@H](NCC(=O)Nc1sccc1C(N)=O)c1ccc2c(c1)OCCCO2,C57383286_decoy,TRY1,Decoy,0,-8.44037,-7.32,-2.97,-7.463170624014709
COc1cc([C@H]2NC(=S)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccccc2)cc(OC)c1O,C57531376_decoy,TRY1,Decoy,0,-8.46107,-5.23,-2.11,-5.170443673804591
Cc1cccc(Cn2c(C)c(C[NH2+]CCc3ccc(S(N)(=O)=O)cc3)c(C(=O)[O-])c2C)c1,C08932702_decoy,TRY1,Decoy,0,-8.5333,-7.38,-2.6,-6.175311920041489
CCCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1cc(F)cc(F)c1,C54535292_decoy,TRY1,Decoy,0,-7.63131,-6.83,-3.61,-7.256887233892718
C[C@@H](NC(=O)Nc1ccc(OC(F)F)c(F)c1)c1ccc(S(N)(=O)=O)cc1,C47713923_decoy,TRY1,Decoy,0,-8.34483,-6.93,-3.61,-5.7673554694268185
O=C(CCCCC[C@@H]1CCNC(=O)N1)NNC(=O)c1ccc(Br)s1,C59435071_decoy,TRY1,Decoy,0,-9.01496,-6.78,-2.79,-6.6435216484583615
CC/C(C)=N/Nc1nnc(SCC(=O)Nc2ccc(I)cc2)n1N,C59914747_decoy,TRY1,Decoy,0,-8.39076,-5.02,-1.78,-5.183877417531724
NC(=O)[C@@H]1C2=C(CCC2)S[C@H]1NC(=O)COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3,C39945005_decoy,TRY1,Decoy,0,-10.5616,-8.6,-2.21,-7.310081775617639
CCCc1cc(=O)[nH]c(SCC(=O)N[C@@H]2S[C@H]3CCCC[C@H]3[C@H]2C(N)=O)n1,C63767082_decoy,TRY1,Decoy,0,-8.87388,-6.78,-2.51,-6.066736745292933
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C04081954_decoy,TRY1,Decoy,0,-6.53099,-5.15,-3.1,-4.873132028808901
COc1ccc(-c2ccc(C[NH2+]CCNC(=O)c3nonc3N)o2)cc1Cl,C04488484_decoy,TRY1,Decoy,0,-8.06395,-7.91,-2.86,-6.617899494007794
CC(C)(C)NC(=O)COc1ccc(C[NH2+]CCNC(=O)c2nonc2N)cc1,C06882418_decoy,TRY1,Decoy,0,-7.46336,-6.25,-4.02,-5.276324499166164
CCOc1ccc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C08324510_decoy,TRY1,Decoy,0,-8.26908,-6.43,-1.44,-6.8725330288519775
C=CCOc1c(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1OC,C08470124_decoy,TRY1,Decoy,0,-7.30586,-5.94,-2.53,-5.720677551138542
COc1ccc(Cl)cc1NC(=O)C[NH+](C)CC(=O)Nc1sc2c(c1C(N)=O)CCC2,C09244618_decoy,TRY1,Decoy,0,-10.0649,-7.31,-4.38,-7.238801392853726
Nc1nc(NCCC[NH+]2CCOCC2)nc(NC[C@@H]2CCCO2)c1[N+](=O)[O-],C09313417_decoy,TRY1,Decoy,0,-7.30033,-6.64,-1.23,-6.496062710310435
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(Cl)cc3)C[NH+]12)NCc1cccnc1,C15707956_decoy,TRY1,Decoy,0,-8.25811,-6.49,-1.72,-5.902326864977884
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(O)c3)n2)CC(C)(C)[NH2+]1,C20906784_decoy,TRY1,Decoy,0,-8.89748,-8.52,-1.53,-8.665061996428035
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1N,C20912096_decoy,TRY1,Decoy,0,-8.9696,-6.72,-1.01,-6.433235415508812
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(c2ccccc2O)CC1,C22010345_decoy,TRY1,Decoy,0,-7.82836,-6.53,-1.08,-5.238653836209316
CCOC(=O)[NH+]=c1ccc2c(CSc3nc(N)cc(=O)[nH]3)cc(O)oc-2c1,C23674126_decoy,TRY1,Decoy,0,-5.90567,-8.14,-1.83,-6.717850877319703
COCCCNC(=O)C[NH+]1CCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C24338032_decoy,TRY1,Decoy,0,-10.2153,-6.29,-1.48,-6.3473588754772265
C[C@H](c1nnc(SCc2nc(N)nc(N)n2)n1-c1ccc(F)cc1)[NH+](C)C,C26490926_decoy,TRY1,Decoy,0,-6.93031,-7.3,-0.62,-7.087596919341443
C[C@@H]1CCCC[C@@H]1[NH+](CC(=O)NC(=O)NC1CC1)CC(=O)NC(=O)NC1CC1,C31469589_decoy,TRY1,Decoy,0,-8.64726,-8.02,-0.9,-7.705023146436209
CCOC(=O)C1=C(CS/C(N)=[NH+]/CCOC)NC(=O)N[C@H]1c1ccco1,C30025946_decoy,TRY1,Decoy,0,-8.21917,-5.06,-3.72,-5.858972676703823
COC(=O)c1c(NC(=O)C[NH+]2CCC[C@@H](CNC(N)=O)C2)sc(C)c1C,C32935672_decoy,TRY1,Decoy,0,-7.56038,-6.83,-1.81,-7.428769551231696
CCOC(=O)[C@H]1NN[NH+](Cc2ccc(C)cc2)[C@@H]1NC(=O)CSc1nc[nH]n1,C39290207_decoy,TRY1,Decoy,0,-7.53759,-5.81,-2.13,-5.16688479223662
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)[C@H](C)ON1,C39676517_decoy,TRY1,Decoy,0,-10.4866,-7.32,-3.89,-6.904802031218018
O=c1cc(CS[C@H]2N[NH2+]NN2c2ccc3c(c2)OCO3)c2ccccc2[nH]1,C39697696_decoy,TRY1,Decoy,0,-6.9738,-5.33,-1.62,-4.42024020587058
N#CC1=C(N)O[C@H]2N=[NH+][C@@H](c3ccc4ccccc4c3)[C@H]2[C@@H]1c1cn(CC(N)=O)nc1-c1ccccc1,C39964302_decoy,TRY1,Decoy,0,-7.68022,-5.73,-1.49,-5.264079150765216
Cc1ccc2c(Nc3ncnc(Nc4ccc5c(c4)OCO5)c3N)cccc2[nH+]1,C40685182_decoy,TRY1,Decoy,0,-8.55743,-7.92,-1.31,-6.724901555399864
Cc1ccccc1COc1ccccc1C[NH2+]CCNC(=O)c1nonc1N,C40744480_decoy,TRY1,Decoy,0,-7.14459,-7.55,-1.21,-6.897767410686973
Cc1ccccc1COc1ccc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C40744517_decoy,TRY1,Decoy,0,-7.99915,-7.71,-0.83,-8.415889966878613
Cc1ccc2nc(Nc3ncnc(NCCCn4cc[nH+]c4)c3N)sc2c1,C40783629_decoy,TRY1,Decoy,0,-7.87776,-6.65,-1.38,-5.553076739617005
Nc1c(NCCCn2cc[nH+]c2)ncnc1NNC(=O)c1ccc(Cl)cc1,C40784488_decoy,TRY1,Decoy,0,-6.69326,-5.99,-1.05,-5.1980429175048615
CC(C)[NH+](CCNC(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C,C42893859_decoy,TRY1,Decoy,0,-6.89285,-4.86,-2.21,-4.9286559629008
CC1(C)CC(NC(=O)N[C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C42895955_decoy,TRY1,Decoy,0,-6.79035,-5.39,-1.64,-5.086511322485106
C[C@H](C(=O)NC1CC1)[NH+]1CCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C45681922_decoy,TRY1,Decoy,0,-10.5479,-7.62,-1.42,-7.472824568967829
CCCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCCC)Cc1ccco1,C47549070_decoy,TRY1,Decoy,0,-7.44577,-5.37,-1.78,-6.173560747427056
CC1CCC([NH+](CC(=O)NC(=O)NC2CC2)CC(=O)NC(=O)NC2CC2)CC1,C47551350_decoy,TRY1,Decoy,0,-9.06665,-7.49,-2.12,-7.443640493645142
Cc1c(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cccc1C(N)=O,C48768040_decoy,TRY1,Decoy,0,-8.6791,-8.41,-1.54,-9.539824573825296
COc1cccc(C(=O)NNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1O,C54539725_decoy,TRY1,Decoy,0,-7.80169,-6.64,-3.45,-5.6073618364165645
CC(C)NC(=O)NC(=O)[C@@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55028576_decoy,TRY1,Decoy,0,-7.89099,-5.51,-2.51,-5.026038043426888
COCCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55029016_decoy,TRY1,Decoy,0,-8.22557,-4.45,-2.63,-5.504346473394369
C=CCNC(=O)NC(=O)[C@H](C)[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C43571990_decoy,TRY1,Decoy,0,-7.59655,-7.18,-2.61,-6.6335785340788895
CC(C)[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)NC(N)=O,C39763442_decoy,TRY1,Decoy,0,-7.84959,-7.59,-2.06,-7.8809865651308835
Nc1nc(CN2C(=O)N[C@@H](CC3=c4ccccc4=[NH+]C3)C2=O)nc(Nc2ccccc2)n1,C63187755_decoy,TRY1,Decoy,0,-7.41218,-9.34,-1.9,-6.543300105326348
N[C@H]1N/C(=N\c2ccccc2)NC(CSc2nnc(-c3ccncc3)o2)=[NH+]1,C38971421_decoy,TRY1,Decoy,0,-7.65213,-5.35,-1.23,-5.486443443088497
COc1ccc2[nH]/c(=N/C(=O)CC3(CN4CN[NH2+]N4)CCCCC3)sc2c1,C63818155_decoy,TRY1,Decoy,0,-8.89701,-7.43,-1.35,-6.0519872899787694
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cccc2c3c([nH]c12)CCCC3,C64886206_decoy,TRY1,Decoy,0,-8.65005,-7.42,-1.63,-6.815585446724576
CCCNC(=O)NC(C)(C)C(=O)NNC(=O)c1ccc(C[NH+](CC)CC)o1,C65124624_decoy,TRY1,Decoy,0,-8.20843,-5.72,-1.61,-6.419529255363671
CCCNC(=O)C[NH+]1CCC(NC(=O)NNC(=O)c2sccc2C)CC1,C67059593_decoy,TRY1,Decoy,0,-8.27411,-6.2,-2.89,-5.650571098735938
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc(-n3ncc(C#N)c3N)cc2)CC1,C67550286_decoy,TRY1,Decoy,0,-8.83119,-7.36,-1.74,-5.795545596216549
CC(C)NC(=O)O[C@@H]1CC[C@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)NCc2ccco2)[C@]1(C)CO,C04236613_decoy,TRY1,Decoy,0,-8.37343,-5.7,-3.23,-5.6502910105121495
Cc1cc(C)nc(NC(=O)NCCCCCCNC(=O)Nc2cc(C)cc(C)n2)c1,C05002497_decoy,TRY1,Decoy,0,-9.18584,-7.28,-1.99,-7.696139079143452
OC[C@@H](O)[C@H](O)[C@@H](O)c1nn(-c2ccc(Cl)cc2)c2nc3cc(Cl)c(Cl)cc3nc12,C05892615_decoy,TRY1,Decoy,0,-10.6236,-5.73,0.07,-8.115815340512105
Nn1c(Cc2ccccc2F)nnc1SCc1cc(=O)oc2cc(O)c(O)cc12,C03310473_decoy,TRY1,Decoy,0,-9.11583,-5.92,-2.63,-6.21317192307483
C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1N,C08645304_decoy,TRY1,Decoy,0,-9.84741,-7.31,-1.94,-6.545364178944152
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1N,C08645307_decoy,TRY1,Decoy,0,-9.66345,-7.9,-1.1,-7.395284101568534
Nn1c(SCCCSc2nnc(C3CCCCC3)n2N)nnc1C1CCCCC1,C08921071_decoy,TRY1,Decoy,0,-10.8599,-8.06,-2.21,-10.523555462149186
CC(C)(C)c1ccc(-c2nnc(SCC(=O)C(C#N)=C3Nc4ccccc4N3)n2N)cc1,C03311297_decoy,TRY1,Decoy,0,-9.27151,-9.12,-3.25,-6.852510962108333
Nc1ccc(C(c2ccc(N)c([N+](=O)[O-])c2)(C(F)(F)F)C(F)(F)F)cc1[N+](=O)[O-],C08926456_decoy,TRY1,Decoy,0,-3.24291,-6.19,-2.12,-3.7045942674082935
Cc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)s2)c1,C16769822_decoy,TRY1,Decoy,0,-9.0276,-8.47,0.05,-7.957585478302207
CNC(=S)/N=C(\NCCc1c[nH]c2ccc(OC)cc12)Nc1nc(C)cc(C)n1,C18155230_decoy,TRY1,Decoy,0,-8.66455,-6.24,-2.78,-6.171556883215453
COc1cc(/N=C(\N)Nc2nc(=O)cc(CSc3ccc(C)cc3)[nH]2)cc(OC)c1,C18249802_decoy,TRY1,Decoy,0,-8.87904,-7.67,-3.83,-6.026127508238272
Nc1c(N2CCN(CCO)CC2)cc(NCc2ccco2)c2c1C(=O)c1ccccc1C2=O,C20573641_decoy,TRY1,Decoy,0,-7.57998,-6.42,-0.25,-5.358896045584101
Cc1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cc(F)ccc3F)n2N)cc1,C20917315_decoy,TRY1,Decoy,0,-9.06179,-8.5,-4.14,-7.651027402954201
O=C(CCSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)Nc1c(Cl)cccc1Cl,C21078172_decoy,TRY1,Decoy,0,-9.17289,-8.35,-3.88,-7.652593064717832
Nn1c(N/N=C/c2cccc(Cl)c2)nnc1SCC(=O)Nc1cccc2ccccc12,C21321564_decoy,TRY1,Decoy,0,-10.2667,-5.67,-2.47,-6.062298415118679
C[C@H](Sc1nnc(NCCc2cccs2)s1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C22020073_decoy,TRY1,Decoy,0,-9.04879,-7.67,-1.42,-7.8117711902836335
C[C@@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)cc1,C22621453_decoy,TRY1,Decoy,0,-7.43969,-8.96,-3.51,-8.516850234685895
C=CCN(CC=C)c1nc(N)c2c(N)nc3c(c2c1C#N)CC(=O)N3CCC1=CCCCC1,C23882470_decoy,TRY1,Decoy,0,-7.96188,-6.46,-4.55,-5.623531350238167
COc1ccccc1Nc1nc(N)nc(CSCC(=O)c2c(C)[nH]c3ccccc23)n1,C24346870_decoy,TRY1,Decoy,0,-8.70319,-6.18,-2.9,-6.248093457736921
Nc1c(Cl)c(Cl)nc(C(=O)OCC(=O)NC(=O)NC2CCCC2)c1Cl,C35380557_decoy,TRY1,Decoy,0,-9.99525,-6.27,-2.27,-5.828498007581801
Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)c3ccccc3O)[nH]c(=O)c2c1C,C21901400_decoy,TRY1,Decoy,0,-8.67029,-6.06,-1.46,-6.5744571487420576
CCCCNC(=O)[C@H](c1ccccc1O)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500765_decoy,TRY1,Decoy,0,-6.86178,-6.19,-2.83,-5.891474581629722
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)Cc1ccccc1,C36506683_decoy,TRY1,Decoy,0,-7.56059,-6.72,-0.48,-6.835930729447685
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)Cc1ccccc1,C36506684_decoy,TRY1,Decoy,0,-7.83838,-5.41,-1.78,-6.273442830042069
CC(=O)OC[C@@H]1O[C@H](O[C@@H]2/C=C(\C)CC[C@@H](O)/C(C)=C\C[C@H]2C(C)C)[C@H](O)[C@H](O)[C@@H]1O,C37538763_decoy,TRY1,Decoy,0,-7.53757,-6.98,-3.87,-6.028079698428795
NN1C(SCC(=O)Nc2ccc(Br)cc2F)=NN[C@@H]1[C@H]1N=NC2=C1CCC2,C39012520_decoy,TRY1,Decoy,0,-9.22855,-6.47,-2.05,-5.9543053757606925
C[NH+]1[C@H](SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)NN[C@H]1c1ccc(C(C)(C)C)cc1,C39722604_decoy,TRY1,Decoy,0,-8.63971,-6.79,-2.76,-5.448796643727079
CCOc1cc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)ccc1O,C38705032_decoy,TRY1,Decoy,0,-7.17029,-6.88,-2.11,-6.258320254026184
Cc1ccc(S(=O)(=O)NNc2ncnc(Oc3cc(C)c(Cl)c(C)c3)c2N)cc1,C40794687_decoy,TRY1,Decoy,0,-8.42794,-8.07,-2.0,-7.560418230377964
COc1cc2c(cc1OCCCCO)Nc1cc(Nc3cc(F)nc(F)c3)ccc1C(=O)N2,C42967084_decoy,TRY1,Decoy,0,-8.29505,-6.47,-3.42,-6.081979231215808
COc1cc2ncc3c(N)nc(-c4cncc(Nc5cccc(CO)c5)c4)cc3c2cc1OC,C45259237_decoy,TRY1,Decoy,0,-9.42958,-6.01,-2.54,-5.572561525402104
C=CCNC(=O)Nc1ccc(NC(=O)CNC(=O)c2ccc(Br)o2)cc1,C45873260_decoy,TRY1,Decoy,0,-8.86509,-5.38,-1.24,-5.655911578551554
C=CCNC(=O)Nc1ccc(NC(=O)/C=C/c2ccc(S(=O)(=O)NC)cc2)cc1,C45889017_decoy,TRY1,Decoy,0,-8.25332,-5.61,-3.19,-7.076895312758552
C[C@@H](NC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc2c(c1)NC(=O)CO2,C46653067_decoy,TRY1,Decoy,0,-8.9806,-7.01,-1.18,-7.3092283286054
CCc1cccc2c1NC(=O)[C@]21N[C@@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C16033015_decoy,TRY1,Decoy,0,-7.40114,-7.88,-0.09,-9.155456941323532
O=C1NC(=O)[C@@](CCCCCC[C@@]2(c3ccccc3)NC(=O)NC2=O)(c2ccccc2)N1,C18284541_decoy,TRY1,Decoy,0,-7.36747,-7.61,-3.02,-6.323674093494777
Cc1cccc(N2CCN(c3ncnc(NNC(=O)c4ccccc4Br)c3N)CC2)c1C,C54544511_decoy,TRY1,Decoy,0,-8.78795,-7.51,-2.1,-7.5086212727408626
O=C(CSc1n[nH]c(N/N=C/c2ccccc2O)n1)NCc1ccccc1Cl,C06336492_decoy,TRY1,Decoy,0,-8.99229,-8.26,-2.41,-7.107937998038887
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)NCCc1ccc(F)cc1,C59015441_decoy,TRY1,Decoy,0,-8.88329,-8.94,-2.02,-9.57779750008095
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)NCCc1ccccc1Cl,C59015461_decoy,TRY1,Decoy,0,-9.48237,-9.47,-1.91,-8.788387430547752
O=C(CSc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1)NCc1ccccc1Cl,C59018556_decoy,TRY1,Decoy,0,-11.742,-8.95,-3.61,-11.383987593422985
CCc1c(C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)[nH]c(C)c1C(C)=O,C51451213_decoy,TRY1,Decoy,0,-8.80682,-7.57,-2.0,-6.923372487048478
CCOc1ccc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)c(OC)c2)cc1,C59384240_decoy,TRY1,Decoy,0,-9.23515,-5.23,-1.34,-7.122409822601122
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@@H](C)O)N[C@]23C(=O)Nc2ccc(F)cc23)c1,C59488010_decoy,TRY1,Decoy,0,-7.78772,-5.59,-3.73,-5.853053734606177
C=CCNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2O)n1,C59815737_decoy,TRY1,Decoy,0,-9.12165,-7.59,-1.39,-7.803185840817011
C/C(=N\Nc1nnc(SCC(=O)C2C3CC4CC(C3)CC2C4)n1N)c1ccccc1O,C59829690_decoy,TRY1,Decoy,0,-8.61417,-9.17,-1.7,-7.670489724689175
CCC/C(C)=N/Nc1nnc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)n1N,C59915220_decoy,TRY1,Decoy,0,-9.42475,-5.34,-2.48,-6.236260462004164
Cc1cccc(-n2c(S[C@@H](C(=O)NC(N)=O)C(C)C)nnc2-c2c[nH]c3ccccc23)c1,C12528440_decoy,TRY1,Decoy,0,-9.25689,-8.92,-1.45,-9.665683770908068
COc1cc(N/C(N)=N\c2nc(=O)cc(CSc3ccc(C)cc3)[nH]2)cc(OC)c1,C17027684_decoy,TRY1,Decoy,0,-7.51642,-6.65,-3.55,-6.195208253089004
COc1ccc([C@@H]2C(C(=O)c3ccc(F)cc3)=C(O)C(=O)N2CC[NH2+]CCO)cc1,C04626048_decoy,TRY1,Decoy,0,-8.14685,-5.29,-1.64,-5.434056206898338
O=c1nc2n(CC[NH+](CCO)CCO)c3cc(Cl)c(Cl)cc3nc-2c(=O)[nH]1,C05052125_decoy,TRY1,Decoy,0,-8.39728,-5.18,-1.36,-5.623180380156292
CC[NH+]1CCc2c(sc(NC(=O)CSc3ccc(Cl)cc3)c2C(N)=O)C1,C05191587_decoy,TRY1,Decoy,0,-9.16699,-5.62,-1.38,-5.384504618435596
NS(=O)(=O)c1ccc(CC[NH2+][C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1,C04679915_decoy,TRY1,Decoy,0,-9.25859,-6.12,-2.23,-6.021592281516901
CC(C)[NH+]1CCc2c(sc(NC(=O)CS(=O)(=O)c3ccccc3)c2C(N)=O)C1,C05189878_decoy,TRY1,Decoy,0,-8.0875,-6.49,-2.16,-5.717001950329531
CCC[NH+](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)Cc1nnc(-c2cccs2)o1,C08185058_decoy,TRY1,Decoy,0,-8.29465,-6.7,-2.18,-6.514180475942255
OCC[NH+](CCO)C[C@H](O)COc1ccc(Br)cc1Br,C12420359_decoy,TRY1,Decoy,0,-8.07814,-3.75,-2.24,-5.0906594462145005
C[NH+](CCc1ccccn1)[C@H]1[C@@H]2OC[C@@H](O2)[C@@H](NC(=O)Nc2cccc(C#N)c2)[C@@H]1O,C12489994_decoy,TRY1,Decoy,0,-7.21294,-6.94,-2.74,-6.123071094434881
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12749939_decoy,TRY1,Decoy,0,-7.23761,-5.93,-0.52,-4.935144716986695
COCCOC(=O)c1c(NC(=O)C[NH+]2C[C@@H](C)C[C@H](C)C2)sc(C(N)=O)c1C,C16475192_decoy,TRY1,Decoy,0,-8.69203,-5.6,-2.5,-7.72800814920691
Cc1ccc(NC(=O)C[NH+](C)CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc1,C16512520_decoy,TRY1,Decoy,0,-8.91434,-6.91,-2.7,-6.401575515112952
Cc1nnc(C[NH2+]Cc2cc(Cl)ccc2OC[C@@H](O)C[NH+]2CCCCCC2)[n-]1,C19335319_decoy,TRY1,Decoy,0,-8.12504,-7.04,-0.71,-7.378287113752162
NS(=O)(=O)c1ccc(CC[NH2+][C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1,C19597007_decoy,TRY1,Decoy,0,-8.33189,-7.63,-2.0,-5.463268976012233
COc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)Nc1n[nH]c2nc(C)ccc12,C19661266_decoy,TRY1,Decoy,0,-7.82256,-7.21,-1.81,-6.660713593533691
COc1ccccc1C[NH+]1CCNC(=O)[C@H]1CC(=O)Nc1n[nH]c2nc(C)ccc12,C19661268_decoy,TRY1,Decoy,0,-7.7306,-7.88,-1.6,-5.888703093395732
OCc1ccc(C[NH2+][C@H]2[C@H](O)[C@@H](N3CCN(c4ccccc4)CC3)[C@@H]3OC[C@H]2O3)o1,C20463848_decoy,TRY1,Decoy,0,-7.75256,-5.76,-1.92,-5.085544185497698
CC(=O)N[C@H]1CC[C@]2(C)CC[C@H]([C@H](C)C(=O)NCC[NH+]3CCCC3)[C@H](O)[C@H]2[C@@H]1C,C20466178_decoy,TRY1,Decoy,0,-8.53539,-6.6,-3.4,-5.600079839273123
Cc1n[nH]c2nc(SCC(=O)NCc3ccco3)n(-c3ccc(Br)cc3)c(=[NH2+])c12,C20758610_decoy,TRY1,Decoy,0,-9.01919,-7.07,-3.23,-8.792811682000522
C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(S(=O)(=O)c2ccc(F)cc2)CC1,C22010492_decoy,TRY1,Decoy,0,-7.63779,-8.48,-1.53,-6.95883281057912
Cc1sc2nc(CN3CCOCC3)nc(NC3CC[NH+](CC(N)=O)CC3)c2c1C,C25151146_decoy,TRY1,Decoy,0,-9.47634,-6.87,-1.04,-7.794775902131431
Cc1ccc([N+](=O)[O-])c(NC(=O)C[NH+](C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)c1C,C25795744_decoy,TRY1,Decoy,0,-7.53359,-6.02,-1.11,-5.487057532871455
O=C(NCCN1CC[NH2+]CC1)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccco1,C26805719_decoy,TRY1,Decoy,0,-8.79955,-7.68,-1.98,-6.801748366437685
Cc1c(C(N)=O)sc(NC(=O)CN2CC[NH+]3CCC[C@@H]3C2)c1C(=O)OC(C)C,C20295038_decoy,TRY1,Decoy,0,-9.15583,-6.13,-0.63,-5.8823930013328205
CC[NH+]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc([C@]2(CC)CCC(=O)NC2=O)cc1,C36352089_decoy,TRY1,Decoy,0,-8.75594,-7.47,-3.3,-6.088485557733748
CC[NH+]1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc([C@]2(CC)CCC(=O)NC2=O)cc1,C36352090_decoy,TRY1,Decoy,0,-7.98372,-7.44,-2.65,-5.632044191047201
CC[NH+](CC)CCNC(=O)c1ccc2c(c1NCCO)C(=O)c1ccccc1C2=O,C05025253_decoy,TRY1,Decoy,0,-7.32222,-7.62,-1.67,-6.138416931660475
CCC[C@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631220_decoy,TRY1,Decoy,0,-9.24951,-4.88,-3.54,-5.81819259562332
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632019_decoy,TRY1,Decoy,0,-9.25154,-4.89,-1.7,-5.746790894657514
CC(C)C(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685703_decoy,TRY1,Decoy,0,-8.21125,-5.65,-4.12,-6.584451286027752
CC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693435_decoy,TRY1,Decoy,0,-7.72221,-5.51,-2.22,-5.384331099957566
CC(C)Nc1ccc[nH+]c1N1CCN(C(=O)[C@@H]2Cc3cc(NS(C)(=O)=O)ccc3N2)CC1,C29568882_decoy,TRY1,Decoy,0,-8.60355,-5.78,-2.07,-5.2905404584087705
CC(C)Nc1ccc[nH+]c1N1CCN(C(=O)[C@H]2Cc3cc(NS(C)(=O)=O)ccc3N2)CC1,C29568886_decoy,TRY1,Decoy,0,-7.40589,-7.97,-3.13,-5.971055960865799
CC(C)C[C@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2cccc([N+](=O)[O-])c2)c2ccccc21,C06952235_decoy,TRY1,Decoy,0,-8.02626,-6.93,-2.74,-6.802486261287482
CC(C)C[C@@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2cccc([N+](=O)[O-])c2)c2ccccc21,C06952408_decoy,TRY1,Decoy,0,-8.26794,-6.09,-2.56,-6.205001307649629
CC(C)C[C@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc21,C59165495_decoy,TRY1,Decoy,0,-7.05947,-7.29,-1.58,-7.653006180015866
CC(C)C[C@@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc21,C59165496_decoy,TRY1,Decoy,0,-7.955,-7.01,-1.33,-6.731898967096058
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)Nc1cc(-c2ccccc2)nn1CCO,C60330517_decoy,TRY1,Decoy,0,-8.98974,-6.86,-1.52,-8.297202804467284
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)Nc1cc(-c2ccccc2)nn1CCO,C60330518_decoy,TRY1,Decoy,0,-8.52395,-5.71,-1.38,-6.031701947845707
CCOc1ccc(C(=O)NCCC(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc1,C20573431_decoy1,TRY1,Decoy,0,-9.31926,-6.23,,-5.498366063460889
CSCC[C@H](NC(=O)c1ccco1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C20573754_decoy,TRY1,Decoy,0,-10.1257,-6.21,-0.88,-6.982097994854506
CCCCc1ccc(C(=O)NCC(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc1,C20623344_decoy,TRY1,Decoy,0,-8.79572,-7.35,-1.27,-5.758130542130293
COc1ccc2c(c1)=C(CCNC(=O)CCNc1nc(Cl)nc3[nH]cnc13)C[NH+]=2,C63279457_decoy,TRY1,Decoy,0,-9.93295,-7.4,-1.8,-6.985551268117042
CNC(=S)/N=C(\NCCC1=c2cc(OC)ccc2=[NH+]C1)Nc1nc(C)cc(C)n1,C63492704_decoy,TRY1,Decoy,0,-7.56405,-7.23,-1.84,-7.352339312842825
COc1ccc2c(c1)=C(CCNC(=O)C(=O)Nc1ccc([C@H]3NN=C(C)O3)cc1)C[NH+]=2,C63807345_decoy,TRY1,Decoy,0,-8.96812,-8.52,-2.88,-7.809035515348158
CC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)c1ccc2c(c1)OCO2,C63843828_decoy,TRY1,Decoy,0,-8.19063,-7.0,-0.29,-5.492246471184575
O=C(NC[C@@H]1CCCO1)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64348470_decoy,TRY1,Decoy,0,-8.77114,-7.11,-1.23,-7.843190976493731
O=C(NC[C@H]1CCCO1)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64348472_decoy,TRY1,Decoy,0,-8.46337,-6.81,-1.33,-6.143875524812405
O=C(NC[C@H]1CCCO1)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64348474_decoy,TRY1,Decoy,0,-8.214,-6.49,-0.76,-6.266173705798964
CC1=NN[C@H](c2ccc(NC(=O)C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)cc2)O1,C64369637_decoy,TRY1,Decoy,0,-8.22943,-8.59,-2.94,-6.44126832914322
CCOc1ccc(C(=O)NCCC(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)cc1,C20573431_decoy2,TRY1,Decoy,0,-9.05489,-6.1,,-5.851636593328357
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)C[NH3+],C04084148_decoy,TRY1,Decoy,0,-9.28564,-7.51,-2.75,-5.994104766145932
CSc1nc(NCC[NH3+])c2sc3nc(-c4ccccc4)c4c(c3c2n1)CCC4,C02211592_decoy,TRY1,Decoy,0,-11.0497,-5.81,-3.69,-7.465209152671691
CC[NH+]1CCc2c(sc(NC(=O)CCSc3ccc(C)cc3)c2C(N)=O)C1,C05191302_decoy,TRY1,Decoy,0,-9.1532,-6.29,-4.07,-6.139515269442304
[NH2+]=C(N/N=C/c1ccc(Cl)c(Cl)c1)N/N=C/c1ccc(Cl)c(Cl)c1,C05567611_decoy,TRY1,Decoy,0,-11.4283,-5.4,-4.52,-7.181030528963144
CC[C@@]1(C)Cc2c(sc3c2[C@H]([NH3+])N=C(SCC(=O)N2CCCCC2)N3)CO1,C06603994_decoy,TRY1,Decoy,0,-9.10406,-6.64,-0.68,-6.022834409113799
C[C@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12743716_decoy,TRY1,Decoy,0,-6.71675,-6.85,-1.02,-5.314315705400237
C[C@@H](C(=O)Nc1cc(F)ccc1F)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12797118_decoy,TRY1,Decoy,0,-7.65274,-6.11,-1.43,-5.754675643727491
COc1ccc2c([C@@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3ccccc3O4)c[nH]c2c1,C19563119_decoy,TRY1,Decoy,0,-8.18338,-6.21,-0.8,-4.823792455976151
CS(=O)(=O)CC[C@H]([NH3+])C(=O)Nc1c(Cl)cc(Br)cc1Cl,C20505950_decoy,TRY1,Decoy,0,-8.3557,-5.25,-3.78,-5.2262901440547695
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(F)c(F)c1)NCCc1ccc(O)cc1,C20780984_decoy,TRY1,Decoy,0,-9.07512,-8.33,-1.88,-7.639349595118021
CCCCC[C@@H](C)[C@@H](C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C[NH+](CC(N)=O)CC1,C20806860_decoy,TRY1,Decoy,0,-8.46057,-6.42,-2.23,-6.726634244396532
CCCCC[C@H](C)[C@@H](C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C[NH+](CC(N)=O)CC1,C20806864_decoy,TRY1,Decoy,0,-8.58711,-7.33,-2.34,-6.352817153253064
CCCCC[C@H](C)[C@H](C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C[NH+](CC(N)=O)CC1,C20806871_decoy,TRY1,Decoy,0,-8.25399,-7.29,-3.01,-6.016249298815148
CCc1cccc(CC)c1NC(=O)c1cc(C(=O)c2cc(C)ccc2O)coc1=[NH2+],C06489974_decoy,TRY1,Decoy,0,-8.36255,-6.93,-2.69,-6.2127512802381135
O=C(c1cccs1)N1N[C@H](c2cccnc2)N[C@H]1[NH2+]CC1=CC2=CC=N[C@@H]2C=C1,C38599004_decoy,TRY1,Decoy,0,-8.60022,-7.52,-2.06,-6.394352162155006
O=C(c1cccs1)N1N[C@@H](c2cccnc2)N[C@H]1[NH2+]CC1=CC2=CC=N[C@@H]2C=C1,C38599006_decoy,TRY1,Decoy,0,-8.36902,-7.92,-0.89,-13.8774086016807
O=C(NNc1ccc(Cl)cc1)c1ccc(N2CC[NH2+][C@H](c3ccccc3)C2)nc1,C39229430_decoy,TRY1,Decoy,0,-9.42016,-7.6,-2.02,-6.943689150386297
O=C(NNc1ccc(Cl)cc1)c1ccc(N2CC[NH2+][C@@H](c3ccccc3)C2)nc1,C39229431_decoy,TRY1,Decoy,0,-8.76649,-6.07,-1.74,-5.315643900655583
CC(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676367_decoy,TRY1,Decoy,0,-8.97534,-7.74,-0.69,-6.817170519573157
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2)CC12CC[NH2+]CC2,C39683893_decoy,TRY1,Decoy,0,-7.74845,-5.21,-1.42,-5.661193038548396
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(F)c2)CC12CC[NH2+]CC2,C39683894_decoy,TRY1,Decoy,0,-7.13895,-6.3,-4.04,-6.6539323207509335
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C)c2)CC12CC[NH2+]CC2,C39683910_decoy,TRY1,Decoy,0,-7.13124,-7.22,-0.88,-5.25017411104612
C=CC[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@H]1c1ccc(C)c(C)c1,C39744818_decoy,TRY1,Decoy,0,-7.65013,-8.28,-1.15,-5.752750022214574
C=CC[NH+]1[C@@H](c2ccc(C)c(C)c2)NN[C@H]1SCc1nc2ccccc2c(=O)[nH]1,C39744825_decoy,TRY1,Decoy,0,-7.56633,-7.86,-3.21,-6.001906070311772
CCN(c1cccc(C)c1)c1nc[nH+]c(Nc2ccc(Cl)c(C(F)(F)F)c2)c1N,C40661926_decoy,TRY1,Decoy,0,-8.24281,-5.63,-2.11,-6.116005225778543
CCN(c1ccccc1)c1nc[nH+]c(Nc2cc(C(F)(F)F)ccc2Cl)c1N,C40679379_decoy,TRY1,Decoy,0,-8.32584,-6.03,-3.04,-4.971012476922224
CCN(c1ccccc1)c1nc[nH+]c(Nc2ccc(Cl)c(C(F)(F)F)c2)c1N,C40679745_decoy,TRY1,Decoy,0,-8.01014,-7.32,-2.27,-7.568117484981734
CCN(c1nc[nH+]c(Nc2cccc(Cl)c2C)c1N)c1cccc2ccccc12,C40701473_decoy,TRY1,Decoy,0,-7.93382,-7.54,-1.05,-7.090854521580668
CCN(c1nc[nH+]c(Nc2ccc(Cl)cc2C)c1N)c1cccc2ccccc12,C40701908_decoy,TRY1,Decoy,0,-8.39554,-7.54,-1.26,-6.868736653132406
CCN(c1nc[nH+]c(Nc2cc(Cl)ccc2C)c1N)c1cccc2ccccc12,C40701912_decoy,TRY1,Decoy,0,-9.45715,-6.97,-2.82,-7.376150223638642
CCCCOc1ccc(Nc2[nH+]cnc(N(CC)c3cccc4ccccc34)c2N)cc1,C40701966_decoy,TRY1,Decoy,0,-8.22162,-6.04,-2.88,-5.208187850913009
CCN(c1nc[nH+]c(Nc2cccc3cccnc23)c1N)c1cccc2ccccc12,C40701978_decoy,TRY1,Decoy,0,-9.38731,-7.51,-1.29,-6.976754665627827
CCN(c1nc[nH+]c(Nc2cccc(Cl)c2Cl)c1N)c1cccc2ccccc12,C40701995_decoy,TRY1,Decoy,0,-8.57256,-6.46,-1.76,-5.706962802960375
CCN(c1[nH+]cnc(Nc2nc3c(C)cccc3s2)c1N)c1cccc2ccccc12,C40702025_decoy,TRY1,Decoy,0,-7.91966,-7.3,-2.58,-5.616634054166282
CCN(c1[nH+]cnc(Nc2nc3ccc(C)cc3s2)c1N)c1cccc2ccccc12,C40702027_decoy,TRY1,Decoy,0,-8.0212,-8.14,-2.09,-10.242216646499228
CCN(c1nc[nH+]c(Nc2ccc(C(F)(F)F)cc2)c1N)c1cccc2ccccc12,C40702143_decoy,TRY1,Decoy,0,-6.99764,-7.01,-1.68,-5.304279107554624
CC1(C)C[C@H]2C[C@](C)(CN2c2nc[nH+]c(NN(c3ccccc3)c3ccccc3)c2N)C1,C40734877_decoy,TRY1,Decoy,0,-7.98935,-5.86,-1.34,-5.180705262335631
Nc1c(N2CCCc3ccccc32)nc[nH+]c1Nc1ccc(Oc2ccccc2)cc1,C40780391_decoy,TRY1,Decoy,0,-7.45114,-5.95,-1.88,-5.4558068436776574
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/Nc1ccccc1)CCC2,C40824263_decoy,TRY1,Decoy,0,-9.13036,-7.11,-2.08,-5.586530146898597
C[C@@H](Nc1nc(NCCc2c[nH]c3ccccc23)[nH+]c2ccccc12)c1ccccc1,C41154031_decoy,TRY1,Decoy,0,-9.57162,-8.42,-1.32,-7.298015162019189
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C44713720_decoy,TRY1,Decoy,0,-9.19322,-5.83,-0.95,-6.253675921268196
CCc1ccc2oc(-c3ccc(O)c(OC)c3)c/c(=[NH+]\Nc3nc4ccccc4[nH]3)c2c1,C08847638_decoy,TRY1,Decoy,0,-8.92482,-7.55,-1.74,-6.467721288915196
Nc1cc(Nc2ccc(Cl)cc2)c2nc(-c3ccccc3)c(-c3ccccc3)nc2[nH+]1,C01703633_decoy,TRY1,Decoy,0,-9.59163,-7.88,-2.18,-5.650189918413156
COc1cccc([C@@H]2CC(c3ccccc3O)=NC3(CC[NH+](C(C)C)CC3)N2)c1O,C15830192_decoy,TRY1,Decoy,0,-10.6144,-6.78,-5.13,-6.176647396588076
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccc(N(c3ccccc3)c3ccccc3)cc2)N1,C12579688_decoy,TRY1,Decoy,0,-9.16978,-7.56,-2.48,-8.600872661459528
C[C@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(Cl)ccc4=[NH+]C3)C2)S1,C63557671_decoy,TRY1,Decoy,0,-9.93204,-6.34,-2.73,-6.328134569930769
O=C(Nc1ccc([C@@H]2C=CNN2)cc1)[C@@H]1CCC[NH+](Cc2ccc(Cl)s2)C1,C39359847_decoy,TRY1,Decoy,0,-9.24829,-8.16,-1.1,-8.400661847150655
CC1(C)CC(=O)C2=CNC3=C(C(=O)NCCC4=c5ccccc5=[NH+]C4)CNN3[C@@H]2C1,C64518151_decoy,TRY1,Decoy,0,-8.63098,-8.69,-1.09,-6.38143756093864
CC1(C)CC(=O)C2=CNC3=C(C(=O)NCCC4=c5ccccc5=[NH+]C4)CNN3[C@H]2C1,C64518152_decoy,TRY1,Decoy,0,-8.72407,-8.73,-1.19,-5.976482867381488
Cc1sc2nc(CC[NH3+])nc(N[C@@H](C)c3ccc(S(C)(=O)=O)cc3)c2c1C,C65506377_decoy,TRY1,Decoy,0,-9.1074,-7.18,-0.41,-9.114067500717354
Nc1ccn([C@@H]2O[C@H](CO[P@@]3(=O)OCC[C@@H](c4ccncc4)O3)[C@@H](O)[C@@H]2O)c(=O)n1,C03938680_decoy,TRY1,Decoy,0,-5.87156,-7.56,-1.68,-6.703480663248084
CC(=O)OCC1=C[C@@H]2CC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]1[C@@H]32,C04270034_decoy,TRY1,Decoy,0,-8.23558,-6.96,-1.14,-6.092829444477384
Cn1c(=O)[nH]c(=O)c2c1nc(NCCO)n2C[C@H](O)COc1ccc([N+](=O)[O-])cc1,C08892323_decoy,TRY1,Decoy,0,-8.088,-7.25,-1.68,-5.636638668267391
CC1(C)NC(=O)N(CC(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1=O,C09388535_decoy,TRY1,Decoy,0,-9.23245,-7.33,-3.0,-7.921151557086981
CNc1nc2c(c(=O)[nH]c(=O)n2C)n1CCCn1c(NC)nc2c1c(=O)[nH]c(=O)n2C,C10049598_decoy,TRY1,Decoy,0,-8.49925,-7.39,-2.13,-6.066724506500709
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1c(C)nc2nc(N)nn2c1C,C12702267_decoy,TRY1,Decoy,0,-9.02381,-8.02,-1.67,-12.57517921623788
CCn1c(N)c(C(=O)COC(=O)C[C@H]2Oc3ccccc3NC2=O)c(=O)[nH]c1=O,C13027256_decoy,TRY1,Decoy,0,-7.17707,-8.09,-0.63,-7.01886952108057
COc1ccc(OC[C@@H](O)Cn2c(NCCO)nc3c2c(=O)[nH]c(=O)n3C)cc1,C06444864_decoy,TRY1,Decoy,0,-7.86852,-7.28,-2.2,-5.793425630058524
C/C(=N\Nc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@@H](O)CO)c1ccc([N+](=O)[O-])cc1,C05358186_decoy,TRY1,Decoy,0,-7.72192,-6.92,-1.91,-6.499773810871692
Cc1ccc(OC[C@@H](O)Cn2c(NC[C@H](C)O)nc3c2c(=O)[nH]c(=O)n3C)cc1,C13810683_decoy,TRY1,Decoy,0,-8.73266,-7.78,-1.5,-6.795677351332047
Cc1ccc(OC[C@@H](O)Cn2c(NCCCO)nc3c2c(=O)[nH]c(=O)n3C)cc1,C13810809_decoy,TRY1,Decoy,0,-8.62659,-7.45,-2.51,-6.328432302325115
CC(=O)NC(=O)CSc1nnc(NC(=O)CSc2nnc(N)s2)s1,C13839546_decoy,TRY1,Decoy,0,-10.1545,-6.41,-1.27,-7.737797448672087
O=[N+]([O-])c1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C16928611_decoy,TRY1,Decoy,0,-6.36667,-7.97,-2.83,-6.68443944557386
CC(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1n1nc(-c2ccc(C)cc2)n(C(C)C)c1=S,C17051973_decoy,TRY1,Decoy,0,-6.69988,-4.07,-3.66,-4.088641512129766
Cn1c(=O)n(C)c2cc([C@H](O)COc3ccccc3CNn3nnnc3N)ccc21,C20877906_decoy,TRY1,Decoy,0,-6.90186,-8.87,-3.4,-6.963837561302244
CC(C)n1cc(/C=N/Nc2nnc(Sc3nc4c([nH]3)c(=O)n(C)c(=O)n4C)n2N)cn1,C20921113_decoy,TRY1,Decoy,0,-9.17054,-8.63,-2.58,-7.51345193984754
CC(=O)c1c(NNC(=O)C(=O)NNc2oc(C)cc(=O)c2C(C)=O)oc(C)cc1=O,C27028118_decoy,TRY1,Decoy,0,-7.39706,-7.91,-2.89,-7.124972426474714
COc1c2c(cc3oc(C)cc(=O)c13)O[C@H](C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2,C31165497_decoy,TRY1,Decoy,0,-5.84574,-6.39,-3.49,-4.615889228738435
C=C(C(=O)OC)[C@@H]1[C@@H](O)[C@@H]2C(=O)CC[C@@H](O)[C@@]2(C)C[C@@H]1OC(=O)C(=C)[C@@H](O)CO,C31170351_decoy,TRY1,Decoy,0,-7.6714,-5.19,-3.24,-5.143925964282063
C=C(C(=O)OC)[C@H]1[C@@H](O)[C@@H]2C(=O)CC[C@@H](O)[C@@]2(C)C[C@@H]1OC(=O)C(=C)[C@@H](O)CO,C31170354_decoy,TRY1,Decoy,0,-8.15662,-6.07,-4.41,-5.891291679216351
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(COc2ccccc2C)n(C)c1=S,C32594282_decoy,TRY1,Decoy,0,-6.75135,-7.09,-4.54,-6.044881428988577
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(-c2ccncc2)n(CC(C)C)c1=S,C32594304_decoy,TRY1,Decoy,0,-7.02025,-5.59,-2.8,-5.095767877264162
Cn1c(=O)c2[nH]c(CNC(=S)NCc3nc4c([nH]3)c(=O)n(C)c(=O)n4C)nc2n(C)c1=O,C17146852_decoy,TRY1,Decoy,0,-6.66687,-7.0,-2.36,-4.743042722718384
CC(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@H]1n1nc(-c2ccc(C)cc2)n(C(C)C)c1=S,C35590902_decoy,TRY1,Decoy,0,-7.86531,-5.41,-0.59,-5.652730697504705
N#Cc1cc(C#N)c(SC/C([O-])=N/c2c(C#N)sc(N)[n+]2-c2ccccc2)nc1N,C35741530_decoy,TRY1,Decoy,0,-7.84053,-6.73,-3.16,-5.647662604445696
COCCOC(=O)c1c(NC(=O)CSc2ncn[nH]2)sc(C(N)=O)c1C,C09963864_decoy,TRY1,Decoy,0,-8.36778,-6.59,-2.32,-8.236961739791615
CCOc1ccc(N[C@@H]2N=C3C(=O)N=CN=C3N2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C38818474_decoy,TRY1,Decoy,0,-7.28476,-6.8,-2.79,-6.394986628217311
CCOc1ccc(N[C@@H]2N=C3C(=O)N=CN=C3N2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C38818476_decoy,TRY1,Decoy,0,-7.23182,-6.1,-1.82,-5.019950201439452
CCOc1ccc(N[C@H]2N=C3C(=O)N=CN=C3N2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C38818477_decoy,TRY1,Decoy,0,-6.7969,-7.43,-1.52,-5.784401898049856
O=C1[C@@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@@](CO)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C33916510_decoy,TRY1,Decoy,0,-7.45307,-7.49,-2.21,-7.013425734098301
CCOC(=O)Cc1[nH]nc2c1[C@@]1(C(=O)Nc3ccc([N+](=O)[O-])cc31)C(C#N)=C(N)O2,C09242507_decoy,TRY1,Decoy,0,-5.86146,-5.21,-2.7,-4.568018819796808
COCCN1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C16022303_decoy,TRY1,Decoy,0,-8.37285,-5.85,-1.59,-5.851329558361449
COCCN1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@@]3(C(=O)Nc4ccc(Br)cc43)[C@@H]2C1=O,C20567057_decoy,TRY1,Decoy,0,-7.32475,-5.24,-3.81,-5.302777335533552
CCNC(=O)NC(=O)[C@H](C)OC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC(=O)NCC,C57464167_decoy,TRY1,Decoy,0,-7.93009,-7.25,-4.6,-6.8640124220091225
Cn1c(N)c(C(=O)CSc2nnc(NC[C@H]3CCCO3)s2)c(=O)[nH]c1=O,C57549339_decoy,TRY1,Decoy,0,-8.71997,-7.86,-2.02,-7.909481877596307
O=C(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N/N=C/[C@@H](O)[C@H]1OC(=O)[C@@H](O)[C@H]1O,C59385249_decoy,TRY1,Decoy,0,-6.10126,-7.9,-1.02,-6.740524303558049
O=C(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N/N=C/[C@H](O)[C@@H]1OC(=O)[C@@H](O)[C@H]1O,C59385250_decoy,TRY1,Decoy,0,-6.11995,-7.67,-3.28,-6.507619500267142
O=C(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N/N=C/[C@@H](O)[C@@H]1OC(=O)[C@@H](O)[C@H]1O,C59385251_decoy,TRY1,Decoy,0,-6.90056,-5.83,-2.17,-5.56706219481853
COc1cc([C@H]2C(C(N)=O)=C(C)N=C3N=C(CCCO)NN32)cc(OC)c1OC,C13132308_decoy,TRY1,Decoy,0,-7.8493,-5.46,-2.53,-6.346637135725103
COc1cc(/C=N/Nc2nc(SCC(=O)NCCO)n[nH]2)cc(OC)c1OC,C59830862_decoy,TRY1,Decoy,0,-8.86414,-6.72,-2.66,-6.375832768712345
C=CCn1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)cn1,C59883850_decoy,TRY1,Decoy,0,-8.83269,-7.45,-3.27,-6.763358129545877
C[C@@]1(c2ccc(Cl)s2)NC(=O)N(CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C1=O,C60374816_decoy,TRY1,Decoy,0,-8.56661,-7.44,-1.56,-5.548769484691622
NC(=O)CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1I,C61808638_decoy,TRY1,Decoy,0,-6.08306,-4.0,-3.07,-4.586443939441606
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2ccco2)N1C,C39781074_decoy,TRY1,Decoy,0,-7.92516,-7.12,-2.72,-5.8731083903941474
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2ccco2)N1C,C39781075_decoy,TRY1,Decoy,0,-7.39888,-6.96,-3.06,-5.223883574511394
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(C2CC2)N1C1CC1,C39935909_decoy,TRY1,Decoy,0,-8.19501,-6.75,-1.63,-6.217010041615466
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=NN1C[C@@H]1CCCO1,C39937768_decoy,TRY1,Decoy,0,-7.68486,-7.61,-1.03,-6.5187043018705095
Cc1ccc(C#N)cc1NC(=O)C(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C63814268_decoy,TRY1,Decoy,0,-7.40939,-7.39,-1.91,-5.901422215245148
COCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2Cc2ccc(O)c(O)c2)C(=O)Nc2ccccc21,C20548289_decoy,TRY1,Decoy,0,-9.43499,-9.64,-2.53,-10.655924542269531
O=C(NCc1cc(Br)c2c(c1)OCO2)NNC(=O)C(=O)NC1CC1,C64764582_decoy,TRY1,Decoy,0,-8.32035,-7.28,-1.33,-5.903475725371947
CC(C)[NH2+]C[C@@H](O)C[NH2+][C@H](C)[C@@H]1COc2ccccc2O1,C04610571_decoy,TRY1,Decoy,0,-6.93215,-5.11,-3.7,-4.507119128280496
CC/C=C/C/C=C/[C@@H]1CC(=O)NCCC[NH2+]CCCC[NH2+]1,C05734056_decoy,TRY1,Decoy,0,-8.35486,-4.35,-1.22,-4.61716810778481
[NH3+]C1CC[NH+](C[C@@H](O)c2ccc(Br)cc2)CC1,C11729525_decoy,TRY1,Decoy,0,-8.35372,-6.29,-0.41,-10.156231783737848
CC/C=C\C/C=C/[C@@H]1CC(=O)NCCC[NH2+]CCCC[NH2+]1,C17191218_decoy,TRY1,Decoy,0,-8.39562,-4.54,-1.99,-4.698864237063443
C[NH+]1CCC(C[NH3+])(NS(=O)(=O)N2CCCCCC2)CC1,C20431611_decoy,TRY1,Decoy,0,-7.41473,-5.29,-3.46,-5.007004626777137
[NH3+]C[C@H](c1ccccc1O)N1CCN(c2cccc[nH+]2)CC1,C32066422_decoy,TRY1,Decoy,0,-6.31257,-5.12,-1.78,-4.244978234252511
CC(C)C[NH+](CC(C)C)[C@@H](C[NH3+])c1cc(Cl)ccc1O,C32066550_decoy,TRY1,Decoy,0,-8.03926,-4.31,-4.72,-5.077892121024014
[NH3+]C[C@@H](c1cc(Br)ccc1O)[NH+]1CCCCC1,C32066576_decoy,TRY1,Decoy,0,-8.55131,-5.85,-2.23,-7.223796222081459
C=CCc1cc([C@@H](C[NH3+])[NH+]2CCC(C)CC2)cc(OC)c1O,C32074387_decoy,TRY1,Decoy,0,-8.06286,-5.02,-4.55,-5.105270950191031
Cc1cc2c(cc1C)NC1(CC[NH2+]CC1)/C(=[NH+]/C(C)(C)C)N2,C32918780_decoy,TRY1,Decoy,0,-7.02757,-5.09,-0.63,-3.862700069357617
CCC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC[C@H](CO)C2)C1,C36226790_decoy,TRY1,Decoy,0,-7.29793,-4.69,-1.43,-4.794069901519508
CCC(C)(C)[C@@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC(CO)CC2)C1,C37159020_decoy,TRY1,Decoy,0,-8.29954,-4.8,-1.85,-5.017096442549983
CNC(=O)C[NH+]1CCC(NC(=O)CC[NH2+]C(C)(C)C)CC1,C37634350_decoy,TRY1,Decoy,0,-7.81605,-5.76,-2.89,-5.102689883243902
[NH3+]CCCC[NH2+]Cc1cc(Br)c2c(c1)OCO2,C37715265_decoy,TRY1,Decoy,0,-7.95075,-4.58,-1.27,-5.8989551419177015
[NH3+]CCCC[NH2+]Cc1ccc(I)o1,C37715439_decoy,TRY1,Decoy,0,-7.60732,-4.47,-1.99,-7.038968183478319
CSCC[C@H]([NH3+])C(=O)NC[C@]1([NH+](C)C)CCC[C@@H](C)C1,C40670663_decoy,TRY1,Decoy,0,-8.77203,-4.4,-2.62,-5.364739314688166
CC(C)[C@@H](CNC(=O)C1([NH3+])CCCC1)N1CC[NH+](C)CC1,C40770536_decoy,TRY1,Decoy,0,-8.22989,-4.28,-1.95,-5.429766474565233
CC(C)[C@H](CNC(=O)C1([NH3+])CCCC1)N1CC[NH+](C)CC1,C40770538_decoy,TRY1,Decoy,0,-8.40974,-4.51,-1.06,-4.714031782428027
[NH3+]C1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1C(=O)Nc2cc(F)cc(F)c21,C42134954_decoy,TRY1,Decoy,0,-7.33135,-6.75,-1.74,-3.978878084055999
Cc1sc2nc(C[NH+]3CCCC[C@@H]3C[NH3+])[nH]c(=O)c2c1C,C44557515_decoy,TRY1,Decoy,0,-8.91859,-5.58,-2.8,-5.033905406243929
[NH3+]CC1(C(=O)N[C@@H]2CC[NH+]3CCCC[C@H]23)CCCCCC1,C44763855_decoy,TRY1,Decoy,0,-7.35082,-4.99,-3.18,-4.572018882893676
[NH3+]CC1(C(=O)N[C@H]2CC[NH+]3CCCC[C@H]23)CCCCCC1,C44763856_decoy,TRY1,Decoy,0,-7.51524,-4.76,-0.93,-4.704747861128356
C[C@H](CNC(=O)C1(C[NH3+])CCCCCC1)[NH+]1CCCCC1,C44995377_decoy,TRY1,Decoy,0,-8.06796,-5.08,-1.29,-5.328163728310728
CCC[NH2+][C@](C)(CC[NH+]1CCC[C@H]2CCCC[C@@H]21)C(N)=O,C45272308_decoy,TRY1,Decoy,0,-7.22309,-4.33,-1.35,-4.557042515455184
CC(C)(C)[NH+]1CCN(CC[C@](C)([NH2+]C2CC2)C(N)=O)CC1,C45279765_decoy,TRY1,Decoy,0,-7.34049,-5.71,-1.45,-5.28289881489055
C[C@H]1CCC[C@@](C[NH3+])([NH+](C)CC(=O)NCC(F)(F)F)C1,C50088850_decoy,TRY1,Decoy,0,-7.30943,-5.32,-1.16,-5.127713821346928
CC(C)[NH2+][C@](C)(CC[NH+]1CCC(C(C)(C)C)CC1)C(N)=O,C50348196_decoy,TRY1,Decoy,0,-7.10314,-5.09,-1.2,-5.294406957115551
CC(C)(C)C1CC[NH+](CC[C@](C)([NH2+]C2CC2)C(N)=O)CC1,C50348198_decoy,TRY1,Decoy,0,-7.20388,-5.68,-1.52,-5.317593682458514
[NH3+]C1CCC([NH2+]Cc2cc(Cl)c3c(c2)OCCO3)CC1,C51692768_decoy,TRY1,Decoy,0,-9.08477,-7.01,-2.13,-7.438361858724061
CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Cl)cc1Cl,C51693793_decoy,TRY1,Decoy,0,-9.35577,-6.45,-1.81,-9.929623713372294
C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(F)c(Cl)cc1Cl,C51694274_decoy,TRY1,Decoy,0,-8.65705,-4.6,-4.25,-5.040195451047331
C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc(F)c(Cl)cc1Cl,C51694276_decoy,TRY1,Decoy,0,-8.90675,-4.37,-1.51,-4.698331831748412
C[C@@H](O)C[NH+](C)[C@@H](C[NH3+])c1ccc(Br)s1,C51817238_decoy,TRY1,Decoy,0,-8.783,-3.62,-2.18,-5.008588875075495
C[C@H](O)C[NH+](C)[C@@H](c1cccc(Br)c1)[C@@H](C)[NH3+],C51817427_decoy,TRY1,Decoy,0,-7.31883,-5.5,-3.19,-7.515209661959869
C[C@H](O)C[NH+](C)[C@@H](c1ccc(Br)cc1)[C@@H](C)[NH3+],C51817439_decoy,TRY1,Decoy,0,-8.08654,-4.25,-1.77,-4.840611784997613
C[C@H](O)C[NH+](C)[C@@H](c1ccccc1Br)[C@@H](C)[NH3+],C51817471_decoy,TRY1,Decoy,0,-7.17984,-3.99,-1.62,-4.712409724829112
C[C@@H](O)C[NH+](C)[C@@H](c1ccccc1Br)[C@@H](C)[NH3+],C51817472_decoy,TRY1,Decoy,0,-6.53028,-4.11,-3.15,-4.205966717560205
C=C(C)C[NH+]1CCC2(CC1)NC(=O)N(C[C@H]([NH3+])CC)C2=O,C57846504_decoy,TRY1,Decoy,0,-7.2788,-6.0,-1.47,-6.938115685926845
CCCC[NH+]1CCC2(CC1)NC(=O)N(CC(C)(C)[NH3+])C2=O,C57846825_decoy,TRY1,Decoy,0,-8.64997,-4.11,-1.05,-4.734611001508855
NC(=O)[C@@H](C[NH+]1CCC(C[NH+]2CCCC2)CC1)NC1CC1,C62035082_decoy,TRY1,Decoy,0,-7.98432,-5.79,-1.4,-5.695475701557561
CCC[NH2+][C@](C)(CCN1CCC[NH+]2CCC[C@@H]2C1)C(N)=O,C62941721_decoy,TRY1,Decoy,0,-7.60743,-5.42,-4.58,-5.273240398027204
C[C@](CCN1CCC[NH+]2CCC[C@@H]2C1)([NH2+]C1CC1)C(N)=O,C62941724_decoy,TRY1,Decoy,0,-7.85982,-5.65,-1.62,-5.041886971612883
Nc1cnn(C[C@@H](O)C[NH+]2CC[C@H]([NH+]3CCCCC3)C2)c1,C62977652_decoy,TRY1,Decoy,0,-8.35984,-6.48,-0.22,-5.562413070990829
C[NH+]1CCC(C[NH+](C)Cc2nc(NN)ccc2Cl)CC1,C63121886_decoy,TRY1,Decoy,0,-7.73607,-6.37,-1.13,-7.627208737870998
C[NH2+]CC1CC[NH+](CC(=O)NC(=O)NCCC(C)C)CC1,C63165947_decoy,TRY1,Decoy,0,-8.34859,-5.69,-0.77,-5.877094198467606
O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1)NC(=O)NC1CC1,C63200949_decoy,TRY1,Decoy,0,-8.74407,-5.39,-1.21,-5.860439809125861
C[C@@H](Nc1cc(Cl)nc(N)n1)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C63952286_decoy,TRY1,Decoy,0,-7.88556,-7.62,-0.99,-8.21965019032765
c1ccc(C/[NH+]=C2\Nc3ccccc3N[C@@]23CCC[NH2+]C3)cc1,C65259944_decoy,TRY1,Decoy,0,-6.36303,-5.48,-0.56,-3.872835448907503
CC[C@@H](CO)[NH+]1CN[C@@H](c2ccccc2)[C@@H]1c1[nH+]c[nH]c1C,C65425018_decoy,TRY1,Decoy,0,-6.67093,-3.86,-1.88,-3.788973743505588
C[C@@H]1CCC[C@@](CN/C(N)=[NH+]/C[C@@H]2CCCO2)([NH+](C)C)C1,C66245700_decoy,TRY1,Decoy,0,-8.18769,-4.55,-1.51,-5.016965827324199
CCSC1(SCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccccc3)[NH2+]C(C)=C(C)[C@@]12C#N,C04328267_decoy,TRY1,Decoy,0,-5.36029,-4.41,-1.85,-4.096766106194538
CCSC1(SCC)[NH+]=C(N)[C@@]2(C#N)[C@H](c3ccccc3)[NH2+]C3=C(CCC3)[C@@]12C#N,C04328532_decoy,TRY1,Decoy,0,-7.43559,-5.49,-1.77,-5.1426779676660255
CC[NH+](CC)CCC[C@@H](C)Nc1c2cc(OC)ccc2[nH+]c2cc(Cl)c(N)cc12,C04363965_decoy,TRY1,Decoy,0,-8.43794,-7.26,-1.13,-7.990769843317642
[NH3+]CCCCNc1ncnc2c1sc1[nH+]c(N3CCOCC3)c3c(c12)CCC3,C02402212_decoy,TRY1,Decoy,0,-9.1056,-6.86,-0.99,-6.498021787914382
S=C(NCC[NH+]1CCOCC1)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCCC1,C08635583_decoy,TRY1,Decoy,0,-8.38554,-6.11,-2.53,-5.701576403629246
CCSC1(SCC)[NH+]=C(N)[C@@]2(C#N)[C@H](c3ccccc3)[NH2+]C3=C(CCCC3)[C@@]12C#N,C09435887_decoy,TRY1,Decoy,0,-7.74193,-4.98,-1.32,-5.164689123775037
COc1ccc(C[NH2+]CCSc2cn[nH]n2)cc1OC[C@H](O)C[NH+]1CCCC1,C11664404_decoy,TRY1,Decoy,0,-7.71581,-6.75,-2.14,-6.738099831069984
C[NH+](C[C@H](O)COc1ccccc1C[NH2+]CC1(O)CCCCC1)C1CCCCC1,C12386480_decoy,TRY1,Decoy,0,-8.45955,-7.29,-1.11,-7.069323004675306
C[NH+](C)CC(C)(C)C[NH2+]Cc1ccccc1OC[C@H](O)C[NH+]1CCSCC1,C12715558_decoy,TRY1,Decoy,0,-8.69859,-4.61,-1.69,-5.09460329956537
O[C@H](COc1ccccc1C[NH2+]CCc1cn[nH]c1)C[NH+]1CCc2ccccc2C1,C12715829_decoy,TRY1,Decoy,0,-8.04386,-7.97,-1.2,-6.725226214272421
CCCCSC1(SCCCC)[NH+]=C(N)[C@@]2(C#N)[C@H](c3ccccc3)[NH2+]C3=C(CCCC3)[C@@]12C#N,C13810544_decoy,TRY1,Decoy,0,-8.01255,-4.87,-2.46,-5.592103704572171
C[NH+]1CCN(CC[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCSCC2)CC1,C19218146_decoy,TRY1,Decoy,0,-8.80818,-5.03,-1.67,-5.507542239007909
CC[NH+]1CCN(C[C@H](O)COc2cccc(C[NH2+]CCc3c(C)n[nH]c3C)c2)CC1,C19759109_decoy,TRY1,Decoy,0,-9.28993,-6.19,-2.09,-7.477281508940481
[H]/N=c1\cc(C)sn1/C(Nc1ccc(F)c(Cl)c1)=[NH+]/C1CC(C)(C)[NH2+]C(C)(C)C1,C20343916_decoy,TRY1,Decoy,0,-8.35568,-5.8,-1.2,-5.157412047246574
OCC[NH+](CCO)Cc1ccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)cc1,C20515474_decoy,TRY1,Decoy,0,-8.23375,-6.04,-2.59,-5.940498767992841
CC1(C)CC(NC(=S)N(Cc2ccco2)C2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C21263853_decoy,TRY1,Decoy,0,-7.53614,-5.64,-2.86,-5.366818421997471
Nc1c(/C=C\c2cc3cc(C4=[NH+]CCN4)ccc3o2)[nH]c2cc(C3=[NH+]CCN3)ccc12,C05518854_decoy,TRY1,Decoy,0,-9.75201,-9.52,-2.39,-7.603326485287943
Nc1nc(C[NH+]2CCN(c3cccc[nH+]3)CC2)nc(Nc2ccc(Cl)cc2)n1,C12406238_decoy,TRY1,Decoy,0,-8.35985,-7.34,-1.07,-5.621377990570504
O[C@@H](COc1ccccc1C[NH2+]CC1=C[C@@H](c2ccccc2)[NH+]=N1)C[NH+]1CCCCC1,C39354746_decoy,TRY1,Decoy,0,-7.78087,-7.15,-2.47,-7.79791497891266
COc1ccc(OC[C@@H](O)C[NH+](C)C)c(C[NH2+]CC2([NH+]3CCCCC3)CCCC2)c1,C32516110_decoy,TRY1,Decoy,0,-8.93385,-6.49,-3.08,-7.119292003162181
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH2+]CC3(O)CCCCC3)c2)CC1,C23358458_decoy,TRY1,Decoy,0,-9.26708,-7.14,-3.61,-6.771498651022322
CC1=C(CCN(C)C(=O)CN2N[NH2+]N[C@H]2C[NH+]2CCc3ccccc3C2)[C@H](C)N=N1,C39500621_decoy,TRY1,Decoy,0,-7.87576,-8.01,-1.81,-7.437411296935107
Oc1ccccc1NC[C@@H](c1ccc(Cc2ccccc2)cc1)[NH+]1CC[NH2+][C@H](Cc2ccccc2)C1,C39530978_decoy,TRY1,Decoy,0,-9.44105,-8.0,-2.7,-10.270270589431489
CC[NH+]1[C@@H](SCC(=O)N/N=C\C2=c3ccccc3=[NH+]C2)NN[C@H]1c1ccc(C)cc1,C39923307_decoy,TRY1,Decoy,0,-8.04674,-8.07,-2.5,-11.755496812416586
CC1(C)CC(Nc2ncnc(NCCCn3cc[nH+]c3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645284_decoy,TRY1,Decoy,0,-7.06206,-7.35,-2.09,-7.558963228707211
OCC[NH2+]CCC[NH2+]Cc1cc(Br)ccc1OCc1c(Cl)cccc1Cl,C40720820_decoy,TRY1,Decoy,0,-7.98274,-5.86,-1.94,-5.7693245052329045
OCC[NH2+]CCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(F)cc1Cl,C40720894_decoy,TRY1,Decoy,0,-8.3109,-5.95,-1.82,-6.468870446892635
OCC[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2Br)o1,C41207505_decoy,TRY1,Decoy,0,-9.49859,-5.19,-1.43,-7.706555554927521
CCc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc12,C52566150_decoy,TRY1,Decoy,0,-8.97734,-8.0,-4.29,-6.609347637478084
[NH3+][C@H](CNc1cncc(Nc2cccc3cnccc23)c1)CC1=c2ccccc2=[NH+]C1,C52627722_decoy,TRY1,Decoy,0,-7.92291,-9.16,-1.9,-7.091267911292739
[NH3+][C@H](COc1cncc(-c2ccc3c(=O)[nH]ccc3c2)c1)CC1=c2ccccc2=[NH+]C1,C52627941_decoy,TRY1,Decoy,0,-8.55776,-7.09,-2.39,-5.575122568987799
CC[NH+](CC)CCC[C@@H](C)Nc1cc(N)[nH+]c2nc(-c3ccc(F)cc3)cnc12,C01719148_decoy,TRY1,Decoy,0,-7.90122,-6.44,-3.19,-7.678420873603613
O[C@H](COc1ccccc1C[NH2+]CC[NH+]1CCCCC1)C[NH+]1CCc2ccccc2C1,C20906603_decoy,TRY1,Decoy,0,-8.36963,-7.16,-2.61,-7.6309665304071554
C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]CC[NH+]2CCCCC2)cc1,C20917404_decoy,TRY1,Decoy,0,-7.81231,-6.21,-2.44,-5.366458112268416
C[C@@H](O)C[NH2+]CC[NH2+]Cc1c(OCc2ccc(Cl)cc2Cl)ccc2ccccc12,C23469500_decoy,TRY1,Decoy,0,-7.04951,-6.85,-4.01,-6.540956008623227
C[C@H](O)C[NH2+]CC[NH2+]Cc1cc(Br)ccc1OCc1ccccc1Cl,C23469532_decoy,TRY1,Decoy,0,-9.14689,-6.23,-2.57,-7.013154412432182
CCOc1cc(C[NH2+]CC[NH2+]CCO)cc(Br)c1OCc1ccccc1Cl,C23471968_decoy,TRY1,Decoy,0,-7.47976,-5.64,-4.73,-5.131128172097553
CCOc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)cc(Cl)c1OCc1ccccc1Cl,C23471972_decoy,TRY1,Decoy,0,-9.05201,-5.95,-3.42,-5.549832587368525
CCOc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)cc(Br)c1OCc1ccc(C)cc1,C20874766_decoy,TRY1,Decoy,0,-7.08645,-5.9,-2.62,-6.081515230900639
COc1cccc(C[NH2+]CC[NH2+]C[C@@H](C)O)c1OCc1ccc(F)cc1Cl,C20876266_decoy,TRY1,Decoy,0,-7.54273,-6.45,-1.81,-9.80896207056581
CCOc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccc(Cl)cc1Cl,C22937133_decoy,TRY1,Decoy,0,-8.83787,-6.4,-2.59,-7.154762471599943
C[C@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2Br)o1,C59634738_decoy,TRY1,Decoy,0,-8.02285,-4.62,-2.11,-5.098285947290163
COc1ccc2c(c1)=C(CCNC(=O)[C@H]1N[C@@H](CC3=c4ccccc4=[NH+]C3)NO1)C[NH+]=2,C63295333_decoy,TRY1,Decoy,0,-7.93751,-7.6,-1.85,-6.73222904902419
O=C(N/[NH+]=c1\oc2cc(O)ccc2cc1C1[NH+]=c2ccccc2=[NH+]1)c1ccc([N+](=O)[O-])cc1,C63406082_decoy,TRY1,Decoy,0,-7.9467,-10.55,-1.73,-9.690099896742254
N#CC1=C(SCC2[NH+]=c3ccccc3=[NH+]2)NS[C@H]1SCC1[NH+]=c2ccccc2=[NH+]1,C63514238_decoy,TRY1,Decoy,0,-8.86076,-5.64,-1.53,-6.119371996925182
Clc1ccc(N2[C@@H](c3cc[nH+]cc3)NN[C@H]2SCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63619717_decoy,TRY1,Decoy,0,-9.4841,-5.99,-1.14,-6.405632156058506
N#Cc1nc2c(nc1C#N)N(CCc1ccccc1)[C@@H]([NH3+])[C@@H]2C1[NH+]=c2ccccc2=[NH+]1,C63766860_decoy,TRY1,Decoy,0,-9.05452,-6.53,-1.37,-7.567309473378446
Cc1cc(NC(=O)CC2=[NH+][C@@H](C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)ON2)no1,C63796159_decoy,TRY1,Decoy,0,-8.54859,-7.24,-1.73,-5.9880987411611954
Cc1cccc(NC(=O)CS[C@@H]2N=N[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64428618_decoy,TRY1,Decoy,0,-7.40919,-9.0,-2.02,-7.559885014619502
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)[C@@H]1NC(c3ccc([NH+]4CCC(C)CC4)cc3)=NO1)[NH+]=2,C64519967_decoy,TRY1,Decoy,0,-8.035,-7.51,-1.92,-6.533334786399344
CCSC1(SCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccccc3)[NH2+]C(C)=C[C@]12C#N,C04199101_decoy,TRY1,Decoy,0,-6.61416,-5.89,-2.01,-5.870934971291163
CCSC1(SCC)[NH+]=C(N)[C@@]2(C#N)[C@H](c3ccccc3)[NH2+]C(C)=C(C)[C@]12C#N,C04328272_decoy,TRY1,Decoy,0,-7.00123,-4.11,-3.07,-4.263005910980667
CC1(C)Cc2c(c(N3CCOCC3)[nH+]c3sc4c(NCC[NH3+])ncnc4c23)CO1,C04488659_decoy,TRY1,Decoy,0,-10.1421,-4.79,-2.44,-5.715513582934847
COc1cc2[nH+]c3cc([N+](=O)[O-])ccc3c(NCC[NH2+]C[C@H](C)O)c2cc1OC,C04748026_decoy,TRY1,Decoy,0,-6.79817,-6.17,-2.21,-4.819746648979479
Nc1ccc2c(NCCCCCCNc3c4ccccc4[nH+]c4cc(N)ccc34)c3ccccc3[nH+]c2c1,C05370755_decoy,TRY1,Decoy,0,-9.53708,-11.5,-1.48,-9.710274067312458
CCSC1(SCC)[NH+]=C(N)[C@]2(C#N)[C@@H](c3ccccc3)[NH2+]C3=C(CCC3)[C@@]12C#N,C06576956_decoy,TRY1,Decoy,0,-7.9649,-5.07,-1.51,-5.206321550038725
CCCCSC1(SCCCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccccc3)[NH2+]C3=C(CCC3)[C@]12C#N,C09041041_decoy,TRY1,Decoy,0,-8.62085,-5.42,-2.21,-6.445369965942791
Nc1nc(C[NH+]2CCN(c3cccc[nH+]3)CC2)[nH]/c(=N\c2ccc(Cl)cc2)n1,C09317788_decoy,TRY1,Decoy,0,-8.84809,-6.38,-1.67,-5.244295812194532
CC1CC[NH+](Cc2nc(N3CC[NH2+][C@H](C(N)=O)C3)c3c4c(sc3n2)CCC4)CC1,C11174251_decoy,TRY1,Decoy,0,-10.0924,-6.61,-2.2,-5.774100237301201
C[NH+](C)CCOc1cccc(C[NH2+]C[C@H]2C[C@@H](CO)[NH+](C)[C@H]2c2ccccc2F)c1,C12430293_decoy,TRY1,Decoy,0,-8.16479,-5.05,-1.29,-5.391253059293483
O[C@H](COc1cccc(C[NH2+]CCc2cn[nH]c2)c1)C[NH+]1CCc2ccccc2C1,C12718779_decoy,TRY1,Decoy,0,-8.70875,-7.88,-1.35,-6.791714594834316
CCSC1(SCC)[NH+]=C(N)[C@]2(C#N)[C@H](c3ccccc3)[NH2+]C(C)=C[C@@]12C#N,C13154434_decoy,TRY1,Decoy,0,-8.01265,-4.17,-2.03,-5.201107143535094
OCC[NH2+]CCC[NH2+]Cc1cc(Br)ccc1OCc1ccccc1F,C13732920_decoy,TRY1,Decoy,0,-8.59573,-6.04,-2.28,-7.214903758446739
CCSC1(SCC)[NH+]=C(N)[C@]2(C#N)[C@H](c3ccccc3)[NH2+]C3=C(CCCC3)[C@@]12C#N,C13809964_decoy,TRY1,Decoy,0,-7.27815,-4.57,-2.14,-5.09679330287963
CCCCSC1(SCCCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccccc3)[NH2+]C(C)=C[C@@]12C#N,C08666538_decoy,TRY1,Decoy,0,-8.24447,-4.79,-2.02,-5.751615934946259
CCCCSC1(SCCCC)[NH+]=C(N)[C@]2(C#N)[C@@H](c3ccccc3)[NH2+]C(C)=C(C)[C@@]12C#N,C13146902_decoy,TRY1,Decoy,0,-6.8601,-5.3,-3.43,-5.402099039292116
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2cc(C#CCO)cs2)C[C@@]1(C)CO,C19790756_decoy,TRY1,Decoy,0,-10.8556,-5.02,-2.61,-6.797855088351242
CCCOc1c(Br)cc(C[NH2+]CCC[NH2+]CCO)cc1Br,C20967572_decoy,TRY1,Decoy,0,-7.57933,-4.11,-2.13,-4.637008296600495
C[NH+](C)CCCN(C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1)C1CC[NH+](C)CC1,C21264048_decoy,TRY1,Decoy,0,-8.1705,-5.23,-2.73,-6.196376421818377
CC1(C)[C@H]2CC[C@]1(C)[C@@H]([NH2+]C1=c3ccccc3=[NH+]C1=O)[C@@H]2NC1=c2ccccc2=[NH+]C1=O,C13404833_decoy,TRY1,Decoy,0,-6.81725,-9.1,-0.91,-8.020611820797727
O[C@H](C[NH2+]C1CCCCC1)CN1CCN(C[C@H](O)C[NH2+]C2CCCCC2)CC1,C20436810_decoy,TRY1,Decoy,0,-10.7661,-6.07,-1.69,-7.855151978186903
O[C@H](COc1ccccc1C[NH2+]CC1=C[C@@H](c2ccccc2)[NH+]=N1)C[NH+]1CCCCC1,C39354748_decoy,TRY1,Decoy,0,-8.10403,-7.75,-1.75,-8.810825236363696
CN(C[C@@H]1C=C(c2ccccc2)N=N1)C(=O)CN1N[NH2+]N[C@H]1C[NH+]1CCCCCC1,C39357991_decoy,TRY1,Decoy,0,-8.43461,-6.99,-1.51,-6.157838563755376
COc1cccc(C[NH2+]CCC[NH2+]CCO)c1OCc1c(Cl)cccc1Cl,C40720705_decoy,TRY1,Decoy,0,-9.08889,-5.33,-2.19,-6.523367342820277
CC(C)Oc1c(Br)cc(Br)cc1C[NH2+]CCC[NH2+]CCO,C40720726_decoy,TRY1,Decoy,0,-7.80417,-3.85,-3.75,-4.932741935822296
Cc1ccccc1COc1ccc(Br)cc1C[NH2+]CCC[NH2+]CCO,C40720818_decoy,TRY1,Decoy,0,-9.64239,-5.52,-0.88,-7.009067191173828
OCC[NH2+]CCC[NH2+]Cc1cc(Br)ccc1OCc1ccc(Cl)c(Cl)c1,C40720826_decoy,TRY1,Decoy,0,-9.17382,-4.61,-2.52,-5.621749573785534
C[C@@H]1C[NH2+]CCN1c1nc(Nc2cc[nH+]cc2)nc(NC2Cc3ccccc3C2)n1,C45300526_decoy,TRY1,Decoy,0,-8.62312,-6.77,-2.48,-6.425878362855105
C[C@H]1CN(c2nc(Nc3cc[nH+]cc3)nc(NC3Cc4ccccc4C3)n2)CC[NH2+]1,C45300774_decoy,TRY1,Decoy,0,-9.40646,-6.36,-1.74,-5.682256495343681
CC(=O)/[NH+]=c1/ccc2c(C[NH+](Cc3ccc(C(N)=O)cc3)C3CC3)cc(O)oc-2c1,C46569727_decoy,TRY1,Decoy,0,-6.96193,-8.05,-3.64,-6.992745997678562
Fc1ccc(-c2[nH]c(C3CC[NH+](C[C@@H]4C[NH2+]CCN4)CC3)cc2-c2ccncc2)cc1,C29125961_decoy,TRY1,Decoy,0,-8.66103,-8.33,-1.48,-7.437989472976618
O[C@@H](COc1cccc(C[NH2+]CC[NH+]2CCCC2)c1)C[NH+]1CCc2ccccc2C1,C20779379_decoy,TRY1,Decoy,0,-9.09289,-5.83,-1.37,-5.56622552577875
C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]CC[NH+]2CCCC2)cc1,C23374733_decoy,TRY1,Decoy,0,-8.06483,-7.01,-4.18,-5.772477015114808
CC1(C)CC(NC[NH+](C2CC(C)(C)[NH2+]C(C)(C)C2)C2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C19330112_decoy,TRY1,Decoy,0,-9.90445,-5.44,-2.33,-6.024320652273408
OCC[NH2+]CC[NH2+]Cc1c(OCc2ccc(Cl)cc2Cl)ccc2ccccc12,C23469469_decoy,TRY1,Decoy,0,-6.86883,-6.27,-3.96,-6.798976499424969
C[C@@H](O)C[NH2+]CC[NH2+]Cc1cc(Br)ccc1OCc1ccc(Cl)cc1Cl,C23469527_decoy,TRY1,Decoy,0,-9.16339,-4.84,-4.72,-5.59457293465336
CCOc1cc(C[NH2+]CC[NH2+]CCO)cc(Cl)c1OCc1ccc(Cl)cc1Cl,C23471945_decoy,TRY1,Decoy,0,-7.9593,-5.4,-2.3,-5.335161768212942
CCOc1cc(C[NH2+]CC[NH2+]CCO)cc(Br)c1OCc1ccc(C)cc1,C20874770_decoy,TRY1,Decoy,0,-8.16266,-4.96,-4.5,-5.27538634148423
C[NH+]1CCC(C[NH+](C)[C@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C63120173_decoy,TRY1,Decoy,0,-9.20935,-4.72,-1.57,-5.942841761889947
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@H]1N[C@@H](CC2=c3ccccc3=[NH+]C2)NO1,C63294745_decoy,TRY1,Decoy,0,-8.32549,-8.44,-0.95,-6.424265383046932
COc1cccc2cc(C3[NH+]=c4ccccc4=[NH+]3)/c(=[NH+]/[C@@H]3SC4=C(CCCC4)[C@H]3C(N)=O)oc12,C63406115_decoy,TRY1,Decoy,0,-9.6575,-6.51,-1.88,-6.792966146187678
O=C([O-])c1ccc2c(c1)=[NH+][C@@H](c1cccc([C@@H]3[NH+]=c4ccc(C(=O)O)cc4=[NH+]3)c1)[NH+]=2,C39279764_decoy,TRY1,Decoy,0,-8.494,-6.38,-2.12,-5.996472352736407
Clc1ccc(N2[C@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]2c2cc[nH+]cc2)cc1,C63619721_decoy,TRY1,Decoy,0,-8.71406,-7.93,-1.93,-10.242871193672867
CCc1ccccc1NC(=O)CS[C@H]1N=N[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684149_decoy,TRY1,Decoy,0,-10.0161,-8.22,-1.86,-8.497413495146107
Cc1ccc(C)c(NC(=O)CS[C@@H]2N=N[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1,C63720162_decoy,TRY1,Decoy,0,-9.89958,-9.14,-2.32,-8.582839416768614
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2c(F)cccc2Cl)O1,C63720227_decoy,TRY1,Decoy,0,-7.14899,-5.89,-3.76,-4.974421497844334
Oc1ccc([C@H]2Nc3ccccc3S2)cc1C[NH2+]CCC1=c2ccccc2=[NH+]C1,C64083874_decoy,TRY1,Decoy,0,-7.0885,-8.43,-1.02,-5.6625317737920025
Cc1cccc(NC(=O)CS[C@@H]2N=N[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64428623_decoy,TRY1,Decoy,0,-8.20082,-7.54,-3.09,-6.173655508923361
CC1CC[NH+](c2ccc(C3=NO[C@H](C(=O)NCCC4[NH+]=c5ccccc5=[NH+]4)N3)cc2)CC1,C64451915_decoy,TRY1,Decoy,0,-7.75275,-9.71,-1.33,-7.076487098806563
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)[C@H]1NC(c3ccc([NH+]4CCC(C)CC4)cc3)=NO1)[NH+]=2,C64519973_decoy,TRY1,Decoy,0,-8.43666,-9.13,-2.13,-6.837225948741791
COCC1=C(C#N)[C@@H](SS[C@H]2[NH2+]C(C)=CC(COC)=C2C#N)[NH2+]C(C)=C1,C03085641_decoy,TRY1,Decoy,0,-9.00265,-6.09,-3.61,-5.936644561214845
Cn1c(=O)n(C)c2cc(C[NH2+]CCNc3cc[nH+]c4cc(Cl)ccc34)ccc21,C04993718_decoy,TRY1,Decoy,0,-8.47517,-7.01,-1.71,-5.875809070680319
CC1(C)CC([NH2+]C[C@H](O)COC(c2ccccc2)c2ccccc2)CC(C)(C)[NH2+]1,C05602867_decoy,TRY1,Decoy,0,-7.43773,-6.51,-2.84,-6.223477269831535
CC[NH+](CC)CCCNc1[nH+]cc(C)c2c1c1ccc3c(O)cccc3c1n2C,C01633630_decoy,TRY1,Decoy,0,-8.71319,-5.71,-3.08,-5.356832383484795
COc1cccc(OC)c1C[NH2+]C[C@H]1C[C@@H](CO)[NH+](C)[C@H]1c1ccccc1F,C11842979_decoy,TRY1,Decoy,0,-6.76135,-5.79,-2.95,-4.597888447212963
O[C@H](COc1ccc(C[NH2+]C2CCCCC2)cc1)C[NH+]1CCc2ccccc2C1,C11945365_decoy,TRY1,Decoy,0,-8.361,-6.92,-0.9,-5.56222544673407
CC1(C[NH2+]Cc2cc(Cl)ccc2OC[C@H](O)C[NH+]2CCCCCC2)COC1,C12075381_decoy,TRY1,Decoy,0,-8.88589,-5.83,-0.87,-6.18938182153584
O[C@H](COc1ccccc1C[NH2+]Cc1ccccc1Cl)C[NH+]1CCCCC1,C12755120_decoy,TRY1,Decoy,0,-7.65688,-6.31,-1.44,-5.4305343589049375
CC(C)(C)c1n[nH]cc1C[NH+]1CCC(O)(C[NH+]2CCc3ccccc3C2)CC1,C19083479_decoy,TRY1,Decoy,0,-8.29926,-6.23,-2.18,-5.747115641613826
C[NH+]1[C@H](CO)C[C@H](C[NH2+]CC(C)(C)CN2CCOCC2)[C@@H]1c1ccccc1F,C19218014_decoy,TRY1,Decoy,0,-7.1779,-4.92,-1.37,-5.203920351310646
CC(C)[NH+]1CCC(N2CC[NH+](Cc3c[nH]nc3C3CCCCC3)C[C@@H]2CCO)CC1,C19635328_decoy,TRY1,Decoy,0,-9.28796,-5.61,-2.11,-6.019848629473456
Cc1nn(C(C)C)c(C)c1C[NH2+]C[C@H]1C[C@@H](CO)[NH+](C)[C@H]1c1ccccc1F,C20209178_decoy,TRY1,Decoy,0,-7.60027,-5.4,-2.74,-5.551102826579502
C[NH+]1[C@H](CO)C[C@H](C[NH2+]Cc2ccc(-c3ccco3)cc2)[C@@H]1c1ccccc1F,C20865607_decoy,TRY1,Decoy,0,-7.8663,-5.36,-0.47,-4.89172359697926
CCc1cccc2c(C[NH2+]C[C@H](c3cccs3)N3CC[NH+](C)CC3)c[nH]c12,C22809905_decoy,TRY1,Decoy,0,-8.77293,-6.55,-2.11,-5.60783324596591
Cc1c(O)ccc2c(C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)cc(=O)oc12,C25702461_decoy,TRY1,Decoy,0,-8.56047,-7.42,-3.5,-7.06533997485024
COc1ccc([C@H]2[NH+]=NC(NCCc3c[nH]c4ccc(Cl)cc34)=[NH+]C2=O)cc1,C39154789_decoy,TRY1,Decoy,0,-8.99642,-8.24,-1.96,-7.659817115048233
CCc1ccc2c(c1)=C1N=NC(N/N=C/c3cc(Cl)cc(OC)c3O)=[NH+][C@@H]1[NH+]=2,C39253037_decoy,TRY1,Decoy,0,-8.55253,-5.95,-1.74,-5.18315091045424
Oc1ccccc1C=[NH+]CCN(CC/[NH+]=C/c1ccccc1O)c1ccccc1,C18066205_decoy,TRY1,Decoy,0,-8.46163,-8.13,-4.29,-6.522059280039085
CC1(C)CC([NH2+]C[C@H](O)COc2ccc(-c3ccccc3)cc2)CC(C)(C)[NH2+]1,C04744797_decoy,TRY1,Decoy,0,-8.29178,-7.44,-2.06,-6.018957196283172
[NH3+][C@H](COc1cncc(-c2cccc3cnccc23)c1)CC1=c2ccccc2=[NH+]C1,C52566137_decoy,TRY1,Decoy,0,-8.83483,-8.85,-1.74,-7.483622061782485
C[NH+](C)[C@@H](CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)c1ccc(F)cc1,C56937859_decoy,TRY1,Decoy,0,-8.13785,-6.97,-0.82,-5.886360144094446
C[C@@H](CNC(=O)Nc1ccc(N2CCCCC2)[nH+]c1)[NH+]1CCc2sccc2C1,C58329244_decoy,TRY1,Decoy,0,-10.3247,-6.51,-1.81,-5.883216936722215
O[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)C[NH+]1CCCC1,C44344845_decoy,TRY1,Decoy,0,-7.79585,-6.47,-2.5,-6.2604492923108
CCOc1ccc2c(c1)S[C@@H](NC(=O)CSC1[NH+]=c3ccccc3=[NH+]1)N2,C63075045_decoy,TRY1,Decoy,0,-7.75938,-7.38,-1.42,-6.754881351528473
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)N[C@H]1Nc3c(C)cccc3S1)[NH+]=2,C63075064_decoy,TRY1,Decoy,0,-8.1858,-7.18,-2.25,-6.501782441477302
COc1ccc2c(c1)=[NH+][C@@H](SCC(=O)N[C@H]1Nc3c(C)cccc3S1)[NH+]=2,C63075068_decoy,TRY1,Decoy,0,-7.12386,-7.46,-1.34,-6.241322908461274
Cc1cccc2c1N[C@H](NC(=O)CS[C@@H]1[NH+]=c3ccc([N+](=O)[O-])cc3=[NH+]1)S2,C63075097_decoy,TRY1,Decoy,0,-6.37,-7.38,-2.03,-5.003446968220664
c1coc(CN2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]2c2cccs2)c1,C63162908_decoy,TRY1,Decoy,0,-8.006,-5.53,-1.74,-4.9701732139102655
C=CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccc(Cl)cc1,C63162959_decoy,TRY1,Decoy,0,-8.63113,-5.55,-1.14,-5.38640967840561
Cc1ccc(C(=O)NC(=S)Nc2ccc(C3[NH+]=c4ccccc4=[NH+]3)cc2)c(C)c1,C63233092_decoy,TRY1,Decoy,0,-7.07731,-8.26,-1.8,-5.249119932583154
C[NH+](C)CCCNC(=O)CNC(=O)N1CCC2=c3cc(Cl)ccc3=[NH+][C@@H]2C1,C63303090_decoy,TRY1,Decoy,0,-8.65699,-7.12,-2.85,-6.439144990646579
c1ccc([C@@H]2NN[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2c2ccccc2)cc1,C63446531_decoy,TRY1,Decoy,0,-6.55851,-8.15,-0.96,-8.76773861019682
O=C(COc1ccc(Cl)cc1)NNC(=O)CSC1[NH+]=c2ccccc2=[NH+]1,C63465086_decoy,TRY1,Decoy,0,-7.8287,-7.14,-1.78,-6.468818001985913
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](NCCCOC(C)C)N3N2)[C@H](C)N=N1,C63494670_decoy,TRY1,Decoy,0,-8.57112,-7.59,-1.87,-7.758570886676243
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](NCCCOC(C)C)N3N2)[C@H](C)N=N1,C63494674_decoy,TRY1,Decoy,0,-9.39176,-7.4,-1.57,-9.6216789054902
CCc1ccc2c(c1)=C1N=[NH+]C(N/N=C/c3cc(Cl)cc(OC)c3O)=N[C@H]1[NH+]=2,C39253038_decoy,TRY1,Decoy,0,-9.35519,-6.39,-1.62,-5.395235992124882
CCC(=O)N[C@H]1Nc2cc(NC(=O)CCC3[NH+]=c4ccccc4=[NH+]3)ccc2S1,C63625138_decoy,TRY1,Decoy,0,-8.98691,-7.24,-1.22,-6.1884658938949695
Cc1ccc2c(c1)S[C@H](NC(=O)CS[C@H]1[NH+]=c3ccc([N+](=O)[O-])cc3=[NH+]1)N2,C63625970_decoy,TRY1,Decoy,0,-6.80938,-6.43,-1.52,-5.506283860541625
COc1ccc([C@H]2[NH2+]CCc3[nH]cnc32)cc1CSC1=[NH+][C@H]2CCCC[C@@H]2N1,C20353479_decoy,TRY1,Decoy,0,-8.78316,-7.13,-2.86,-5.596198257335495
C[C@@H]1C([C@@H](C)NC[C@@H]2[NH+]=c3ccc(F)cc3=[NH+]2)=CNN1c1ccc(F)cc1F,C64074502_decoy,TRY1,Decoy,0,-9.34511,-6.33,-3.54,-6.447189374551655
CC1=[NH+][C@@H](CCCC(=O)Nc2nc(C3=c4ccccc4=[NH+][C@H]3C)cs2)ON1,C64085810_decoy,TRY1,Decoy,0,-8.18606,-6.81,-2.24,-6.916905880649197
O=C(CS[C@@H]1[NH+]=c2ccc([N+](=O)[O-])cc2=[NH+]1)N[C@H]1Nc2ccccc2S1,C64097986_decoy,TRY1,Decoy,0,-7.1255,-5.23,-1.57,-4.672199243306407
CCN(CC)c1ccc(/C=N/NC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)c(O)c1,C64162135_decoy,TRY1,Decoy,0,-8.28513,-6.17,-1.51,-5.7595626252357714
Cc1ccc2c(c1)=[NH+][C@H](CNc1ccc([C@H]3NC(c4ccccc4)=NO3)nn1)[NH+]=2,C64612602_decoy,TRY1,Decoy,0,-8.68539,-10.03,-2.84,-7.262259644958736
C[C@H]([NH2+]C[C@H](C1=c2ccccc2=[NH+]C1)[C@@H]1CC=CS1)C(=O)Nc1ccccc1,C64715620_decoy,TRY1,Decoy,0,-7.75141,-6.06,-1.99,-5.4027184882144415
CCNC(=O)[C@H]1CC[C@@](C)(C(=O)NCC[C@H]2[NH+]=c3cccc(C)c3=[NH+]2)C1(C)C,C65434673_decoy,TRY1,Decoy,0,-7.67785,-6.05,-1.94,-5.223300155778131
CC1CC[NH+](C[C@@H](O)C[NH2+]CC2=Cc3cc(Br)ccc3OC2)CC1,C67122369_decoy,TRY1,Decoy,0,-8.15959,-7.04,-2.42,-5.354259734031289
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CC1,C67122402_decoy,TRY1,Decoy,0,-7.59986,-6.6,-2.55,-5.116592260216359
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122507_decoy,TRY1,Decoy,0,-8.03271,-7.32,-3.17,-5.664871833630204
CC(C)[NH+](C)Cc1ccccc1C[NH2+]Cc1c[nH]nc1-c1cc2ccccc2o1,C67188119_decoy,TRY1,Decoy,0,-6.82683,-7.38,-2.86,-7.03413074125108
C[NH+](C)Cc1ccc(C[NH2+]C[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1,C08428555_decoy,TRY1,Decoy,0,-7.64194,-7.76,-1.79,-9.260374309727917
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCOCC1)Nc1ccc(F)cc1F,C08635804_decoy,TRY1,Decoy,0,-8.44892,-5.71,-3.43,-5.348559536732886
CC[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=O)C(=O)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CC,C08635820_decoy,TRY1,Decoy,0,-8.92003,-6.55,-3.14,-6.634570316480347
CCOc1cc(C[NH2+]CC2CC[NH2+]CC2)cc(Br)c1OCC,C10434685_decoy,TRY1,Decoy,0,-8.38975,-5.13,-1.63,-5.423507807729655
CC(C)=CC[NH+]1CCNC(=O)[C@H]1CC(=O)N(C)C1CC(C)(C)[NH2+]C(C)(C)C1,C12713732_decoy,TRY1,Decoy,0,-8.93444,-6.63,-4.19,-6.075997482880141
C[NH+](C)CC(C)(C)CNC(=O)C[C@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1,C14953372_decoy,TRY1,Decoy,0,-7.76671,-6.18,-1.37,-6.102564376261869
O[C@@H](COc1ccc(C[NH2+]C2CCOCC2)cc1)C[NH+]1CCc2ccccc2C1,C20207660_decoy,TRY1,Decoy,0,-8.29524,-7.56,-2.61,-6.417316425179014
C[NH+]1[C@H](CO)C[C@H](C[NH2+]Cc2ccc(-n3cccn3)cc2)[C@@H]1c1ccccc1F,C20454887_decoy,TRY1,Decoy,0,-7.46696,-5.97,-2.76,-4.861113526724868
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2cccnc2)C[C@@]1(C)CO,C20560774_decoy,TRY1,Decoy,0,-7.28169,-7.06,-1.46,-7.944235171404931
C=CCn1cc(C[NH2+]C[C@H]2C[C@@](C)(CO)[NH+](CC)[C@H]2c2ccc(Cl)cc2)c(C)n1,C20866423_decoy,TRY1,Decoy,0,-7.77843,-5.43,-3.32,-5.533343465413304
OCC[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2Cl)o1,C20875697_decoy,TRY1,Decoy,0,-9.40966,-5.82,-3.85,-7.432613043010208
CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(=O)oc2c(C)c(O)ccc12,C25702862_decoy,TRY1,Decoy,0,-7.95901,-6.33,-2.32,-8.415777248833676
C[C@H]([NH2+]C1CC[NH+](CC(N)=O)CC1)c1ccc(I)cc1,C37318492_decoy,TRY1,Decoy,0,-8.12051,-4.32,-0.49,-4.436811067727574
Cc1cc(N2CCOCC2)[nH+]c2ccc(NC(=S)NCC[NH+](C)C)cc12,C04969808_decoy,TRY1,Decoy,0,-7.4719,-5.48,-1.65,-4.922131212209379
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1NCCO)c1cccc(Cl)c1,C39012381_decoy,TRY1,Decoy,0,-8.5478,-7.69,-1.53,-8.969677766378066
O=C1[NH+]=C(Nc2ccc(Nc3ccccc3)cc2)N=[NH+][C@@H]1c1ccc(F)cc1,C39143870_decoy,TRY1,Decoy,0,-7.30007,-7.49,-0.05,-9.56607315101944
CNC(=O)c1nn(C)c2c1C[C@H]([NH2+]CC1([NH+]3CCCCC3)CCCC1)CC2,C32500572_decoy,TRY1,Decoy,0,-8.86655,-6.15,-1.88,-5.995705466237504
Cc1cc2c(C)nc(N3CCC([NH2+]CC[NH+]4CCC[C@@H](O)C4)CC3)nc2cc1F,C32519487_decoy,TRY1,Decoy,0,-8.79906,-8.15,-2.63,-6.341992756980037
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](CC)CC(=O)NC(C)C,C43262303_decoy,TRY1,Decoy,0,-7.95123,-4.12,-1.33,-5.27120640304747
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](CC)CC(=O)NC(C)C,C43287069_decoy,TRY1,Decoy,0,-8.15215,-3.74,-1.01,-5.221472402511216
S=C(NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCCCC1)Nc1ccc(-n2cccn2)cc1,C43527082_decoy,TRY1,Decoy,0,-8.56383,-6.83,-1.99,-6.004108273231427
O=C(NCC[NH+]1CCCCC1)[C@@H]1CSC[C@H](c2ccc(F)c(F)c2)[NH2+]1,C44166060_decoy,TRY1,Decoy,0,-9.15387,-6.2,-1.62,-5.698280264214158
CC1CC[NH+]([C@@H](CNC(=O)N[C@@H](C)Cn2cc[nH+]c2)c2cccs2)CC1,C47921112_decoy,TRY1,Decoy,0,-8.8266,-5.08,-3.67,-5.179674226290885
CC[NH+](CC)[C@@H](CNC(=O)N[C@@H](C)Cn1cc[nH+]c1)c1ccccc1Cl,C47927283_decoy,TRY1,Decoy,0,-6.84236,-4.86,-2.99,-4.9923902805542255
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)NC[C@@H](c1ccco1)[NH+]1CCCC1,C48230026_decoy,TRY1,Decoy,0,-8.37017,-7.19,-2.01,-6.483412465547165
O[C@H](CC[NH+]1CCCCCC1)c1ccc([C@@H](O)CC[NH+]2CCCCCC2)cc1,C04729704_decoy,TRY1,Decoy,0,-9.3255,-7.03,-1.34,-6.798997670589349
[NH3+][C@H](COc1cncc(-c2ccccc2-c2ccncc2)c1)CC1=c2ccccc2=[NH+]C1,C52627765_decoy,TRY1,Decoy,0,-8.7972,-7.73,-3.31,-6.490891922998707
N#Cc1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627770_decoy,TRY1,Decoy,0,-8.48282,-8.01,-3.23,-6.670847471727327
COc1ccc([C@H]2[NH2+]CC[C@H]3[NH+]=CN[C@@H]23)cc1CSc1nc2ccccc2[nH]1,C50806626_decoy,TRY1,Decoy,0,-9.3287,-5.92,-2.49,-5.984529555578509
COc1ccccc1[C@@H](CNC(=O)N[C@@H](C)Cn1cc[nH+]c1)[NH+]1CCCCC1,C56932202_decoy,TRY1,Decoy,0,-9.24964,-3.98,-3.01,-6.431195320122548
CN(C)c1[nH+]cccc1CNC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1,C47950795_decoy,TRY1,Decoy,0,-7.80257,-6.12,-2.51,-5.746936103176206
CC(=O)Nc1ccc(NC(=O)CS[C@@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)cc1,C63303361_decoy,TRY1,Decoy,0,-8.36261,-7.87,-2.5,-6.311249069359143
C[C@H](CC1=c2ccccc2=[NH+]C1)[NH2+]C[C@@H](O)COc1ccc([N+](=O)[O-])cc1,C63426887_decoy,TRY1,Decoy,0,-6.95252,-7.04,-3.13,-5.39874526832822
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)N[C@H]1Nc3ccccc3S1)[NH+]=2,C63446524_decoy,TRY1,Decoy,0,-8.64053,-7.36,-2.63,-6.851828043219566
CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccccc1OC,C63448354_decoy,TRY1,Decoy,0,-8.06747,-7.06,-1.75,-7.806541955318011
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](NCCC(C)C)N3N2)[C@H](C)N=N1,C63494664_decoy,TRY1,Decoy,0,-8.46694,-6.11,-1.11,-5.472048385644173
O=C(NCC1[NH+]=c2ccccc2=[NH+]1)[C@H]1NC(c2ccc(C(F)(F)F)cc2)=NO1,C63526366_decoy,TRY1,Decoy,0,-6.7742,-7.06,-1.38,-4.93950219381249
COc1ccc2c(c1)=[NH+][C@H](CCNC(=O)c1ccc3c(c1)N[C@@H](C(C)C)O3)[NH+]=2,C64137364_decoy,TRY1,Decoy,0,-8.33978,-7.09,-2.09,-6.163655607635565
Cc1ccc([C@H](CNC(=O)NCc2ccc[nH+]c2N(C)C)[NH+]2CCCC2)cc1,C64237199_decoy,TRY1,Decoy,0,-8.57199,-7.72,-1.95,-9.008592944096574
C[C@@H](CNC(=O)NC1CC[NH+](CC(F)F)CC1)[NH+]1CCc2ccccc2C1,C64254987_decoy,TRY1,Decoy,0,-8.25605,-6.12,-2.18,-5.425944796587148
CC1CC[NH+]([C@H](CNC(=O)NC2CC[NH+](CC(F)F)CC2)C(C)C)CC1,C64255292_decoy,TRY1,Decoy,0,-8.20177,-4.88,-2.06,-4.7866517216164
CC[NH+]1CCN(c2cc(CNC(=O)Nc3ccc4nc(C)oc4c3)cc[nH+]2)CC1,C64697163_decoy,TRY1,Decoy,0,-9.06957,-7.87,-1.22,-6.846097222342708
CCOc1ccc(CC(=O)N[C@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc1OCC,C65305768_decoy,TRY1,Decoy,0,-7.61716,-7.51,-2.06,-7.231108177370898
c1ccc([C@@H]2NCN(C[C@@H](c3ccco3)[NH+]3CCCC3)[C@@H]2c2[nH]cc[nH+]2)cc1,C65371746_decoy,TRY1,Decoy,0,-7.43356,-5.28,-2.15,-4.582239718340706
C=CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@H]1c1ccc(OC)cc1,C65550472_decoy,TRY1,Decoy,0,-7.8037,-4.57,-1.8,-4.550080545128941
C[NH+](CC(=O)Nc1cc(F)cc(F)c1)CC(=O)NC1CC[NH+](C2CC2)CC1,C66836230_decoy,TRY1,Decoy,0,-8.09773,-5.42,-1.14,-5.547785536574319
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2cn(-c3ccccc3)nc2C(C)C)CC1,C67122087_decoy,TRY1,Decoy,0,-7.98224,-6.66,-1.36,-5.743217959193492
Cc1nn(-c2ccc(F)cc2)c(C)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122239_decoy,TRY1,Decoy,0,-8.05826,-7.44,-2.11,-6.714190502654822
Cc1nn(-c2ccccc2)c(Cl)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122345_decoy,TRY1,Decoy,0,-8.01155,-7.08,-3.27,-6.34218651062409
Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]C[C@H](O)C[NH+]1CCC(C)CC1,C67122458_decoy,TRY1,Decoy,0,-8.72685,-6.16,-2.81,-5.60226887426288
O=c1[nH]c(=O)n(-c2ccccc2F)c(O)c1[C@@H]1[NH2+]CCc2c1[nH]c1ccccc21,C04063080_decoy,TRY1,Decoy,0,-7.24482,-6.82,-1.86,-4.954035886677487
COc1cc([C@@H]2[NH2+]CCc3cc(O)c(O)cc32)cc(I)c1O,C04724948_decoy,TRY1,Decoy,0,-9.08437,-1.54,-2.15,-3.341715515222974
O=c1[nH]c(=O)n(-c2ccccc2)c(O)c1[C@H]1[NH2+]CCc2c1[nH]c1ccccc21,C06344856_decoy,TRY1,Decoy,0,-6.01716,-6.05,-2.51,-4.268305014621714
Cc1ccc2c(c1)/C(=N/NC(=O)c1[nH+]c(Cl)c(Cl)c(N)c1Cl)C(O)=N2,C07985400_decoy,TRY1,Decoy,0,-10.3063,-6.42,-1.43,-8.153133180209105
COc1cc([C@H]2NC(=[NH2+])Nc3nc4ccccc4n32)cc(Br)c1O,C08574787_decoy,TRY1,Decoy,0,-8.55909,-7.56,-3.79,-7.689676225382729
Cc1ccc(-n2c(O)nc(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)c(C)c1,C08768471_decoy,TRY1,Decoy,0,-8.22495,-6.99,-0.32,-5.6031500363729
CC(C)n1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09331098_decoy,TRY1,Decoy,0,-6.91516,-5.34,-2.22,-4.02092659654236
Cc1ccc(-n2c(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c(=O)[nH]c2=S)c(C)c1,C05625954_decoy,TRY1,Decoy,0,-6.37428,-7.64,-1.8,-4.433313368407721
O=c1[nH]c(=S)n(-c2ccccc2F)c(O)c1[C@@H]1[NH2+]CCc2c1[nH]c1ccccc21,C05807421_decoy,TRY1,Decoy,0,-7.21748,-7.28,-1.19,-5.207988821239263
CC1CCN(c2[nH+]c3sc(C(N)=O)c(N)c3c3c2CCCC3)CC1,C13628531_decoy,TRY1,Decoy,0,-9.24553,-7.11,-0.22,-8.461655504409226
CCCn1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09109279_decoy,TRY1,Decoy,0,-7.26497,-5.67,-0.75,-4.614806682504531
Cc1ccccc1-n1c(O)nc(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09357434_decoy,TRY1,Decoy,0,-7.39954,-8.46,-2.21,-7.12956545698723
Cc1ccccc1-n1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09357429_decoy,TRY1,Decoy,0,-7.06814,-7.05,-2.97,-4.804715632690095
Cc1cc(C)c(-n2c(O)nc(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)c(C)c1,C09087674_decoy,TRY1,Decoy,0,-6.4055,-6.61,-3.93,-4.320774838618054
Cc1cc(C)c(-n2c(O)nc(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)c(C)c1,C09087673_decoy,TRY1,Decoy,0,-6.92164,-7.0,-1.51,-4.8488114251348575
[NH3+][C@@H](c1cccc(I)c1)c1ccc2[nH]c(=O)[nH]c2c1,C20480597_decoy,TRY1,Decoy,0,-6.79464,-6.3,-1.49,-4.395987599247483
Oc1ccc(Cl)cc1C1=NC2(CC[NH2+]CC2)N[C@H](c2ccccc2O)C1,C15830200_decoy,TRY1,Decoy,0,-8.49985,-5.98,-1.32,-4.901701538338477
CC(C)(C)c1[nH+]n(C(C)(C)C)c(N)c1NC(=O)NC[C@H]1CCCO1,C35932573_decoy,TRY1,Decoy,0,-7.17089,-5.56,-0.87,-5.306878159714059
Cc1ccc(-c2[nH+]c3sc(C(N)=O)c(N)c3c3c2CCCC3)cc1,C00521607_decoy,TRY1,Decoy,0,-8.71001,-8.26,-0.39,-13.679543179961817
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39467107_decoy,TRY1,Decoy,0,-7.21587,-7.17,-2.49,-4.581714349315378
Cc1cc(Nc2[nH+]cnc(NC34CC5CC(CC(C5)C3)C4)c2N)no1,C40680935_decoy,TRY1,Decoy,0,-7.78989,-5.76,-3.2,-5.873145254410219
Cc1cc(C)cc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)c1,C40681914_decoy,TRY1,Decoy,0,-7.78184,-7.06,-1.07,-7.547762393682637
Cc1ccc2cccc(Nc3ncnc(Nc4cc[nH+]cc4)c3N)c2n1,C40687567_decoy,TRY1,Decoy,0,-7.35902,-7.72,-0.36,-7.017643218200742
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1cc(Cl)ccc1Cl,C40687582_decoy,TRY1,Decoy,0,-7.87815,-7.4,-1.75,-7.166293409139825
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1ccc(Cl)cc1Cl,C40687610_decoy,TRY1,Decoy,0,-8.33491,-7.22,-1.11,-10.09898332122087
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1ccc(C(F)(F)F)cc1,C40687670_decoy,TRY1,Decoy,0,-5.84721,-5.91,-0.78,-4.316174439491121
CC(C)c1ccc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)cc1,C40706083_decoy,TRY1,Decoy,0,-6.89168,-7.14,-0.75,-5.489066325762638
Cc1ccc2c(Nc3ncnc(NC4CCCCC4)c3N)cccc2[nH+]1,C40708798_decoy,TRY1,Decoy,0,-8.62421,-7.77,-3.07,-9.26949565315637
Cc1ccc2c(Nc3ncnc(Nc4ccccc4F)c3N)cccc2[nH+]1,C40759364_decoy,TRY1,Decoy,0,-7.90408,-7.63,-2.05,-6.384493542789423
CC1(C)CC(Nc2ncnc(Oc3ccccc3)c2N)CC(C)(C)[NH2+]1,C40760848_decoy,TRY1,Decoy,0,-6.6204,-4.93,-1.73,-4.073767104336042
CC1(C)CC(Nc2ncnc(OC3CCCCC3)c2N)CC(C)(C)[NH2+]1,C40760951_decoy,TRY1,Decoy,0,-8.34763,-7.32,-0.85,-5.5001792157649545
Cc1cc(C)n(-c2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)n1,C40760972_decoy,TRY1,Decoy,0,-6.82124,-6.24,-1.77,-4.751549149351604
Nc1c(NC2CCCC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40778002_decoy,TRY1,Decoy,0,-7.71882,-6.56,-1.05,-5.698963525155896
Cc1ccc2c(Nc3ncnc(Nc4ccccc4)c3N)cccc2[nH+]1,C40781148_decoy,TRY1,Decoy,0,-8.35701,-7.82,0.19,-9.374855494774314
Cc1ccc2c(Nc3ncnc(Nc4ccc(F)cc4)c3N)cccc2[nH+]1,C40782543_decoy,TRY1,Decoy,0,-8.57323,-7.71,0.27,-6.748829917163588
Cc1[nH]c(Nc2ccc(Br)cc2Br)c(N)[nH+]1,C42873112_decoy,TRY1,Decoy,0,-9.33656,-3.81,-0.01,-4.602903286748564
Cc1c(Cl)cccc1NNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C42909054_decoy,TRY1,Decoy,0,-9.26959,-5.35,-0.95,-4.91823699565936
Cc1cc(Br)ccc1[C@@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094242_decoy,TRY1,Decoy,0,-7.10331,-5.46,-1.69,-3.78342988015592
Cc1ccc([C@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)cc1C,C52094279_decoy,TRY1,Decoy,0,-7.63529,-5.59,-2.87,-4.272203753927241
CCCC[C@H](CC)[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094328_decoy,TRY1,Decoy,0,-7.64724,-4.23,-0.8,-5.315153300079532
Cc1cccc([C@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)c1C,C52094379_decoy,TRY1,Decoy,0,-8.33544,-5.14,-3.39,-4.492724132697485
[NH3+][C@@H](c1ccc(F)c(F)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094435_decoy,TRY1,Decoy,0,-7.53393,-5.37,-1.69,-4.263755397503226
Nc1c(-c2ccc(F)c(Br)c2)[nH+]c(C2CCCC2)n1N,C52839529_decoy,TRY1,Decoy,0,-7.58369,-5.1,-2.08,-3.899464018123535
Nc1c(-c2cc(Br)ccc2F)[nH+]c(C2CCCC2)n1N,C52839565_decoy,TRY1,Decoy,0,-8.16302,-5.95,-1.89,-4.288119905242105
Nc1c(-c2ccc(Br)cc2F)[nH+]c(C2CCCC2)n1N,C52839583_decoy,TRY1,Decoy,0,-8.30798,-5.98,-1.8,-4.417815171418818
[NH3+][C@@H](c1cc2[nH]c(=O)[nH]c2cc1Br)C1CCCCCC1,C53714469_decoy,TRY1,Decoy,0,-8.75225,-5.14,-0.69,-4.696093831962155
[NH3+][C@H](c1ccc(Br)cn1)c1cc2[nH]c(=O)[nH]c2cc1Br,C61862778_decoy,TRY1,Decoy,0,-8.74426,-5.57,-0.61,-4.891365506508951
NC1=[NH+][C@H](c2cn[nH]c2-c2cccc(F)c2)N2C(=N1)Nc1ccccc12,C18126771_decoy,TRY1,Decoy,0,-7.40559,-4.93,-1.01,-4.759198594277413
NC1=[NH+][C@@H](c2cn[nH]c2-c2cccc(F)c2)N2C(=N1)Nc1ccccc12,C18099607_decoy,TRY1,Decoy,0,-7.75556,-5.98,-0.94,-5.250956026499573
Cc1cc([C@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)ccc1F,C63056041_decoy,TRY1,Decoy,0,-7.5581,-6.45,-1.2,-4.687451980567786
CC[C@H](NC(=O)C1=C[C@@H](N(NC(=O)OC(C)C)C(=O)OC(C)C)[C@H](O)[C@H](O)C1)C(N)=O,C04200755_decoy,TRY1,Decoy,0,-8.87797,-6.07,-3.52,-6.855432695782018
COc1cc(SC)ccc1C(=O)N[C@H]1C[C@@](O)(C(=O)N[C@@H](Cc2cccs2)C(N)=O)C[C@@H](O)[C@@H]1O,C04221841_decoy,TRY1,Decoy,0,-11.0575,-6.82,-2.33,-7.972368990311874
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]3CC(=O)NCCNC(C)=O)cc1,C04222264_decoy,TRY1,Decoy,0,-11.6545,-8.72,-2.59,-8.462598045916312
CC(C)C[C@@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06134982_decoy,TRY1,Decoy,0,-8.32662,-7.46,-1.02,-8.448357320651471
CCC(C)(C)NC(=O)[C@@H](c1c[nH]c2ccccc12)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06461993_decoy,TRY1,Decoy,0,-9.09084,-7.89,-3.47,-10.031105917556898
CCC(C)(C)NC(=O)[C@H](c1c[nH]c2ccccc12)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06462150_decoy,TRY1,Decoy,0,-8.71403,-7.87,-3.17,-9.620637994182202
CCCC[C@@H](C(=O)NCCC(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06481375_decoy,TRY1,Decoy,0,-9.79379,-6.39,-3.01,-9.463597919025132
CCC[C@@H](C(=O)NC1CCCC1)N(CCCOCC)C(=O)c1snc(C(N)=O)c1N,C06501016_decoy,TRY1,Decoy,0,-9.14426,-6.5,-4.67,-8.493662247245693
CCOC(=O)CNC(=O)[C@@H](C)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1OC,C06546561_decoy,TRY1,Decoy,0,-6.86232,-6.81,-1.36,-7.705628993744092
CCOC(=O)CNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06546751_decoy,TRY1,Decoy,0,-7.59706,-7.41,-5.6,-7.856605658822618
CCOC(=O)CNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06547073_decoy,TRY1,Decoy,0,-7.75233,-8.03,-2.43,-8.33201353711162
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](CC)C(=O)NC(C)(C)C,C06632205_decoy,TRY1,Decoy,0,-7.03452,-6.69,-2.3,-7.735624205367421
COCCNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06905062_decoy,TRY1,Decoy,0,-7.39169,-6.43,-0.76,-6.231239857072011
Cc1sc(NC(=O)CCCCC(=O)Nc2sc(C)c(C)c2C(N)=O)c(C(N)=O)c1C,C02062020_decoy,TRY1,Decoy,0,-10.3836,-7.25,-2.99,-8.52813781931143
CCCCn1c(N)c(N(CCC)CC(=O)NC(=O)Nc2ccc3c(c2)OCO3)c(=O)[nH]c1=O,C11350893_decoy,TRY1,Decoy,0,-7.665,-8.98,-2.04,-7.857389263337371
CC(C)C[C@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06190444_decoy,TRY1,Decoy,0,-7.99672,-7.26,-3.77,-8.317215962925847
COCCN(C(=O)CSc1nnc(-c2cccc(Cl)c2)n1N)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12866964_decoy,TRY1,Decoy,0,-9.96721,-4.65,-3.41,-5.898013452779973
O=C(NNC(=S)Nc1ccc(F)c(Cl)c1)C(=O)NNC(=S)Nc1ccc(F)c(Cl)c1,C13109681_decoy,TRY1,Decoy,0,-10.6053,-7.9,-1.18,-8.697489201124888
C=CCc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3cccc(NC(C)=O)c3)n2N)c1O,C20527514_decoy,TRY1,Decoy,0,-9.05146,-8.74,-3.55,-7.138290506722323
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccco3)n2)s1,C20832979_decoy,TRY1,Decoy,0,-9.66543,-6.82,-3.1,-7.726385329660108
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(NN=C3CCCCCC3)n2)s1,C20837855_decoy,TRY1,Decoy,0,-10.1964,-8.13,-2.18,-7.808827838030494
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCCC(=O)Nc1cccc([N+](=O)[O-])c1,C20915320_decoy,TRY1,Decoy,0,-8.60398,-7.71,-3.72,-6.882199018541487
CC(C)n1cc(/C=N/Nc2nnc(SCC(=O)NNC(=O)C(F)(F)F)n2N)cn1,C20921744_decoy,TRY1,Decoy,0,-6.90427,-7.16,-4.64,-5.401520337267767
CCNC(=S)/N=C(/NCCc1ccc(S(N)(=O)=O)cc1)Nc1nc(C)cc(C)n1,C14157926_decoy,TRY1,Decoy,0,-8.86778,-5.74,-2.48,-5.993553359954396
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]1O,C22066087_decoy,TRY1,Decoy,0,-6.10035,-8.6,-1.76,-6.817831633358108
NC(=O)CCn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1cccs1,C22408311_decoy,TRY1,Decoy,0,-10.5914,-6.88,-4.24,-7.1254087866734
COc1cc(SC)ccc1C(=O)N[C@H]1C[C@](O)(C(=O)N[C@@H](Cc2cccs2)C(N)=O)C[C@@H](O)[C@@H]1O,C25181073_decoy,TRY1,Decoy,0,-10.7058,-7.57,-3.49,-8.172781282091556
CC(=O)NNc1nc(C)c([C@H](/C=C/c2ccc(NC(C)=O)cc2)NNC(N)=S)s1,C25585266_decoy,TRY1,Decoy,0,-9.56024,-7.65,-2.11,-7.6869495571221504
Cc1cc(O)oc2cc(=[NH+]C(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](C)NC(=O)CCC(=O)[O-])ccc1-2,C25667529_decoy,TRY1,Decoy,0,-7.51819,-6.14,-3.56,-4.521825102349758
O=C([O-])C[C@@H](NC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccc(Cl)cc1,C29565643_decoy,TRY1,Decoy,0,-8.52718,-6.86,-3.27,-6.714477273687744
O=C([O-])C[C@H](NC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccc(Cl)cc1,C29565647_decoy,TRY1,Decoy,0,-9.14718,-7.35,-3.16,-7.753048760893543
C[C@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)COC(=O)C1,C31167157_decoy,TRY1,Decoy,0,-8.80409,-6.56,-1.73,-6.452718657077877
C[C@H](O)[C@H](O)[C@H](O)[C@@H](OCCO)Oc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1,C34898303_decoy,TRY1,Decoy,0,-9.05591,-7.79,-1.77,-6.249554233559671
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C35653059_decoy,TRY1,Decoy,0,-6.13603,-7.65,-1.75,-7.001221789672181
COCCN(C(=O)CSc1nnc(-c2cccc(F)c2)n1N)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C15940571_decoy,TRY1,Decoy,0,-7.61147,-6.05,-2.45,-5.074351823935902
CCC[C@H](C(=O)NC(C)(C)C)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06501268_decoy,TRY1,Decoy,0,-7.69359,-4.15,-2.55,-5.009020478301745
CC(C)N(C(C)C)[C@@H](C(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C(=O)[O-])[NH+](C(C)C)C(C)C,C19327760_decoy,TRY1,Decoy,0,-7.07189,-4.05,-3.43,-5.020868751842923
CC(C)N(C(C)C)[C@@H](C(=O)OC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)C(=O)[O-])[NH+](C(C)C)C(C)C,C19327766_decoy,TRY1,Decoy,0,-6.56187,-4.21,-3.06,-4.872975601406518
CCCC[C@@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06481295_decoy,TRY1,Decoy,0,-7.24126,-4.22,-2.75,-5.053187119363579
CCCC[C@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06481462_decoy,TRY1,Decoy,0,-7.11296,-6.93,-2.99,-7.56163615174144
NC(=O)c1c(Nc2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026397_decoy,TRY1,Decoy,0,-8.66644,-6.58,-1.69,-9.176641256457511
CCOC(Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1)OCC,C41302012_decoy,TRY1,Decoy,0,-7.84641,-6.84,-1.75,-7.717036274193405
CCCCN1C(=O)[C@H]2[C@@H](c3ccc(OCCC)cc3)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33874532_decoy,TRY1,Decoy,0,-8.40965,-7.51,-1.73,-12.0264943726819
CCO/C([O-])=C1\C(COCCNC(=O)NCC[NH3+])=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C27656499_decoy,TRY1,Decoy,0,-9.72975,-4.54,-2.95,-6.247185065196828
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NNC(=O)C2CCC2)n[nH]1,C59883939_decoy,TRY1,Decoy,0,-8.93618,-8.31,-2.54,-8.194528083198092
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]1,C59883947_decoy,TRY1,Decoy,0,-9.15764,-7.43,-2.06,-7.984255036521042
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]1,C59883948_decoy,TRY1,Decoy,0,-8.95048,-7.95,-2.73,-9.257916012994976
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]1,C59888340_decoy,TRY1,Decoy,0,-8.58581,-5.68,-1.48,-5.6845503428572455
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2nccs2)n1N,C59914548_decoy,TRY1,Decoy,0,-10.2431,-8.45,-2.64,-11.97031690565418
Cc1cc(NCCCCCCCCNc2cc(C)[nH+]c3cc(N)ccc23)c2ccc(N)cc2[nH+]1,C01560989_decoy,TRY1,Decoy,0,-10.9177,-8.79,-3.59,-8.826080024308904
O[C@@H](CCOc1ccccc1)C[NH2+]CCCCCC[NH2+]C[C@H](O)COc1ccccc1,C04686163_decoy,TRY1,Decoy,0,-9.16404,-6.13,-2.93,-6.768692822445196
O[C@H](CCOc1ccccc1)C[NH2+]CCCCCC[NH2+]C[C@H](O)COc1ccccc1,C04686164_decoy,TRY1,Decoy,0,-8.71291,-6.14,-2.59,-7.085351041347731
O[C@H](C[NH2+]CCCCCC[NH2+]C[C@@H](O)CCOc1ccccc1)COc1ccccc1,C04686166_decoy,TRY1,Decoy,0,-8.60461,-5.05,-3.55,-5.526853465426025
O[C@H](CCOc1ccccc1)C[NH2+]CCCCCC[NH2+]C[C@@H](O)COc1ccccc1,C04686167_decoy,TRY1,Decoy,0,-7.82807,-4.98,-2.99,-5.0789830458941685
Cc1cc(NCCCCCCNc2cc(C)[nH+]c3ccc(N)cc23)c2cc(N)ccc2[nH+]1,C01727083_decoy,TRY1,Decoy,0,-8.19579,-7.9,-2.28,-7.174553516538737
Cc1cc(NCCCCCCCNc2cc(C)[nH+]c3cc(N)ccc23)c2ccc(N)cc2[nH+]1,C01561345_decoy,TRY1,Decoy,0,-10.3415,-7.81,-1.67,-8.256373456290186
Cc1cc(NCCCCCCNc2cc(C)[nH+]c3cc(N)ccc23)c2ccc(N)cc2[nH+]1,C01562688_decoy,TRY1,Decoy,0,-10.6864,-8.39,-1.13,-8.13489058181477
COc1cc([C@H](C(=O)NC(C)(C)C)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)ccc1O,C06074421_decoy,TRY1,Decoy,0,-8.93953,-7.24,-2.1,-8.433802384812566
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCOC)c1ccc(O)cc1,C06631471_decoy,TRY1,Decoy,0,-7.42515,-6.19,-4.24,-5.943670119685463
COCCNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C12467187_decoy,TRY1,Decoy,0,-6.90267,-6.59,-3.01,-8.09005034833827
OC[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C13548744_decoy,TRY1,Decoy,0,-9.55412,-8.83,-0.69,-8.306757091417056
C=CCC(O)(CC=C)C[NH2+]Cc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(OC)c1,C14948177_decoy,TRY1,Decoy,0,-7.76597,-6.38,-2.39,-6.113788387021528
C=CCC(O)(CC=C)C[NH2+]Cc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(OC)c1,C14948180_decoy,TRY1,Decoy,0,-8.54641,-6.45,-2.83,-5.694344838567488
S=C(NNC(=S)Nc1ccc(Cl)cc1)NNC(=S)Nc1ccc(Cl)cc1,C15637084_decoy,TRY1,Decoy,0,-9.33361,-6.36,-1.71,-7.690240316775748
CC[C@H](C)[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+][C@@H](C)CC)c1Cl,C16225868_decoy,TRY1,Decoy,0,-9.05399,-7.05,-2.91,-7.915704966179544
CC[C@@H](C)[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+][C@H](C)CC)c1Cl,C16225870_decoy,TRY1,Decoy,0,-8.10691,-7.12,-2.87,-6.667245641852781
S=C(NNC(=S)Nc1ccccc1Cl)NNC(=S)Nc1ccccc1Cl,C16450442_decoy,TRY1,Decoy,0,-7.79018,-6.96,-2.32,-6.114724117763319
CCC(=N\NC(=S)NCC[NH+](CC)CC)/C(C)=N/NC(=S)NCC[NH+](CC)CC,C05572757_decoy,TRY1,Decoy,0,-10.0377,-4.53,-2.42,-6.41815418627897
CC(C)[NH2+]C[C@H](O)COc1ccc(O[C@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12,C21981345_decoy,TRY1,Decoy,0,-7.81244,-7.49,-1.78,-6.965828542511798
CC[C@@H](C)[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+][C@@H](C)CC)c1Cl,C16225872_decoy,TRY1,Decoy,0,-9.25321,-6.62,-3.57,-7.7980427731848145
C[C@H]([NH2+]CC(=O)NCCNC(=O)C[NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1,C16694823_decoy,TRY1,Decoy,0,-9.51191,-8.36,-3.32,-8.42068484404063
O[C@@H](C[NH2+]Cc1ccccc1)COCC1CCC(COC[C@@H](O)C[NH2+]Cc2ccccc2)CC1,C26897822_decoy,TRY1,Decoy,0,-9.02635,-7.19,-4.29,-7.457952956036012
O[C@H](C[NH2+]Cc1ccccc1)COCC1CCC(COC[C@@H](O)C[NH2+]Cc2ccccc2)CC1,C26897825_decoy1,TRY1,Decoy,0,-9.16671,-7.08,,-7.049796744908674
O[C@H](C[NH2+]Cc1ccccc1)COCC1CCC(COC[C@H](O)C[NH2+]Cc2ccccc2)CC1,C26897830_decoy,TRY1,Decoy,0,-8.53165,-6.66,-3.27,-7.171269510161512
C[C@@H]1CCCC[C@@H]1[NH2+]C[C@H](O)COc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCCC[C@@H]2C)cc1,C35083462_decoy,TRY1,Decoy,0,-8.97009,-6.69,-3.88,-6.048546183670944
C[C@@H]1CCCC[C@H]1[NH2+]C[C@H](O)COc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCCC[C@@H]2C)cc1,C35083467_decoy,TRY1,Decoy,0,-9.97664,-6.71,-3.11,-6.559140502488462
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500505_decoy,TRY1,Decoy,0,-8.02583,-6.38,-2.91,-6.8663061260004055
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500742_decoy,TRY1,Decoy,0,-7.47043,-5.85,-3.09,-6.035172044402223
Cc1ccccc1OC[C@@H](O)C[NH2+]C1CCC([NH2+]C[C@H](O)COc2ccccc2C)CC1,C12540241_decoy,TRY1,Decoy,0,-8.91707,-6.54,-1.74,-6.568224925921543
Cc1ccccc1OC[C@H](O)C[NH2+]C1CCC([NH2+]C[C@H](O)COc2ccccc2C)CC1,C12540243_decoy,TRY1,Decoy,0,-8.5609,-7.41,-3.84,-6.782623380782018
CCOc1ccc([C@@H](C(=O)NCCC(C)C)N(CCO)C(=O)c2snc(C(N)=O)c2N)cc1,C06601380_decoy,TRY1,Decoy,0,-8.94781,-5.92,-1.23,-6.25577632875158
O=C(/C=C/c1ccc(O)cc1)OC[C@@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O,C35455341_decoy,TRY1,Decoy,0,-10.8793,-9.19,-1.64,-8.343626879239347
Cc1ccccc1OC[C@H](O)C[NH2+]C1CCC([NH2+]C[C@@H](O)COc2ccccc2C)CC1,C09509785_decoy,TRY1,Decoy,0,-8.97046,-7.14,-2.64,-7.159104956080214
CCC(=N/NC(=S)NCC[NH+](CC)CC)/C(C)=N/NC(=S)NCC[NH+](CC)CC,C17107960_decoy,TRY1,Decoy,0,-8.90348,-4.65,-3.17,-5.392218052977218
C[C@H]1CCCC[C@@H]1[NH2+]C[C@H](O)COc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCCC[C@@H]2C)cc1,C35083465_decoy,TRY1,Decoy,0,-9.72701,-6.35,-1.53,-7.27424512316141
COc1c(C)c(OC/C=C(\C)C(=O)OC[C@@H](O)[C@H](O)[C@H](O)CO)cc(CO)c1CO,C39559843_decoy,TRY1,Decoy,0,-8.56497,-6.86,-2.74,-6.834353080728766
O=C(CS[C@H]1NN[C@H]([NH2+]Cc2ccco2)S1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39692869_decoy,TRY1,Decoy,0,-10.2628,-7.59,-1.28,-7.397569522557109
C[NH+](CCCOC[C@H](O)C[NH3+])C[C@H](O)COc1ccc(Br)cc1Br,C43146945_decoy,TRY1,Decoy,0,-10.1872,-6.25,-3.48,-8.468191038880557
C[NH+](CCCOC[C@@H](O)C[NH3+])C[C@H](O)COc1ccc(Br)cc1Br,C43146948_decoy,TRY1,Decoy,0,-9.2251,-4.18,-1.3,-5.317398150299262
Cc1cc([C@H](OC[C@H](O)C[NH2+]CC[NH3+])c2ccncc2)c2cc(Br)ccc2n1,C49048969_decoy,TRY1,Decoy,0,-9.53492,-6.78,-2.11,-9.715082259080312
Cc1cc([C@@H](OC[C@H](O)C[NH2+]CC[NH3+])c2ccncc2)c2cc(Br)ccc2n1,C49048973_decoy,TRY1,Decoy,0,-8.19718,-5.72,-1.03,-5.736654830334123
Cc1cc([C@H](OC[C@@H](O)C[NH2+]CC[NH3+])c2ccncc2)c2cc(Br)ccc2n1,C49048977_decoy,TRY1,Decoy,0,-8.60802,-6.63,-3.14,-7.735712290146417
Cc1cc([C@@H](OC[C@@H](O)C[NH2+]CC[NH3+])c2ccncc2)c2cc(Br)ccc2n1,C49048981_decoy,TRY1,Decoy,0,-10.454,-6.91,-1.08,-9.049034827799447
[NH3+][C@H](COc1cncc(/C=C/c2cc[nH+]c(NCc3ccccc3)c2)c1)CC1=c2ccccc2=[NH+]C1,C52627508_decoy,TRY1,Decoy,0,-8.9328,-8.8,-5.21,-7.716458077839529
C[C@H]1CCCC[C@H]1[NH2+]C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH2+][C@@H]2CCCC[C@@H]2C)cc1,C27529388_decoy,TRY1,Decoy,0,-10.2679,-6.2,-3.07,-6.151191571469097
O[C@H](C[NH2+]Cc1ccccc1Cl)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccccc2Cl)cc1,C27529519_decoy,TRY1,Decoy,0,-9.54753,-6.96,-2.93,-6.796858055319989
CC[NH+](CC)CCNC(=O)c1cc(Cl)c(N[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)cc1OC,C65747774_decoy,TRY1,Decoy,0,-5.36152,-5.3,-2.39,-4.382341436141051
O[C@H](C[NH2+]Cc1ccccc1)COCC1CCC(COC[C@@H](O)C[NH2+]Cc2ccccc2)CC1,C26897825_decoy2,TRY1,Decoy,0,-8.1676,-6.46,,-6.162788974321899
C=C(C)C(CCc1nc(N)nc(N)n1)(CCc1nc(N)nc(N)n1)C(C)=O,C01666709_decoy,TRY1,Decoy,0,-7.60406,-6.34,-1.77,-7.291646261553045
CC(=O)C(CCC#N)(CCc1nc(N)nc(N)n1)CCc1nc(N)nc(N)n1,C01603584_decoy,TRY1,Decoy,0,-8.67359,-7.19,-1.98,-8.524196232239422
C[C@@H](O)C[NH+](Cc1cc(O)c(C[NH+](C[C@@H](C)O)C[C@@H](C)O)cc1O)C[C@@H](C)O,C04775230_decoy,TRY1,Decoy,0,-8.51177,-5.6,-3.98,-6.398773433755223
Nc1nc(N(CCO)CCO)nc2c(N)nc(N(CCO)CCO)nc12,C01603753_decoy,TRY1,Decoy,0,-7.62012,-4.9,-1.39,-5.75881761276518
OCCNc1nc(NCCO)c2nc(NCCO)nc(NCCO)c2n1,C05543696_decoy,TRY1,Decoy,0,-7.54668,-4.58,-3.94,-6.505065021726684
COc1ccc2[nH+]c(NCC[NH2+]CCO)cc(NCC[NH2+]CCO)c2c1,C05552028_decoy,TRY1,Decoy,0,-9.02459,-5.86,-2.05,-7.752410159611539
Cc1n[nH]c(=O)nc1NCCCCCCCC[NH2+]CCCCCCCC[NH3+],C04749843_decoy,TRY1,Decoy,0,-8.4152,-4.86,-3.11,-4.946700962309408
C[C@@]1(O[C@H]([C@H](O)CO)[C@H](O)CC=O)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915729_decoy,TRY1,Decoy,0,-6.70774,-4.29,-2.86,-4.635981446987087
CCc1nc(N)nc(N)c1-c1ccc(NCCCCCC[NH3+])c([N+](=O)[O-])c1,C05479324_decoy,TRY1,Decoy,0,-8.468,-7.71,-3.84,-9.138166908013142
COc1cc(C[C@H](CO)[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)Cc2ccc(O)c(OC)c2)ccc1O,C14694397_decoy,TRY1,Decoy,0,-9.37076,-8.18,-2.59,-9.848451243476942
COc1cc([C@@H]2Oc3c(O)cc(CCCO)cc3[C@H]2CO)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C15169011_decoy,TRY1,Decoy,0,-9.26116,-7.58,-1.1,-6.788710583116687
CCOc1ccc(NCC(=O)N/N=C/[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)cc1,C15224530_decoy,TRY1,Decoy,0,-8.51729,-7.71,-2.0,-9.456683195593111
CCOc1ccc(NCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)cc1,C15224532_decoy,TRY1,Decoy,0,-8.13635,-7.38,-3.39,-7.502970857463683
CCOc1ccc(NCC(=O)N/N=C/[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc1,C15224534_decoy,TRY1,Decoy,0,-7.68721,-7.54,-2.38,-6.6201251116172
CCOc1ccc(NCC(=O)N/N=C/[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc1,C15224535_decoy,TRY1,Decoy,0,-7.96521,-7.66,-1.69,-8.435614206388308
Cc1c(CSC(N)=[NH2+])c(C)c(CSC(N)=[NH2+])c(C)c1CSC(N)=[NH2+],C04377411_decoy,TRY1,Decoy,0,-9.02539,-5.33,-1.67,-11.857324993218628
C[C@H](O)CN(CC[NH+](C[C@@H](C)O)C[C@@H](C)O)CC[NH+](C[C@@H](C)O)C[C@@H](C)O,C22576466_decoy,TRY1,Decoy,0,-8.32007,-4.36,-1.72,-5.573431675581527
C[C@@H](O)CN(CC[NH+](C[C@@H](C)O)C[C@@H](C)O)CC[NH+](C[C@@H](C)O)C[C@@H](C)O,C22576472_decoy,TRY1,Decoy,0,-7.71956,-4.98,-3.6,-5.46954858427639
CCCCCCC(=O)CCCCCC/C=C/[C@H](O)[C@@H](O)[C@H](O)[C@@]([NH3+])(CO)C(=O)[O-],C31163788_decoy,TRY1,Decoy,0,-8.19855,-4.31,-4.56,-5.896728000321608
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C35169069_decoy,TRY1,Decoy,0,-7.70305,-5.68,-3.9,-4.843733865889651
CCOc1ccc(NCC(=O)N/N=C/[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)cc1,C33957539_decoy,TRY1,Decoy,0,-8.21349,-7.76,-2.31,-7.284600118962994
CCOc1ccc(NCC(=O)N/N=C/[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)cc1,C33957540_decoy,TRY1,Decoy,0,-7.67536,-4.98,-2.82,-4.9895198786462505
CCOc1ccc(NCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc1,C33957541_decoy,TRY1,Decoy,0,-7.90766,-8.0,-2.27,-7.361850521611514
CCOc1ccc(NCC(=O)N/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc1,C33957542_decoy,TRY1,Decoy,0,-7.87864,-6.67,-1.5,-6.603046762889169
COc1cc(C[C@@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C35464802_decoy,TRY1,Decoy,0,-9.30405,-7.56,-2.95,-8.831944562491762
CSC(=S)N/N=C(/CNNC(=S)SC)[C@@H](O)[C@@H](O)[C@H](O)CO,C37263622_decoy,TRY1,Decoy,0,-9.98645,-5.1,-3.04,-8.175079703264217
C[C@H](O)CC(C[C@@H](C)O)[NH2+]CCCCCC[NH2+]C(C[C@@H](C)O)C[C@@H](C)O,C38637380_decoy,TRY1,Decoy,0,-9.09612,-5.23,-1.96,-6.569893137022377
C[C@@H](O)CC(C[C@@H](C)O)[NH2+]CCCCCC[NH2+]C(C[C@@H](C)O)C[C@@H](C)O,C38637383_decoy,TRY1,Decoy,0,-9.56484,-5.2,-2.94,-6.611702194808008
C[C@H](O)CC(C[C@H](C)O)[NH2+]CCCCCC[NH2+]C(C[C@@H](C)O)C[C@@H](C)O,C38637387_decoy,TRY1,Decoy,0,-9.16853,-4.89,-3.41,-6.405779605279612
C=CCOC[C@H]1O[C@](CO)(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C38653928_decoy,TRY1,Decoy,0,-4.97121,-5.53,-2.17,-4.726741649463581
C=CCOC[C@@H]1O[C@](CO)(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C38653932_decoy,TRY1,Decoy,0,-5.96208,-5.27,-2.74,-4.817910104432782
C=CCOC[C@H]1O[C@](CO)(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C38653935_decoy,TRY1,Decoy,0,-6.03274,-5.26,-2.12,-4.983512621562143
C=CCOC[C@@H]1O[C@](CO)(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C38653940_decoy,TRY1,Decoy,0,-5.24183,-5.08,-2.97,-5.008795043494076
OCC(CO)OC[C@@H](CO)OC[C@@H](CO)OC[C@@H](CO)OC(CO)CO,C38655062_decoy,TRY1,Decoy,0,-7.51199,-5.06,-2.29,-6.283106387913524
OCC(CO)OC[C@H](CO)OC[C@@H](CO)OC[C@@H](CO)OC(CO)CO,C38655066_decoy,TRY1,Decoy,0,-8.44856,-5.13,-2.82,-7.096645574436027
OCC(CO)OC[C@@H](CO)OC[C@H](CO)OC[C@@H](CO)OC(CO)CO,C38655070_decoy,TRY1,Decoy,0,-7.8627,-5.66,-3.7,-7.345502592395058
OCC(CO)OC[C@H](CO)OC[C@H](CO)OC[C@@H](CO)OC(CO)CO,C38655073_decoy,TRY1,Decoy,0,-7.74412,-5.6,-3.43,-6.676613958062694
C[C@H](O)CN(CC[NH+](C[C@H](C)O)C[C@@H](C)O)CC[NH+](C[C@@H](C)O)C[C@@H](C)O,C22576478_decoy,TRY1,Decoy,0,-8.12638,-4.08,-2.0,-5.60691104311316
C[C@H](O)C[NH+](CCN(CC[NH+](C[C@@H](C)O)C[C@@H](C)O)C[C@@H](C)O)C[C@@H](C)O,C22576485_decoy,TRY1,Decoy,0,-8.19963,-4.26,-3.24,-5.986380595471867
[NH3+]CCCCCCN[C@H]1N=C2C(=O)N=CN=C2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345362_decoy,TRY1,Decoy,0,-8.05894,-4.88,-0.82,-5.602119059519006
[NH3+]CCCCCCN[C@@H]1N=C2C(=O)N=CN=C2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345363_decoy,TRY1,Decoy,0,-8.23782,-6.52,-1.84,-7.589930230388858
NC(=O)[C@@H]([NH3+])CCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C44075222_decoy,TRY1,Decoy,0,-9.91803,-6.32,-2.96,-6.732354150833127
COc1cc(C[C@H]([NH3+])CO)cc(-c2cc(C[C@H]([NH3+])CO)cc(OC)c2O)c1O,C44467014_decoy,TRY1,Decoy,0,-10.616,-6.82,-4.4,-9.43565261561092
COc1cc(C[C@H]([NH3+])CO)cc(-c2cc(C[C@@H]([NH3+])CO)cc(OC)c2O)c1O,C44467017_decoy,TRY1,Decoy,0,-12.3547,-7.17,-1.55,-11.726536060557368
COc1cc(C[C@@H]([NH3+])CO)cc(-c2cc(C[C@@H]([NH3+])CO)cc(OC)c2O)c1O,C44467019_decoy,TRY1,Decoy,0,-11.8761,-7.1,-1.58,-10.797775865292255
O=c1[nH]c(NCCCO)c(Cc2c(NCCCO)[nH]c(=O)[nH]c2=O)c(=O)[nH]1,C59922981_decoy,TRY1,Decoy,0,-7.68793,-5.48,-0.68,-5.682707867410259
C[C@H](O)C[NH+](Cc1cc(O)c(C[NH+](C[C@@H](C)O)C[C@@H](C)O)cc1O)C[C@@H](C)O,C17328547_decoy,TRY1,Decoy,0,-8.12037,-4.42,-3.41,-5.786367886487873
Cc1cccc2c1=[NH+][C@@H](CCNC(=O)CN1N[NH2+]N[C@H]1C[NH+](C)C(C)C)[NH+]=2,C64067023_decoy,TRY1,Decoy,0,-9.23728,-6.15,-2.3,-6.703199245410428
Cc1cccc2c1=[NH+][C@H](CCNC(=O)CN1N[NH2+]N[C@H]1C[NH+](C)C(C)C)[NH+]=2,C64067024_decoy,TRY1,Decoy,0,-8.50695,-6.91,-1.79,-7.654930511197398
COc1ccc(NC(=O)C2(N(Cc3ccccc3)C(=O)C[C@@H]3[C@H](c4c(C)[nH]c5ccccc45)C3(C)C)CC[NH+](C)CC2)c(OC)c1,C08749375_decoy,TRY1,Decoy,0,-8.00803,-7.53,-2.3,-6.43311710013981
Cc1[nH]c2ccccc2c1[C@H]1[C@@H](CC(=O)N(C2CC2)C2(C(=O)Nc3ccc(N4CCOCC4)cc3)CC[NH+](C)CC2)C1(C)C,C08696049_decoy,TRY1,Decoy,0,-8.13475,-7.05,-1.75,-5.805789932264691
CCN(CC)c1ccc([C@@H]2[C@@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1,C09158552_decoy,TRY1,Decoy,0,-9.226,-7.48,-2.32,-7.650300685354036
CCCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)OC)CC(C)(C)[NH2+]C3(C)C)cc1,C09391496_decoy,TRY1,Decoy,0,-9.36925,-4.57,-3.27,-5.962756544069314
COc1ccc(-c2c[nH]nc2-c2ccc(OCC[NH+]3CCN(c4ccccc4F)CC3)cc2O)cc1,C09060259_decoy,TRY1,Decoy,0,-7.81631,-5.9,-2.96,-5.729090433146564
CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1,C13776534_decoy,TRY1,Decoy,0,-10.0071,-6.25,-3.15,-6.888995605200107
Cc1ccc(NC(=O)NCC[NH+]2CCN(c3nc(Cc4ccc(Cl)cc4)ns3)CC2)cc1C,C16493657_decoy,TRY1,Decoy,0,-9.43892,-7.38,-2.91,-6.392347917246138
COc1ccc(Cl)cc1NC(=O)C[NH+](C)Cc1nc2sc(C)c(-c3ccc(C)cc3)c2c(=O)[nH]1,C16626443_decoy,TRY1,Decoy,0,-7.30137,-7.26,-2.77,-5.5146356517257935
CC[NH+]1CCN(c2ccc(NC(=S)NC(=O)c3ccc(-c4ccccc4[N+](=O)[O-])o3)cc2Cl)CC1,C16681581_decoy,TRY1,Decoy,0,-8.96911,-8.97,-3.65,-7.762179808404072
CC[NH+]1CCc2c(sc(-n3cccc3)c2[C@@H](CCC(C)C)NC(=O)Nc2ccccc2OC)C1,C20532183_decoy,TRY1,Decoy,0,-8.02931,-5.72,-1.76,-6.096111401758456
COc1cc(/[NH+]=c2\oc3c(C)ncc(CO)c3cc2C(=O)Nc2cc(Cl)ccc2OC)cc(OC)c1,C20617490_decoy,TRY1,Decoy,0,-9.78938,-8.88,-2.03,-9.83624158222547
COc1cc(C[NH2+]Cc2ccc(F)cc2)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCO2,C20877053_decoy,TRY1,Decoy,0,-9.76385,-6.6,-2.4,-6.461755860272199
Cc1cccc(NC(=O)CN2CC[NH+](CC(=O)N[C@H](c3ccc(F)cc3)c3cccs3)CC2)c1C,C22785254_decoy,TRY1,Decoy,0,-10.0038,-7.25,-1.77,-6.382218407525845
CCc1ccccc1NC(=O)C[NH+]1CCN(CC(=O)Nc2nc(-c3cc(F)ccc3F)cs2)CC1,C23248219_decoy,TRY1,Decoy,0,-8.21055,-7.45,-3.26,-6.463652521659987
C=CCOc1ccc(-c2[nH+]c3c(NC4CCCC4)cccn3c2-c2ccnc(NC3CCCC3)n2)cc1,C28703234_decoy,TRY1,Decoy,0,-8.84557,-5.61,-3.44,-5.177916389942827
CCOc1ccc([C@H]([NH2+]CC(=O)Nc2cc3c(cc2Cl)OCCCO3)C(C)C)cc1OCC,C29150507_decoy,TRY1,Decoy,0,-8.92267,-5.07,-3.53,-4.863236786259906
C=C(Nn1c(-c2cccc([N+](=O)[O-])c2)cs/c1=[NH+]\c1c(C)cccc1C)c1cccc(NC(C)=O)c1,C03278242_decoy,TRY1,Decoy,0,-7.03141,-6.99,-3.1,-5.55640265998752
O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(N2CCC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)nc1,C34682094_decoy,TRY1,Decoy,0,-7.60724,-6.68,-2.28,-5.059729771034879
CCCCNC(=O)N(CC[NH+]1CCN(C(=O)Nc2ccc(Cl)cc2)CC1)CC1=CC[C@@H]2C[C@H]1C2(C)C,C34997519_decoy,TRY1,Decoy,0,-9.56376,-8.69,-2.24,-8.159512801705493
CC(C)NC(=O)N(CC[NH+]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1)CC1=CC[C@@H]2C[C@H]1C2(C)C,C35000855_decoy,TRY1,Decoy,0,-8.94845,-5.92,-2.6,-5.962055525690628
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H]([NH2+]C3CC3)C[C@@H](c3ccc(OC(F)(F)F)cc3)N12,C12603018_decoy,TRY1,Decoy,0,-8.16975,-6.22,-1.98,-6.10058656490046
CCCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@H](c3ccc(F)cc3)NC(=O)N2CC)CC1,C35642737_decoy,TRY1,Decoy,0,-7.90773,-5.98,-1.9,-5.75741910078396
CCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@H](c3ccc(C)cc3C)NC(=O)N2CC)CC1,C35646849_decoy,TRY1,Decoy,0,-6.56982,-5.14,-2.3,-5.023510262504539
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@H]1c1ccc(C)cc1C,C35646853_decoy,TRY1,Decoy,0,-7.05027,-5.14,-3.79,-5.235948376020185
CC(C)c1cc2c(=O)[nH]c(C[NH+](C[C@H](O)COc3ccc(Cl)cc3)C3CCCCC3)nc2s1,C35780954_decoy,TRY1,Decoy,0,-10.2985,-8.18,-1.6,-7.781051245806284
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(C)C(=O)N[C@H]1c1ccc(C(C)C)cc1,C36005434_decoy,TRY1,Decoy,0,-8.37487,-6.97,-2.9,-6.751079681265643
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@H]1c1ccc(Cl)cc1,C36014009_decoy,TRY1,Decoy,0,-7.72741,-4.77,-1.89,-5.481975907882096
CCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@H](c3ccc(Cl)cc3Cl)NC(=O)N2CC)CC1,C36016858_decoy,TRY1,Decoy,0,-8.75843,-4.97,-4.03,-6.0027292604577545
C=CCN1C(=O)N[C@@H](c2cccc(F)c2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)NCCC)CC1,C36019106_decoy,TRY1,Decoy,0,-8.03961,-5.3,-3.72,-7.85803800980348
COc1ccc(-c2csc3nc(C[NH+](CC(C)C)C[C@@H](O)Cc4ccccc4)[nH]c(=O)c23)cc1,C36206271_decoy,TRY1,Decoy,0,-7.79208,-6.68,-3.85,-6.143996179585813
COc1ccccc1-c1csc2nc(C[NH+](C[C@H](O)COC(C)C)C3CCCCC3)[nH]c(=O)c12,C36206571_decoy,TRY1,Decoy,0,-8.3136,-6.36,-2.5,-5.808230817966434
C#CCOC[C@H](O)C[NH+](Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1)C1CCCCC1,C36207109_decoy,TRY1,Decoy,0,-9.25398,-7.27,-3.07,-7.301091336186483
Cc1ccc(-c2csc3nc(C[NH+](C[C@@H](O)COc4ccc(Cl)cc4)C(C)C)[nH]c(=O)c23)cc1C,C36207580_decoy,TRY1,Decoy,0,-9.8371,-8.09,-2.47,-8.66871674569025
CC(C)c1cc2c(=O)[nH]c(C[NH+](Cc3ccccc3)C[C@H](O)COc3ccc(Cl)cc3)nc2s1,C36313114_decoy,TRY1,Decoy,0,-10.0373,-8.1,-2.38,-8.534729297426956
Cc1cc(N2C[C@H](C)C[C@H](C)C2)[nH+]c2ccc(NC(=O)CCC(=O)NCCC3=CCCCC3)cc12,C20138498_decoy,TRY1,Decoy,0,-9.63246,-8.58,-3.72,-7.024805476127853
CCCCOc1ccc(NC(=O)NC[C@H](c2ccc3c(c2)CCCN3C)N2CC[NH+](C)CC2)cc1,C38517740_decoy,TRY1,Decoy,0,-10.8512,-6.25,-1.23,-6.927937103666778
COc1cccc([C@H](Nc2cccc(C)[nH+]2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1OC,C38547701_decoy,TRY1,Decoy,0,-9.20234,-5.56,-2.19,-5.95954820171303
CCc1cc([C@H](Nc2cc(C)cc[nH+]2)c2cccc(OC)c2OC)c(NC(=O)c2ccco2)s1,C38547926_decoy,TRY1,Decoy,0,-9.16751,-7.02,-2.83,-7.831087489719896
Cc1ccc([C@H]2NN=C(SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N2c2ccc(Cl)cc2)cc1,C39923312_decoy,TRY1,Decoy,0,-9.68896,-6.85,-2.28,-7.399212179533864
CCOc1ccc(N2C(SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)=NN[C@@H]2c2ccccc2)cc1,C39923314_decoy,TRY1,Decoy,0,-8.0785,-5.35,-2.48,-5.421656949779919
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2[N+](=O)[O-])cc1,C40628190_decoy,TRY1,Decoy,0,-8.56077,-6.31,-2.7,-7.746035676549127
Nc1c(N2CCN(C(c3ccccc3)c3ccccc3)CC2)nc[nH+]c1N(Cc1ccccc1)c1ccccn1,C40730024_decoy,TRY1,Decoy,0,-8.68536,-8.22,-1.7,-6.65149734974518
COc1ccc(OC)c([C@@H]2C[C@](O)(c3ccccc3OC)[C@H](C)[C@H](c3cc(OC)ccc3OC)[NH2+]2)c1,C43193533_decoy,TRY1,Decoy,0,-7.51746,-6.44,-2.15,-5.558251846773442
O=C(Nc1sc2c(c1[C@H](Nc1cccc[nH+]1)c1ccc(OC(F)F)cc1)CCCC2)c1ccco1,C38550656_decoy,TRY1,Decoy,0,-8.9877,-5.79,-0.7,-5.80947576740058
Nc1c2c(-c3ccccc3F)nc(N3CC[NH+](CCOc4ccccc4)CC3)nc2nn1Cc1ccccc1,C44854584_decoy,TRY1,Decoy,0,-8.97321,-8.23,-1.7,-6.969051043496392
C[NH+](CC(=O)Nc1nc(-c2cc(F)ccc2F)cs1)CC(=O)Nc1c(Cl)cccc1Cl,C12819140_decoy,TRY1,Decoy,0,-9.48235,-6.78,-2.76,-6.901043275799634
CCOC(=O)c1c(NC(=O)C2=CC3=[NH+][C@@H](c4cccs4)C[C@H](C(F)(F)F)N3N2)sc(C)c1C,C13121891_decoy,TRY1,Decoy,0,-8.24511,-6.69,-3.36,-6.125257464706466
CCOc1cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](CC)C4)N2)ccc1OC(=O)c1ccc(F)cc1,C15947157_decoy,TRY1,Decoy,0,-9.28748,-7.99,-2.32,-6.53640940849204
Cc1ccc(NC(=O)CS[C@H]2N=N[C@@H]([C@H](CC3=c4ccccc4=[NH+]C3)NC(=O)OC(C)(C)C)O2)c(C)c1,C63426770_decoy,TRY1,Decoy,0,-9.21663,-8.45,-1.59,-8.067602435731105
COc1ccc2c(c1)=C(CCNC(=O)C1=CNN3C(C(F)(F)F)=CC(c4ccc(C(C)C)cc4)=N[C@@H]13)C[NH+]=2,C63547056_decoy,TRY1,Decoy,0,-9.37284,-7.19,-2.81,-6.208358108891954
Cc1ccccc1Nc1nc(N)nc(C[NH2+]CCCN2CCCCCC2=O)n1,C06787364_decoy,TRY1,Decoy,0,-7.22161,-6.35,-1.2,-6.362337369497242
CCOc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccccc1,C07539411_decoy,TRY1,Decoy,0,-7.69743,-7.3,-1.0,-7.801300471997929
C[NH+](CC(=O)Nc1cccc(F)c1)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C08119723_decoy,TRY1,Decoy,0,-9.84654,-8.03,-3.01,-7.68834990628695
CCOC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CC[NH+]1CCC(C(N)=O)CC1,C02235366_decoy,TRY1,Decoy,0,-8.16682,-7.28,-1.28,-6.134148016434362
NC(=[NH2+])Sc1cn(CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc12,C02455118_decoy,TRY1,Decoy,0,-9.08815,-7.32,-1.32,-8.113159682382864
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1,C25537127_decoy,TRY1,Decoy,0,-8.15099,-6.77,-1.9,-5.744014597745164
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1,C25537137_decoy,TRY1,Decoy,0,-8.05326,-7.27,-1.71,-6.012915708056689
Cc1ccc(NC(=[NH2+])Nc2nc(CSc3nnc(N)s3)cc(=O)[nH]2)cc1,C09266174_decoy,TRY1,Decoy,0,-8.57673,-8.13,-1.83,-7.480545035707418
OCC(CO)(CO)[NH2+]C[C@H](O)CN1c2ccccc2Sc2ccccc21,C04150550_decoy,TRY1,Decoy,0,-8.34576,-5.94,-2.4,-7.853034573363458
CCOC(=O)C1=C(C)/C(=C(/C)NNc2ccc(S(N)(=O)=O)cc2)C(C)=[NH+]1,C04738354_decoy,TRY1,Decoy,0,-8.79827,-5.21,-1.0,-4.7982553137033
COc1ccc(NC(=[NH2+])Nc2nc(CS[C@@H]3NN=C(C)S3)cc(=O)[nH]2)cc1,C38960025_decoy,TRY1,Decoy,0,-9.00234,-7.63,-2.56,-7.90899241543489
COc1cc(C(=O)c2c(N[NH3+])oc3c(O)c(OC)ccc23)cc(OC)c1OC,C39126708_decoy,TRY1,Decoy,0,-7.25215,-6.01,-2.16,-5.296867863715484
CC(C)S(=O)(=O)c1ccc([C@H](CNO)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534444_decoy,TRY1,Decoy,0,-8.65682,-7.52,-2.9,-7.347616100205653
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccc(C)cc1,C40744374_decoy,TRY1,Decoy,0,-7.81362,-7.56,-2.1,-7.232398776609079
CN(c1ncnc(NNC(=O)COc2ccc(Cl)cc2Cl)c1N)C1CC[NH+](C)CC1,C40795575_decoy,TRY1,Decoy,0,-8.0984,-5.5,-1.74,-5.039718485712114
NC(=O)N[C@@H](CC(=O)NCC1([NH+]2CCSCC2)CCCC1)c1cccs1,C41423526_decoy,TRY1,Decoy,0,-9.9474,-6.48,-1.56,-6.92977073172189
C[NH+](CCCNC(=O)Nc1ccccc1OCCC(N)=O)Cc1ccccc1,C47877352_decoy,TRY1,Decoy,0,-7.868,-6.38,-1.56,-6.076164366266998
C[C@H]([NH2+][C@@H](C)c1ccc(S(N)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1,C49574746_decoy,TRY1,Decoy,0,-7.71015,-6.34,-1.25,-5.925835284959611
C[C@H]([NH2+][C@H](C)c1ccc(S(N)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1,C49574748_decoy,TRY1,Decoy,0,-7.32704,-5.78,-1.69,-5.64460096463892
C[C@H]([NH2+][C@H](C)C(=O)NCCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1,C49574750_decoy,TRY1,Decoy,0,-9.32451,-6.63,-1.37,-6.564118723588626
C[C@@H]([NH2+][C@H](C)c1ccc(S(N)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1,C49574752_decoy,TRY1,Decoy,0,-9.5924,-7.74,-1.6,-7.1540035189306685
CC[NH+]1CCN(CCCCNC(=O)Nc2ccccc2OCCC(N)=O)CC1,C47878160_decoy,TRY1,Decoy,0,-7.87239,-6.53,-1.78,-6.801856901984353
C[NH+](CCNC(=O)Nc1ccccc1SCC(N)=O)Cc1ccccc1,C54409660_decoy,TRY1,Decoy,0,-7.20403,-7.25,-3.72,-7.767568822935225
CC[NH+](CC)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1,C56533852_decoy,TRY1,Decoy,0,-6.94619,-6.14,-1.6,-6.522661629683066
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)Nc2ccccc2OCCC(N)=O)C1,C56716524_decoy,TRY1,Decoy,0,-7.65497,-7.73,-3.62,-7.679615351214003
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)Nc2ccccc2OCCC(N)=O)C1,C56716526_decoy,TRY1,Decoy,0,-7.8606,-7.73,-2.95,-7.849150272375756
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@@H](C)C[NH+]1C[C@H](C)C[C@H](C)C1,C56725473_decoy,TRY1,Decoy,0,-8.85879,-6.2,-2.05,-6.453630945606154
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@H](C)C[NH+]1C[C@H](C)C[C@H](C)C1,C56725474_decoy,TRY1,Decoy,0,-9.08241,-5.95,-2.98,-5.939256301534838
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1,C56725475_decoy,TRY1,Decoy,0,-8.18569,-4.74,-1.86,-4.923962977691862
C[C@@H](CNC(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1)C[NH+]1CCCCC1,C57043863_decoy,TRY1,Decoy,0,-9.33976,-5.93,-2.6,-6.069467447157953
CSCC[C@H](NC(N)=O)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C57288307_decoy,TRY1,Decoy,0,-9.1444,-5.66,-3.4,-6.381771969383646
COc1cc2[nH]c(=O)c(CNc3ccc([NH+]4CCC(C(N)=O)CC4)cc3)cc2c(OC)c1OC,C57718114_decoy,TRY1,Decoy,0,-7.3577,-7.45,-3.2,-5.534967873595417
C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)c1ccc(NC(N)=O)cc1,C58053046_decoy,TRY1,Decoy,0,-8.85292,-7.46,-1.5,-7.219202337940569
C[C@@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1)c1ccc(NC(N)=O)cc1,C58053051_decoy,TRY1,Decoy,0,-9.02201,-8.17,-1.66,-9.275250540078371
C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)c1ccc(NC(N)=O)cc1,C58053056_decoy,TRY1,Decoy,0,-8.93116,-7.01,-3.26,-6.4467590511370485
C[C@@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)c1ccc(NC(N)=O)cc1,C58053063_decoy,TRY1,Decoy,0,-8.56112,-7.38,-1.72,-6.45563565005207
C[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)c1cccc(S(N)(=O)=O)c1,C58436532_decoy,TRY1,Decoy,0,-9.61643,-4.98,-2.21,-5.383826502143046
C[NH+](C)[C@@H](CNC(=O)Nc1ccccc1CC(N)=O)c1ccccc1Cl,C45725588_decoy,TRY1,Decoy,0,-8.31474,-6.97,-3.93,-7.850260267141228
C[NH+](C)[C@H](CNC(=O)Nc1ccccc1CC(N)=O)c1ccccc1Cl,C45725589_decoy,TRY1,Decoy,0,-7.93363,-6.73,-2.07,-7.867761821269241
[NH3+]CCNc1ccc([N+](=O)[O-])c(NCCCNc2ccc([N+](=O)[O-])cc2Cl)c1,C59381682_decoy,TRY1,Decoy,0,-7.89591,-6.3,-3.6,-6.682912676189929
CCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115469_decoy,TRY1,Decoy,0,-7.38787,-5.36,-2.05,-4.943809983963524
Cc1cc(Br)ccc1NC(=O)CCN/C(N)=[NH+]/C[C@H]1CCCO1,C66246059_decoy,TRY1,Decoy,0,-8.51223,-5.1,-2.9,-5.669250063344868
CCCCNC(=O)[C@@H]1CC[C@@H](C)[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C66474081_decoy,TRY1,Decoy,0,-8.08396,-6.15,-3.72,-6.535490891446443
CCC[NH+]1Cc2cccc(N[C@@H](C)C(=O)Nc3sccc3C(N)=O)c2C1,C66968014_decoy,TRY1,Decoy,0,-8.86466,-7.12,-1.94,-8.606498555658964
CNC(=O)CCNC(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C67308340_decoy,TRY1,Decoy,0,-7.99699,-7.09,-3.48,-6.330424839296013
CCOc1ccc(NC(=O)c2cnc(N3CCC(C(N)=O)([NH+]4CCCCC4)CC3)nc2N)cc1,C67336506_decoy,TRY1,Decoy,0,-9.70457,-4.75,-3.29,-5.27276138159074
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)CC1,C67538798_decoy,TRY1,Decoy,0,-8.85388,-7.51,-1.47,-6.2833952782030345
CCCC(=O)Nc1cccc(NC(=O)NC2CC[NH+](CC(=O)NC)CC2)c1C,C67584911_decoy,TRY1,Decoy,0,-8.32169,-5.05,-1.92,-7.098072754339037
CCC(=O)Nc1ccc([C@@H](C)NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1,C67620686_decoy,TRY1,Decoy,0,-8.58405,-7.44,-4.72,-6.322527680388161
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)c2ccccc2F)CC1,C67631780_decoy,TRY1,Decoy,0,-8.68825,-7.42,-1.97,-7.379692586774262
O[C@H](C[NH2+]CCNc1ccc(C(F)(F)F)c[nH+]1)COc1ccccc1,C04299475_decoy,TRY1,Decoy,0,-6.11574,-6.65,-3.01,-5.166918449747954
CC[NH+](CC)CCNc1nc(NCC[NH+](CC)CC)c2cn[nH]c2n1,C04353495_decoy,TRY1,Decoy,0,-7.79921,-5.91,-1.09,-8.474579361408741
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCC[NH2+]C[C@@H](C)O)c2c1,C06491831_decoy,TRY1,Decoy,0,-7.82517,-5.9,-0.61,-4.837843720970207
C=CC[NH2+]Cc1cc(OC)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C11879409_decoy,TRY1,Decoy,0,-7.53212,-6.18,-2.31,-7.847121636714173
COc1cccc(C[NH2+]CCCO)c1OC[C@@H](O)C[NH+]1CCOCC1,C12453867_decoy,TRY1,Decoy,0,-7.26388,-5.62,-1.99,-7.957051299879123
CSCC[NH2+]Cc1cccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c1,C12580092_decoy,TRY1,Decoy,0,-8.7232,-4.85,-3.52,-5.429971094455816
CCOc1cc(C[NH2+]CCC[NH2+]CCO)cc(Br)c1OC,C13733037_decoy,TRY1,Decoy,0,-6.76958,-5.27,-3.11,-4.773075885544083
CC[NH+]1CCN(C[C@H](O)COc2cccc(C[NH2+]CCCO)c2)CC1,C20254927_decoy,TRY1,Decoy,0,-8.61616,-5.1,-2.43,-5.8952116994472
C[NH2+]CCC[NH2+]Cc1cc(Cl)ccc1OCC(=O)NC(C)(C)C,C20873546_decoy,TRY1,Decoy,0,-7.7735,-5.89,-2.26,-7.156904836405732
CC(C)[NH+](CCO)Cc1cccc(-c2nc3c(c(=O)[nH]2)C[NH2+]CC3)c1,C23250796_decoy,TRY1,Decoy,0,-9.00738,-7.03,-0.93,-5.866780000361469
CSCC[C@H]([NH3+])c1nc(C(=O)NCC[NH+](C(C)C)C(C)C)co1,C05977057_decoy,TRY1,Decoy,0,-8.8933,-5.07,-2.75,-5.701320491232608
CN(c1ncnc(NCCCn2cc[nH+]c2)c1N)C1CC[NH+](C)CC1,C40800738_decoy,TRY1,Decoy,0,-7.04576,-6.62,-1.4,-6.819635390947675
CCCC/[NH+]=C(\N)SCc1cc(O)oc2c/c(=[NH+]\C(C)=O)ccc1-2,C46437683_decoy,TRY1,Decoy,0,-7.76654,-6.43,-1.96,-5.78223808498595
COc1cc(C[NH2+]CC[NH2+]C[C@H](C)O)cc(Br)c1OC,C20500233_decoy,TRY1,Decoy,0,-6.95122,-3.97,-2.88,-4.6246251488692
COc1ccccc1[C@H](CNc1cc(C)[nH+]c(N)n1)[NH+]1CCCCC1,C52474142_decoy,TRY1,Decoy,0,-7.75326,-6.66,-2.08,-8.680927805112871
CCc1[nH+]ccn1CCC[NH2+]Cc1c(C)n(CC(N)=O)c2ccccc12,C55154317_decoy,TRY1,Decoy,0,-7.94159,-5.87,-2.93,-5.38159452521906
COc1cccc(C[NH2+]CC[NH2+]C[C@H](C)O)c1OCc1ccccc1F,C22075311_decoy,TRY1,Decoy,0,-8.13984,-4.91,-3.9,-4.972778576059291
COc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccccc1F,C22075313_decoy,TRY1,Decoy,0,-7.75061,-6.16,-2.8,-7.215776213789319
CCOc1cccc(C[NH2+]CC[NH2+]C[C@H](C)O)c1OCc1ccc(C)cc1,C20874115_decoy,TRY1,Decoy,0,-7.43583,-5.83,-3.13,-7.422000560242823
CCOc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)cc(Cl)c1OCc1ccc(C)cc1,C20874905_decoy,TRY1,Decoy,0,-7.82661,-5.81,-4.3,-5.059405471934618
CCOc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccccc1Cl,C22937093_decoy,TRY1,Decoy,0,-8.02493,-4.89,-4.11,-5.632882619126197
CCOc1cccc(C[NH2+]CC[NH2+]C[C@@H](C)O)c1OCc1ccccc1F,C22937117_decoy,TRY1,Decoy,0,-8.07845,-4.84,-0.99,-5.306284882563021
CCCNC(=O)C[NH+]1CCC(NC(=O)NCCCn2cc[nH+]c2)CC1,C47597441_decoy,TRY1,Decoy,0,-7.95779,-4.78,-1.86,-5.410250911188262
CNC(=O)C[NH+]1CCC(NC(=O)NCC[NH+](C(C)C)C(C)C)CC1,C60955672_decoy,TRY1,Decoy,0,-8.20669,-5.79,-2.83,-5.685694986539566
COc1ccc([C@H](C[NH2+]C[C@H](O)CO)C2=c3ccccc3=[NH+]C2)cc1,C63801447_decoy,TRY1,Decoy,0,-7.7887,-5.18,-1.84,-5.341671616927542
Cc1ccc(OC[C@@H](O)CNc2nc(C)[nH+]c3c2CC[NH2+]CC3)c(C)c1,C63844450_decoy,TRY1,Decoy,0,-9.22804,-7.27,-2.01,-6.939236375527921
OCCNc1nc(NCCC2=c3ccccc3=[NH+]C2)[nH+]c2ccccc12,C64428451_decoy,TRY1,Decoy,0,-7.2077,-7.38,-1.33,-7.31531060494615
Cc1c[nH+]ccc1NCCNC(=O)c1cn(C[C@@H]2CCC[NH2+]C2)nn1,C65372539_decoy,TRY1,Decoy,0,-8.39959,-7.18,-1.86,-6.815078016450646
CCCC1=C[C@H](C[NH+](C)C[C@@H]2NN[C@H](CC3CC[NH2+]CC3)N2C)N=N1,C65374419_decoy,TRY1,Decoy,0,-8.96706,-5.17,-1.13,-5.382163624805201
CC[NH+](CC)[C@@H](CNc1nc(CC[NH3+])nc2ccccc12)c1ccco1,C65395838_decoy,TRY1,Decoy,0,-9.17693,-6.17,-3.08,-8.70189477907218
c1ccc([C@H]2NC[NH+](CCCNc3cccnc3)[C@H]2c2[nH]cc[nH+]2)cc1,C65405944_decoy,TRY1,Decoy,0,-6.98331,-4.88,-2.47,-4.660244908550025
CCN1NC(C)=C(NC(=O)C[NH2+]CCC2=c3ccccc3=[NH+]C2)[C@H]1C,C65491128_decoy,TRY1,Decoy,0,-7.52236,-7.4,-1.69,-7.293523624293924
C[C@H](CCCC(C)(C)O)[NH+]1CN[C@H](c2ccccc2)[C@@H]1c1[nH]cc[nH+]1,C65508468_decoy,TRY1,Decoy,0,-5.38029,-4.82,-1.04,-3.885039708708296
CCCNC(=O)C[NH+]1CCC(NC(=O)NCC[NH+](C)[C@@H](C)CC)CC1,C66179966_decoy,TRY1,Decoy,0,-8.10041,-5.85,-2.88,-5.719875479077368
CC1CC[NH+]([C@@H](CN/C(N)=[NH+]/C[C@@H]2CCCO2)c2cccs2)CC1,C66242315_decoy,TRY1,Decoy,0,-9.21859,-4.92,-2.43,-4.753907801507968
CC1CC[NH+]([C@H](CN/C(N)=[NH+]/C[C@H]2CCCO2)c2cccs2)CC1,C66242318_decoy,TRY1,Decoy,0,-8.41563,-4.55,-1.92,-5.721378547619364
CC1CC[NH+]([C@@H](CN/C(N)=[NH+]/Cc2ccco2)c2cccs2)CC1,C66242321_decoy,TRY1,Decoy,0,-7.76293,-5.54,-1.93,-5.704026046888546
CC1CC[NH+]([C@H](CN/C(N)=[NH+]/Cc2ccco2)c2cccs2)CC1,C66242322_decoy,TRY1,Decoy,0,-9.52667,-4.99,-1.98,-5.382249858447499
N/C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)=[NH+]\C[C@@H]1CCCO1,C66242949_decoy,TRY1,Decoy,0,-8.96189,-5.31,-0.78,-5.368994380495487
N/C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)=[NH+]\C[C@H]1CCCO1,C66242951_decoy,TRY1,Decoy,0,-8.91076,-5.83,-0.48,-5.934089160598148
COCC/[NH+]=C(/N)NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C66243014_decoy,TRY1,Decoy,0,-9.21207,-4.64,-0.83,-5.9697685035782
CC[NH+](CC)CCOc1ccccc1CN/C(N)=[NH+]/Cc1ccco1,C66243331_decoy,TRY1,Decoy,0,-7.37993,-6.47,-1.49,-9.636567095931712
C[C@@H]1C[C@H](C)C[NH+](Cc2ccccc2CN/C(N)=[NH+]/Cc2ccco2)C1,C66243454_decoy,TRY1,Decoy,0,-7.42292,-4.9,-3.89,-5.332219580057836
C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CN/C(N)=[NH+]/Cc2ccco2)C1,C66243455_decoy,TRY1,Decoy,0,-7.59082,-6.61,-3.06,-5.555437843658993
COc1ccccc1[C@H](CN/C(N)=[NH+]/Cc1ccco1)[NH+]1CCCCC1,C66244074_decoy,TRY1,Decoy,0,-7.8283,-5.58,-0.71,-5.754191952234721
C[NH+]1CCN(Cc2ccccc2CN/C(N)=[NH+]/Cc2ccco2)CC1,C66245249_decoy,TRY1,Decoy,0,-7.97834,-5.84,-1.42,-5.3779023647376825
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)CC1,C67122230_decoy,TRY1,Decoy,0,-7.21771,-4.83,-0.3,-4.695436575843246
CC1CC[NH+](C[C@H](O)CNC(=O)NC2CC[NH+](C(C)C)CC2)CC1,C67582305_decoy,TRY1,Decoy,0,-9.13847,-6.76,-1.92,-6.537011075088639
CC(C)C[NH+]1CCC(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)CC1,C67614006_decoy,TRY1,Decoy,0,-9.25987,-6.29,-3.04,-6.282717446949218
CC1CC[NH+](C[C@H](O)CNC(=O)NCCC[NH+]2CCC[C@H](C)C2)CC1,C67619408_decoy,TRY1,Decoy,0,-7.8646,-6.67,-2.51,-5.81726305405895
CC[NH+]1CCN(c2nc(NCCC[NH+](C)C)nc(N)c2[N+](=O)[O-])CC1,C05157230_decoy,TRY1,Decoy,0,-7.92954,-4.39,-0.85,-5.165933029057946
CCOc1cc(C[NH2+]CCC[NH+](C)C)cc(Cl)c1OCC(N)=O,C08253755_decoy,TRY1,Decoy,0,-7.9561,-4.6,-4.35,-4.819169692346082
C=CC[NH2+]Cc1cc(OC)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C11879410_decoy,TRY1,Decoy,0,-8.87228,-5.5,-2.73,-6.389692015384235
COc1ccc(C[NH2+]CCCO)cc1OC[C@@H](O)C[NH+](C)C(C)C,C12437748_decoy,TRY1,Decoy,0,-7.87912,-6.54,-2.95,-7.541350534998512
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2cc[nH]n2)C[C@@]1(C)CO,C12305078_decoy,TRY1,Decoy,0,-6.84333,-6.98,-2.55,-7.173162980989636
COc1cccc(C[NH2+]CCC[NH2+]CCO)c1OCc1ccccc1F,C13732845_decoy,TRY1,Decoy,0,-8.66204,-6.32,-2.93,-7.042738987110657
C=CCOc1c(Br)cc(C[NH2+]CCC[NH2+]CCO)cc1OC,C13733161_decoy,TRY1,Decoy,0,-7.06197,-4.81,-1.73,-5.315900418448836
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH2+]CCCO)c2)CC1,C20254925_decoy,TRY1,Decoy,0,-8.52202,-6.1,-2.07,-6.206902706499929
CC(C)[NH2+]C[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N1CCN(c2cccc[nH+]2)CC1,C20465663_decoy,TRY1,Decoy,0,-6.571,-4.53,-2.36,-4.484909669499177
C[NH+](Cc1ccccc1)[C@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]C1CCOCC1,C20465964_decoy,TRY1,Decoy,0,-6.13481,-5.63,-1.99,-4.998640718661005
CCCOc1c(C[NH2+]CCC[NH2+]CCO)cc(Br)cc1OC,C20968379_decoy,TRY1,Decoy,0,-7.65059,-3.93,-3.3,-4.634782826966148
CCN(c1cccc(C)c1)c1[nH+]cnc(NCCCn2cc[nH+]c2)c1N,C40661995_decoy,TRY1,Decoy,0,-6.97137,-5.23,-3.61,-5.313752622570027
COc1cccc(C[NH2+]CCC[NH2+]CCO)c1OCc1ccccc1C,C40720704_decoy,TRY1,Decoy,0,-7.37179,-5.95,-2.55,-5.430603353941727
CCOc1cc(C[NH2+]CCC[NH2+]CCO)cc(Cl)c1OC(C)C,C40720721_decoy,TRY1,Decoy,0,-7.09073,-5.03,-3.9,-4.888965362280735
CCCNC(=O)C[NH+]1CCC(NC(=O)N[C@@H](C)Cn2cc[nH+]c2)CC1,C41171963_decoy,TRY1,Decoy,0,-8.80161,-5.7,-1.61,-6.384884206953809
CCCNC(=O)C[NH+]1CCC(NC(=O)NCC(C)(C)[NH+](C)C)CC1,C43188294_decoy,TRY1,Decoy,0,-6.88791,-4.7,-2.39,-4.40444946054444
CCCNC(=O)C[NH+]1CCC(NC(=O)NCC[NH+](CC)CC)CC1,C47578168_decoy,TRY1,Decoy,0,-8.13117,-5.45,-3.18,-5.3239301498780325
C[NH+](C)CC[NH+](C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)C1CCCC1,C20464920_decoy,TRY1,Decoy,0,-6.85606,-5.43,-2.78,-5.19998639251925
C[NH+](C)CC[NH+](C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)c1cccs1,C20464929_decoy,TRY1,Decoy,0,-6.759,-4.7,-2.42,-4.7233464390989495
Cc1[nH+]c2ccccn2c1[C@@H](C)SCCNC1=C(N)N=[S+](=O)N1,C26287470_decoy,TRY1,Decoy,0,-8.77709,-5.12,-1.57,-5.755976970946275
Cc1cccc(N2CC[NH+](CC[C@@H](C)Nc3cc(C)[nH+]c(N)n3)CC2)c1,C42110110_decoy,TRY1,Decoy,0,-8.47889,-5.95,-0.78,-4.911202279713977
COc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccccc1Cl,C22075192_decoy,TRY1,Decoy,0,-8.14225,-6.01,-2.38,-8.234116952471657
COc1cccc(C[NH2+]CC[NH2+]C[C@@H](C)O)c1OCc1ccccc1F,C22075309_decoy,TRY1,Decoy,0,-6.50716,-5.94,-3.24,-5.324915044903191
CCOc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccc(C)cc1,C20874117_decoy,TRY1,Decoy,0,-7.61131,-4.7,-1.7,-4.692760173884326
CCOc1cc(C[NH2+]CC[NH2+]C[C@H](C)O)cc(Cl)c1OCc1ccc(C)cc1,C20874907_decoy,TRY1,Decoy,0,-7.57453,-6.08,-2.59,-5.439093370326939
CCOc1cccc(C[NH2+]CC[NH2+]CCO)c1OCc1ccccc1F,C22937114_decoy,TRY1,Decoy,0,-7.79609,-5.52,-1.33,-5.578511919937443
CCOc1cccc(C[NH2+]CC[NH2+]C[C@H](C)O)c1OCc1ccccc1F,C22937120_decoy,TRY1,Decoy,0,-8.00804,-4.73,-2.67,-4.900268815483775
COc1ccc([C@@H](C[NH2+]C[C@H](O)CO)C2=c3ccccc3=[NH+]C2)cc1,C63801446_decoy,TRY1,Decoy,0,-8.01933,-6.01,-1.61,-5.369608986472334
Cc1ccc(OC[C@H](O)CNc2nc(C)[nH+]c3c2CC[NH2+]CC3)c(C)c1,C63844448_decoy,TRY1,Decoy,0,-9.57188,-7.52,-0.72,-9.280440477946964
CCCCN1N=C[C@@H](C)[C@@H]1NC(=O)[C@H]([NH3+])CC1=c2ccccc2=[NH+]C1,C63845705_decoy,TRY1,Decoy,0,-7.83164,-5.95,-2.55,-5.873214629267027
Cc1cc2ncc(C[NH2+]CCCC[NH+]3CCC(C(N)=O)CC3)cn2n1,C58314822_decoy,TRY1,Decoy,0,-7.90072,-6.29,-2.53,-5.506551836694544
Cc1cc2n([nH+]1)C[C@@H](C[NH2+]C[C@H](O)COc1c(C)cccc1C)CN2,C58299027_decoy,TRY1,Decoy,0,-7.8824,-5.71,-1.92,-4.974511365012975
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NCCC1[NH+]=c2ccccc2=[NH+]1,C64409720_decoy,TRY1,Decoy,0,-7.91314,-6.12,-3.48,-5.034327349950404
Cc1c[nH+]ccc1NCCNC(=O)c1cn(C[C@H]2CCC[NH2+]C2)nn1,C65372540_decoy,TRY1,Decoy,0,-8.20859,-6.49,-2.41,-5.310792616849772
CC[NH+](CC)[C@H](CNc1nc(CC[NH3+])nc2ccccc12)c1ccco1,C65395839_decoy,TRY1,Decoy,0,-8.88749,-6.34,-3.55,-9.083677110107656
c1ccc([C@H]2NC[NH+](CCSc3cn[nH]n3)[C@H]2c2[nH]cc[nH+]2)cc1,C65397705_decoy,TRY1,Decoy,0,-7.57697,-7.13,-0.6,-8.763113807527079
c1ccc([C@H]2NC[NH+](CCSc3cn[nH]n3)[C@@H]2c2[nH]cc[nH+]2)cc1,C65397707_decoy,TRY1,Decoy,0,-7.49172,-6.88,-0.46,-7.056512566180118
c1ccc([C@@H]2NC[NH+](CCCNc3cccnc3)[C@H]2c2[nH]cc[nH+]2)cc1,C65405945_decoy,TRY1,Decoy,0,-6.94807,-5.58,-3.46,-4.534548502534839
c1ccc([C@@H]2NC[NH+](CCCNc3cccnc3)[C@@H]2c2[nH]cc[nH+]2)cc1,C65405947_decoy,TRY1,Decoy,0,-6.58588,-5.21,-1.35,-4.444679906056465
CCN1NC(C)=C(NC(=O)C[NH2+]CCC2=c3ccccc3=[NH+]C2)[C@@H]1C,C65491131_decoy,TRY1,Decoy,0,-7.57357,-7.43,-2.0,-7.473184688217214
CC(C)Cn1c[nH+]cc1CNc1cc(N2CC[NH+](C)CC2)nc(N)n1,C65525829_decoy,TRY1,Decoy,0,-8.21363,-6.67,-1.31,-5.565810274379267
N/C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)=[NH+]\C[C@H]1CCCO1,C66242952_decoy,TRY1,Decoy,0,-8.77824,-5.17,-0.77,-5.405493136860208
N/C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)=[NH+]\Cc1ccco1,C66242956_decoy,TRY1,Decoy,0,-8.97083,-6.98,-1.14,-7.919795041444601
COCC/[NH+]=C(/N)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C66243013_decoy,TRY1,Decoy,0,-8.47008,-4.53,-1.75,-5.54094802605976
COc1ccccc1[C@@H](CN/C(N)=[NH+]/Cc1ccco1)[NH+]1CCCCC1,C66244073_decoy,TRY1,Decoy,0,-8.20346,-5.29,0.12,-5.166197994871518
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)CC1,C67122231_decoy,TRY1,Decoy,0,-7.62721,-5.89,-2.21,-6.482471960921056
CC1CC[NH+](C[C@@H](O)CNC(=O)NC2CC[NH+](C(C)C)CC2)CC1,C67582307_decoy,TRY1,Decoy,0,-9.03022,-5.42,-2.56,-5.231490672231249
CC1CC[NH+](C[C@@H](O)CNC(=O)NCc2ccc[nH+]c2N(C)C)CC1,C67618902_decoy,TRY1,Decoy,0,-8.52354,-7.08,-3.15,-8.79594990985916
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCC[NH+]2CCC[C@H](C)C2)CC1,C67619431_decoy,TRY1,Decoy,0,-8.16589,-6.61,-1.6,-6.529938091910841
CCCC[NH+]1CCC(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)CC1,C67639057_decoy,TRY1,Decoy,0,-9.29054,-4.67,-1.55,-5.820576084021468
O=C(N[C@@H](NC(=S)Nc1ccccc1O)C(Cl)(Cl)Cl)c1cccc([N+](=O)[O-])c1,C01446563_decoy,TRY1,Decoy,0,-7.34146,-7.2,-1.64,-7.973620279345844
COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(Cl)c2)ccc1OCC(N)=O,C02268328_decoy,TRY1,Decoy,0,-8.37715,-5.33,-1.89,-5.839699748951404
C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)COC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C11441386_decoy,TRY1,Decoy,0,-8.95412,-5.76,-3.05,-6.220837912717612
NC(=O)c1c(NC(=S)NC(=O)c2ccc(-c3ccccc3[N+](=O)[O-])o2)sc2c1CCCC2,C14269425_decoy,TRY1,Decoy,0,-8.07042,-6.94,-1.71,-5.983063719190306
Nn1c(N/N=C/c2ccccc2F)nnc1SCC(=O)Nc1ccccc1Br,C20528110_decoy,TRY1,Decoy,0,-7.77672,-8.11,-1.73,-6.544889830469991
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCC(=O)N(C1CCCCC1)C1CCCCC1,C20915737_decoy,TRY1,Decoy,0,-9.67306,-6.42,-2.93,-7.387649637602333
Cc1ccc(/C=N/Nc2nnc(SCCC(=O)Nc3c(Cl)cccc3Cl)n2N)cc1,C20917953_decoy,TRY1,Decoy,0,-8.90404,-8.27,-2.08,-10.154312586736271
O=C(CSc1n[nH]c(N/N=C/c2ccccc2Cl)n1)NNC(=O)c1ccc(Cl)cc1,C20923394_decoy,TRY1,Decoy,0,-9.02968,-9.2,-2.41,-8.29876724340088
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)Nc1ccccc1F,C21079994_decoy,TRY1,Decoy,0,-9.84812,-7.97,-1.74,-7.587721357096828
Nn1c(N/N=C/c2cccc(Cl)c2)nnc1SCC(=O)Nc1cccc(Cl)c1Cl,C21321792_decoy,TRY1,Decoy,0,-9.93231,-8.84,-2.81,-9.51222632903083
COc1cc(/C=N/n2c(-c3ccc(O)c(C(N)=O)c3)cs/c2=N\C[C@@H]2CCCO2)ccc1O,C21334110_decoy,TRY1,Decoy,0,-9.0879,-6.35,-1.88,-6.148188257233079
COc1ccc2c(CCN/C(=N\C(=O)Nc3ccc(C)cc3)Nc3nc(C)cc(C)n3)c[nH]c2c1,C08758541_decoy,TRY1,Decoy,0,-8.79012,-7.78,-1.09,-6.343740270137263
COc1ccc(Cl)cc1-c1n[nH]c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1,C09491561_decoy,TRY1,Decoy,0,-10.7823,-7.67,-2.98,-7.64494703492947
CCc1cccc(CC)c1N1C(=O)[C@H]2[C@@H](c3cc(C)c(O)c(C)c3)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]2C1=O,C33623404_decoy,TRY1,Decoy,0,-7.19391,-6.37,-2.05,-6.009904614132983
CC[C@@]1(C)C[C@@H](OC(=O)CSc2n[nH]c(N)n2)[C@]2(C)[C@H](C)CC[C@]3(CCC(=O)[C@@H]32)[C@H](C)[C@@H]1O,C35636375_decoy,TRY1,Decoy,0,-8.88542,-6.75,-3.39,-7.964088139265074
O=C(NC1CCCCC1)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccco1)c1cccc(Cl)c1,C36483614_decoy,TRY1,Decoy,0,-7.02243,-5.18,-0.84,-5.204286285358302
COc1ccccc1C(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36494146_decoy,TRY1,Decoy,0,-6.56941,-5.36,-0.85,-5.778172410175428
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccc(Cl)cc1,C36497363_decoy,TRY1,Decoy,0,-7.94755,-6.31,-3.77,-6.560146073038093
O=C(NC1CCCCC1)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccco1)c1ccccc1Cl,C36543940_decoy,TRY1,Decoy,0,-6.80202,-6.96,-2.52,-5.810284567317391
CCCCC/C=C\C(=O)N(Cc1ccc(C)o1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36557372_decoy,TRY1,Decoy,0,-7.94755,-5.32,-3.28,-6.119500026544814
CCCCC/C=C\C(=O)N(Cc1ccc(C)o1)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36557393_decoy,TRY1,Decoy,0,-8.22679,-6.9,-1.59,-7.655486611725757
COc1ccccc1NC(=O)NC[C@@]1(C)C[C@@H](NC(=O)Nc2ccccc2OC)CC(C)(C)C1,C00758089_decoy,TRY1,Decoy,0,-8.8081,-5.03,-2.82,-5.634235859144469
Cc1ccc(C)c(NC(=O)CSC2=NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccccc2)c1,C39361527_decoy,TRY1,Decoy,0,-7.77697,-8.57,-3.53,-7.427635167356052
Cc1ccc(C)c(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccccc2)c1,C39361528_decoy,TRY1,Decoy,0,-8.40959,-7.79,-2.9,-6.902459177198433
Cc1ccc(NC(=O)CSC2=NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccccc2)c(C)c1,C39361529_decoy,TRY1,Decoy,0,-7.20548,-7.99,-1.05,-6.820983749655276
O=C(CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccccc1)Nc1cccc(Cl)c1,C39361540_decoy,TRY1,Decoy,0,-8.60956,-6.69,-2.04,-5.71020765697928
Cc1cccc(N2C(SCC(=O)Nc3ccccc3C)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361695_decoy,TRY1,Decoy,0,-8.46736,-8.58,-3.23,-8.818914259663261
Cc1cccc(N2C(SCC(=O)Nc3ccccc3C)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361696_decoy,TRY1,Decoy,0,-8.29858,-7.23,-2.75,-8.426389499211911
Cc1cccc(N2C(SCC(=O)Nc3ccc(F)cc3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361713_decoy,TRY1,Decoy,0,-8.74236,-6.01,-2.77,-5.798067305855809
Cc1ccc(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)cc1,C39362746_decoy,TRY1,Decoy,0,-9.15403,-5.7,-1.8,-5.8963426020744505
O=C1C[C@@H](C(=O)Nc2ccccc2Sc2ccccc2)c2c(nc(Nc3cccc(Cl)c3)[nH]c2=O)N1,C40399371_decoy,TRY1,Decoy,0,-8.21692,-9.16,-2.82,-6.8937020037699
Cc1cccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NC[C@@H]3CCCO3)CCC4)[nH]n2)c1O,C40527296_decoy,TRY1,Decoy,0,-10.8036,-7.62,-3.32,-7.029597565923408
COCCCNC(=O)c1c(NC(=O)c2cc(-c3ccc(C)c(C)c3O)n[nH]2)sc2c1CCCC2,C40549735_decoy,TRY1,Decoy,0,-10.0271,-7.06,-1.98,-6.843766832982654
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NCc3ccco3)CCCC4)[nH]n2)c(O)c1C,C40549738_decoy,TRY1,Decoy,0,-9.664,-9.37,-1.87,-8.524013802615293
Cc1cc(O)c(-c2cc(C(=O)Nc3sc4c(c3C(=O)NC[C@H]3CCCO3)CCCC4)[nH]n2)cc1C,C40549841_decoy,TRY1,Decoy,0,-10.6164,-8.42,-1.42,-9.693858245150594
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(Nc3cccc4ccc(C)nc34)c2N)cc1,C40758547_decoy,TRY1,Decoy,0,-10.1005,-6.83,-3.23,-6.695772402998112
COc1cc([C@@H]2[C@@H](C(=O)Nc3ccccc3C)C(=O)C[C@](C)(O)[C@H]2C(=O)Nc2ccccc2C)ccc1O,C41006563_decoy,TRY1,Decoy,0,-9.93473,-6.2,-1.07,-6.6830393788719205
COCCNc1nc(Nc2sc3c(c2C(N)=O)CCCC3)c2cnn(-c3ccccc3)c2n1,C41025983_decoy,TRY1,Decoy,0,-8.996,-2.26,-2.1,-4.230620519288324
NC(=O)c1c(Nc2nc(NCc3ccco3)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026288_decoy,TRY1,Decoy,0,-8.16032,-7.61,-2.8,-6.676753295311119
COc1cc2ncc3c(N)nc(-c4cncc(Nc5ccc(CCO)cc5)c4)cc3c2cc1OC,C45256335_decoy,TRY1,Decoy,0,-8.72524,-9.39,-2.79,-6.274555006457522
[NH3+][C@@H](Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)[O-])C[C@@H](c2cccc(F)c2)CC1,C49111660_decoy,TRY1,Decoy,0,-8.78118,-8.28,-2.26,-6.579885836878952
Cc1n[nH]c(O)c1[C@H](c1ccc(OC(=O)c2ccc(Cl)cc2Cl)cc1)c1c(O)n[nH]c1C,C19959550_decoy,TRY1,Decoy,0,-9.00234,-6.24,-2.31,-6.018587942292566
CCOc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)ccc1OC(=O)c1ccccc1Cl,C19885983_decoy,TRY1,Decoy,0,-7.97308,-6.95,-2.83,-6.404393630496892
COc1ccc(O)c(/C=N/Nc2nc(SCC(=O)Nc3ccc(Cl)cc3Cl)n[nH]2)c1,C58998011_decoy,TRY1,Decoy,0,-10.5997,-8.0,-4.22,-8.336625998413268
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(Cl)c3Cl)n[nH]2)c1O,C58998282_decoy,TRY1,Decoy,0,-11.6431,-8.81,-1.99,-8.098234103768988
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Br)ccc3O)n2)c(F)c1,C59016964_decoy,TRY1,Decoy,0,-10.5457,-8.39,-4.64,-7.726474211596201
CC[NH+](CC)c1ccc(NC(=O)CSc2n[nH]c(N/N=C(C)\C=C\c3ccccc3)n2)cc1,C59023103_decoy,TRY1,Decoy,0,-8.71283,-8.01,-2.36,-6.978855139555457
CCCCc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC(N)=O)C(=O)Nc3ccc(F)cc32)cc1,C20518233_decoy,TRY1,Decoy,0,-7.9904,-5.25,-1.43,-5.105052670003047
CCCCc1ccc(N2C(=O)[C@@H]3[C@H](CC(N)=O)N[C@@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C20518236_decoy,TRY1,Decoy,0,-7.29596,-5.06,-3.31,-5.048893972779554
CCCCc1ccc(N2C(=O)[C@@H]3[C@H](CC(N)=O)N[C@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C16010214_decoy,TRY1,Decoy,0,-8.90426,-7.74,-1.02,-6.525771131555822
CC[C@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C04161157_decoy,TRY1,Decoy,0,-7.93346,-5.48,-1.8,-6.250847105971359
C[C@@H](C(=O)NC(C)(C)C)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04192195_decoy,TRY1,Decoy,0,-7.96919,-7.02,-2.56,-8.17076674594918
C[C@@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04192199_decoy,TRY1,Decoy,0,-8.2012,-7.29,-1.97,-10.74307867484672
C[C@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCC1,C04192249_decoy,TRY1,Decoy,0,-7.48079,-7.75,-3.73,-9.05937360569444
C[C@H](C(=O)NC[C@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCC1,C04192258_decoy,TRY1,Decoy,0,-8.21545,-5.42,-0.14,-6.136462139116805
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04252531_decoy,TRY1,Decoy,0,-7.53751,-7.68,-4.14,-9.45339769327808
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C04252534_decoy,TRY1,Decoy,0,-7.31997,-8.22,-2.48,-9.71622486531446
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04252537_decoy,TRY1,Decoy,0,-8.03549,-8.51,-3.5,-9.215319481635571
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C04252539_decoy,TRY1,Decoy,0,-7.63804,-7.35,-2.04,-9.39848374952203
CCc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1CC,C04430517_decoy,TRY1,Decoy,0,-6.64408,-4.99,-1.55,-5.415917094798215
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C04557300_decoy,TRY1,Decoy,0,-7.67255,-8.25,-2.24,-10.062137507733416
Cc1[nH]c(=O)nc(N/N=C/c2ccc(Cl)cc2)c1C(=O)NC(C)(CO)CO,C06483466_decoy,TRY1,Decoy,0,-7.64091,-6.39,-1.79,-6.713239505466147
Cc1oc2cc3oc(=O)c(CC(=O)N(C)C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc2c1C,C08764565_decoy,TRY1,Decoy,0,-7.39132,-7.77,-3.27,-5.644240681465805
Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc(N2CCOCC2)c1[N+](=O)[O-],C09090567_decoy,TRY1,Decoy,0,-8.02914,-5.28,-1.39,-5.004797972494052
CO/N=C(/C(=O)N[C@H](C=O)[C@@H]1[NH2+][C@@H](C(=O)[O-])C(C)(C)S1)c1csc(N)n1,C12503617_decoy,TRY1,Decoy,0,-8.77541,-5.55,-3.72,-6.536773577017784
CO/N=C(/C(=O)N[C@H](C=O)[C@H]1[NH2+][C@@H](C(=O)[O-])C(C)(C)S1)c1csc(N)n1,C12503621_decoy,TRY1,Decoy,0,-8.46371,-4.93,-1.62,-5.446583107260908
NC(=O)c1nsc(C(=O)N(Cc2ccc(F)cc2)[C@H](C(=O)NC[C@H]2CCCO2)c2ccncc2)c1N,C06444814_decoy,TRY1,Decoy,0,-8.36744,-6.09,-1.22,-6.645326785989651
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13424694_decoy,TRY1,Decoy,0,-7.65438,-8.28,-2.64,-9.793001127036188
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C14652612_decoy,TRY1,Decoy,0,-7.51842,-8.2,-2.79,-8.711376751705092
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C14652615_decoy,TRY1,Decoy,0,-5.27893,-8.11,-3.6,-6.631968542811898
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C15774936_decoy,TRY1,Decoy,0,-7.38874,-8.17,-2.25,-7.546393419198567
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@H](O)[C@@H](O)CO)c1ccc([N+](=O)[O-])cc1,C15774938_decoy,TRY1,Decoy,0,-7.88986,-8.52,-0.96,-10.8766204793827
O=C(CSc1nc(O)cc(O)n1)NNC(=O)CSc1nc(O)cc(O)n1,C15777498_decoy,TRY1,Decoy,0,-8.96826,-6.5,-3.3,-7.246158353104273
CCC(=O)NNC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20921587_decoy,TRY1,Decoy,0,-8.71099,-5.89,-1.93,-6.54551236109022
COC(=O)c1c(NC(=O)CSc2nnc(NN)n2N)sc2c1CCCC2,C20922428_decoy,TRY1,Decoy,0,-10.2412,-7.71,-0.71,-7.91074508706763
CC[C@@]1(C)NC(=O)N(NC(=O)CNc2cc([N+](=O)[O-])ccc2NCCO)C1=O,C22017827_decoy,TRY1,Decoy,0,-7.49202,-7.13,-2.95,-7.6226209889547825
CC[C@]1(C)NC(=O)N(NC(=O)CNc2cc([N+](=O)[O-])ccc2NCCO)C1=O,C22017831_decoy,TRY1,Decoy,0,-7.49914,-6.12,-3.17,-5.684391775553627
C=C(C)CCO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H]1O,C31162155_decoy,TRY1,Decoy,0,-5.91155,-6.65,-1.76,-5.063969808948997
O=C(OCc1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)C=CCC[C@@H]1O,C31165580_decoy,TRY1,Decoy,0,-7.27676,-7.93,-1.7,-7.560776606783844
CC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](c4ccc(C#N)cc4)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C2=O)cc1,C33516263_decoy,TRY1,Decoy,0,-7.70824,-8.56,-1.61,-7.71726882355495
CN(CCO)S(=O)(=O)c1ccc2c(c1)C(=NNC(N)=O)c1cc(S(=O)(=O)N(C)CCO)ccc1-2,C01757441_decoy,TRY1,Decoy,0,-9.06228,-7.44,-3.21,-7.02643123508699
CO/N=C(/C(=O)N[C@H](C=O)[C@H]1[NH2+][C@H](C(=O)[O-])C(C)(C)S1)c1csc(N)n1,C38665163_decoy,TRY1,Decoy,0,-7.79498,-6.32,-1.53,-8.166900610940967
CO/N=C(/C(=O)N[C@H](C=O)[C@@H]1[NH2+][C@H](C(=O)[O-])C(C)(C)S1)c1csc(N)n1,C38665165_decoy,TRY1,Decoy,0,-8.76098,-6.46,-1.56,-10.218181100925223
Cc1nc(SCC(=O)N[C@H]2SC=C[C@H]2C(N)=O)[nH]c(=O)c1CCC(=O)O,C39667878_decoy,TRY1,Decoy,0,-8.34643,-7.1,-2.54,-5.841978649730514
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C43465384_decoy,TRY1,Decoy,0,-6.0984,-6.97,-3.12,-7.47881125579326
O=C(CCc1ccccc1)c1c(O)cc(O)cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C43465385_decoy,TRY1,Decoy,0,-6.28293,-8.43,-1.15,-9.230129162778049
C[C@@]12C=CC(=O)C=C1CC[C@H]1[C@H]2[C@@H](O)C[C@]2(C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)[C@H]([NH3+])CCC(=O)[O-],C43743529_decoy,TRY1,Decoy,0,-9.74873,-7.24,-3.49,-6.602623468901399
C/C=C/C#CC#C[C@H](O)[C@@H](/C=C/CCCO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C44460322_decoy,TRY1,Decoy,0,-8.59911,-6.87,-3.33,-7.49705533228862
C/C=C/C#CC#C[C@@H](O)[C@H](/C=C/CCCO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C44460325_decoy,TRY1,Decoy,0,-9.18759,-5.44,-3.14,-5.843912418457732
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C46866513_decoy,TRY1,Decoy,0,-8.88147,-5.46,-3.33,-5.288039394512714
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C46866515_decoy,TRY1,Decoy,0,-8.05198,-5.51,-2.85,-6.805386675600554
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C46866517_decoy,TRY1,Decoy,0,-8.79097,-5.55,-2.25,-6.7569746425326125
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C46866519_decoy,TRY1,Decoy,0,-8.71008,-5.47,-3.44,-6.06926019389722
O[C@H]1[C@H](O)[C@@H](OCCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C49600056_decoy,TRY1,Decoy,0,-4.40603,-6.42,-2.2,-4.416548851494885
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@H]1c1ccc(OCC(N)=O)cc1,C09135109_decoy1,TRY1,Decoy,0,-8.63517,-7.82,,-9.351704179079292
CCN(CC)S(=O)(=O)[C@H]1C=C[C@H]2NC(=O)C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)C2=C1,C39943061_decoy,TRY1,Decoy,0,-7.17204,-6.58,-3.64,-5.640349820536412
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@@H]1c1ccc(OCC(N)=O)cc1,C09135109_decoy2,TRY1,Decoy,0,-8.01496,-4.83,,-5.370244399542234
CCNc1nc(NCC)n2c(SCC(=O)NNC(=O)NC3CC3)nnc2n1,C64900303_decoy,TRY1,Decoy,0,-8.04502,-5.52,-2.62,-7.316306324411209
N#Cc1c(CCCNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)n[nH]c1N,C67321274_decoy,TRY1,Decoy,0,-8.83891,-6.3,-0.69,-5.510488406077648
C[C@H](OC(=O)C[C@@H](NC(N)=O)c1ccc(Cl)cc1)C(=O)NCc1ccco1,C07509719_decoy,TRY1,Decoy,0,-7.14542,-6.79,-3.57,-5.9010028259606
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=S)NC[C@H]1CCCO1,C15898669_decoy,TRY1,Decoy,0,-7.19815,-7.15,-2.0,-5.508102952817636
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=S)NC[C@@H]1CCCO1)C2=O,C15898850_decoy,TRY1,Decoy,0,-8.3818,-5.18,-1.53,-5.773603883064244
O=C(C[C@@H]1Sc2ccccc2NC1=O)NNC(=S)NC[C@@H]1CCCO1,C15900148_decoy,TRY1,Decoy,0,-8.6261,-7.08,-1.27,-7.360856256126317
COCCCNC(=S)NNC(=O)CSCC(=O)Nc1ccc(F)cc1,C15909830_decoy,TRY1,Decoy,0,-8.91588,-6.05,-3.71,-7.205683055247559
Cc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)o1,C20835020_decoy,TRY1,Decoy,0,-7.62899,-5.54,-1.85,-4.960401074428336
CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2cccs2)n1CCC(N)=O,C22408361_decoy,TRY1,Decoy,0,-9.71255,-6.43,-2.9,-6.944391152229267
COCCCNC(=S)NNC(=O)CCCNC(=O)c1ccc(F)cc1F,C22624967_decoy,TRY1,Decoy,0,-7.81782,-6.58,-3.99,-5.846874071606057
CCCn1c(CCC(=O)NNC(=O)c2cc(C)oc2C)nc2cc(S(N)(=O)=O)ccc21,C27617675_decoy,TRY1,Decoy,0,-10.3765,-7.8,-2.82,-8.466635671707271
CN(C)S(=O)(=O)c1cccc(NC(=S)Nc2ccc(N)c([N+](=O)[O-])c2)c1,C36275153_decoy,TRY1,Decoy,0,-6.92556,-5.8,-3.77,-5.033209740160308
CC(C)CN1C(=O)N=C([O-])[C@@H](C(=O)CSc2nc(C(C)(C)C)n[nH]2)[C@@H]1[NH3+],C38763067_decoy,TRY1,Decoy,0,-8.8322,-6.61,-2.23,-7.220938716756909
O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C/C=N/NC(=O)[C@@H]1C(=O)NC[C@@H]1c1ccccc1,C39252971_decoy,TRY1,Decoy,0,-8.63465,-5.5,-3.15,-7.220237459976135
O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C/C=N/NC(=O)[C@@H]1C(=O)NC[C@@H]1c1ccccc1,C39252973_decoy,TRY1,Decoy,0,-9.0198,-5.3,-1.52,-6.080872169759294
CC(C)c1nnc(NC(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)s1,C43697493_decoy,TRY1,Decoy,0,-7.87808,-7.59,-2.15,-6.536741314178228
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1,C45703951_decoy,TRY1,Decoy,0,-7.67041,-6.81,-2.8,-5.918287707690115
Cn1ccnc1[C@](O)(CCNC(=O)NNc1cccc(C#N)c1)C(F)(F)F,C45716231_decoy,TRY1,Decoy,0,-7.8398,-6.44,-2.1,-6.034083565220359
CCOCCCNC(=S)NNC(=O)c1ccccc1CN1C(=O)CNC1=O,C46585958_decoy,TRY1,Decoy,0,-6.63839,-6.23,-3.85,-6.226895546357291
NC(=O)c1ccsc1NC(=O)C(=O)NCCc1cnn(-c2ccccc2)c1,C47969408_decoy,TRY1,Decoy,0,-8.55604,-7.28,-2.45,-7.579181240967074
CCn1nc(C(=O)NNC(=O)NCC(=O)NCC(C)C)c2ccccc2c1=O,C50118074_decoy,TRY1,Decoy,0,-7.3843,-6.28,-0.85,-6.681040727684763
CCCNc1ncc(Br)cc1S(=O)(=O)NCCCC(N)=O,C50660340_decoy,TRY1,Decoy,0,-8.23636,-6.32,-4.52,-7.752128972556562
O=C(NCCNC(=O)c1ccccc1F)NNc1ccc(-n2cccn2)nn1,C52583307_decoy,TRY1,Decoy,0,-7.24995,-7.74,-1.92,-5.9559136857353625
C[C@H](N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1)C(=O)NC(=O)NC1CC1,C56184274_decoy,TRY1,Decoy,0,-7.84744,-5.25,-2.86,-4.764229503117648
NS(=O)(=O)CCNC(=O)CCCCCn1c(=S)[nH]c2ccccc2c1=O,C56850894_decoy,TRY1,Decoy,0,-8.23146,-7.17,-3.36,-5.904004441091903
CCCn1c(N)c(C(=O)CN2CCC[C@@H](NS(C)(=O)=O)C2)c(=O)[nH]c1=O,C32916289_decoy,TRY1,Decoy,0,-7.88361,-5.9,-3.18,-5.266577485542499
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cccc(NC(N)=O)c2)c1C,C58570377_decoy,TRY1,Decoy,0,-8.64779,-7.38,-2.02,-6.170484890252886
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NCCO,C59814703_decoy,TRY1,Decoy,0,-9.53165,-5.33,-1.56,-5.898024310043066
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2ccc(Cl)cc2)n1,C59879152_decoy,TRY1,Decoy,0,-9.03982,-7.34,-1.46,-9.797661297194898
COCCNc1ccc(C(=O)NNC(=O)NCC(F)(F)F)cc1[N+](=O)[O-],C60411659_decoy,TRY1,Decoy,0,-6.06191,-6.47,-2.65,-5.655218802022094
CC(C)NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)/C=C/c1ccccc1,C61544451_decoy,TRY1,Decoy,0,-6.94091,-7.7,-1.72,-6.953155352028014
CNC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@H](O)c1ccc(Cl)cc1,C62206679_decoy,TRY1,Decoy,0,-8.33085,-5.72,-2.31,-5.81868927436943
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCC(C(=O)NC)CC1,C63406732_decoy,TRY1,Decoy,0,-7.06431,-6.98,-4.12,-5.254445401045854
O=C(CNC1=NS(=O)(=O)c2ccccc21)NNC(=S)NCC(F)(F)F,C64080520_decoy,TRY1,Decoy,0,-6.28802,-5.72,-0.7,-4.232720731074015
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)NNC(=O)NCCCn1cc[nH+]c1,C64375757_decoy,TRY1,Decoy,0,-8.28093,-6.87,-3.4,-6.015074611869741
O=C(Cc1csc(NC(=O)Cc2cccs2)n1)NNC(=O)NC1CC1,C64427685_decoy,TRY1,Decoy,0,-9.53579,-6.03,-1.55,-6.3006019576906
O=C(NCC1=C[C@@H](c2ccccc2)ON1)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C64683682_decoy,TRY1,Decoy,0,-7.24788,-8.63,-1.61,-7.456244794874451
CN1[C@@H](SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])NN[C@@H]1c1cccs1,C64684870_decoy,TRY1,Decoy,0,-8.39736,-7.86,-2.13,-8.06151586029396
COCCNC(=O)NNC(=O)[C@@H](CCSC)NC(=O)COc1ccccc1,C64887254_decoy,TRY1,Decoy,0,-7.27772,-6.53,-2.39,-6.721369727375778
CCCNS(=O)(=O)c1ccc(/C=C/C(=O)NNC(=O)NCCOC)cc1,C64898822_decoy,TRY1,Decoy,0,-7.12351,-5.78,-3.82,-5.16507913838937
CCS(=O)(=O)NCCCNC(=O)NCc1ccc(S(=O)(=O)NC)s1,C65379383_decoy,TRY1,Decoy,0,-8.53442,-5.89,-3.39,-5.544524663542919
C[C@@H](NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)NCc1ccco1,C65912954_decoy,TRY1,Decoy,0,-7.45404,-6.44,-2.91,-6.160180409952766
C[C@@H](NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)C(=O)NCc1ccco1,C65913271_decoy,TRY1,Decoy,0,-8.06804,-7.56,-1.96,-7.111564775540391
CC(=O)N[C@@H](CC(=O)Nc1nc(CC(N)=O)cs1)c1c(F)cccc1F,C66281312_decoy,TRY1,Decoy,0,-8.55411,-7.0,-3.11,-7.472127336607794
Cc1cc(NC(=O)[C@H](C)SCC(=O)N[C@@H]2CCCN(CC(N)=O)C2)no1,C66450499_decoy,TRY1,Decoy,0,-9.57755,-6.22,-2.65,-6.551975505623829
Cc1cc(NC(=O)[C@@H](C)SCC(=O)N[C@H]2CCCN(CC(N)=O)C2)no1,C66450502_decoy,TRY1,Decoy,0,-8.06067,-5.22,-4.95,-5.304823401178617
O=C(CCNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1)NC1CCCC1,C66998178_decoy,TRY1,Decoy,0,-8.18399,-8.15,-3.18,-6.853695846421899
CCCCN(CC(N)=O)C(=O)[C@@H]1CCC[C@H](C(=O)N(CCCC)CC(N)=O)C1,C67052492_decoy,TRY1,Decoy,0,-8.80331,-5.72,-2.87,-6.539844394805747
CCCCN(CC(N)=O)C(=O)[C@@H]1CCC[C@@H](C(=O)N(CCCC)CC(N)=O)C1,C67052494_decoy,TRY1,Decoy,0,-8.91057,-5.75,-2.98,-10.644139066710194
CC(C)CCC(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F,C67064873_decoy,TRY1,Decoy,0,-7.3649,-6.08,-4.21,-5.544760832658746
CC(C)CCC(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F,C67064874_decoy,TRY1,Decoy,0,-7.08779,-5.37,-1.83,-5.191672328937426
CCOCCCNC(=O)NNC(=O)[C@H](CCSC)NC(=O)c1ccco1,C67313965_decoy,TRY1,Decoy,0,-7.18968,-4.96,-1.65,-5.832411541887407
COc1ccccc1N1CC[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNC(=S)Nc2ccc(N(C)C)cc2)CC1,C08635638_decoy,TRY1,Decoy,0,-10.1946,-8.31,-3.35,-7.119780551110469
S=C(NCC[NH+]1CCOCC1)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CN1CCc2ccccc21,C08635727_decoy,TRY1,Decoy,0,-8.91272,-5.35,-2.83,-5.58492833346761
CSc1cccc(NC(=O)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1,C08635960_decoy,TRY1,Decoy,0,-9.91886,-7.81,-3.28,-6.744967767154437
N#Cc1cccc(NC(=O)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2CCN(c3ccc(F)cc3)CC2)c1,C08635968_decoy,TRY1,Decoy,0,-9.75502,-7.79,-2.38,-6.265867017526031
COC[C@H]1CCC[NH+]1C[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=S)Nc1ccc(-n2cccn2)cc1,C08635995_decoy,TRY1,Decoy,0,-8.48644,-6.7,-2.59,-6.338383262128184
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1cccc(F)c1F)NCC1([NH+]2CCCCC2)CCCC1,C12199027_decoy,TRY1,Decoy,0,-9.1642,-7.83,-1.28,-8.120596236063621
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1cccc(F)c1F)NCC1([NH+]2CCCCC2)CCCC1,C12199033_decoy,TRY1,Decoy,0,-9.85378,-7.9,-2.34,-6.738452968061245
O=C1NC(C[NH+](CCCc2ccccc2)Cc2nc3cc(Cl)ccc3c(=O)[nH]2)=[NH+][C@H]2C=C(Cl)C=C[C@@H]12,C13145752_decoy,TRY1,Decoy,0,-10.4074,-8.07,-1.91,-8.752155434474385
S=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2)CC1)Nc1ccccc1,C08636251_decoy,TRY1,Decoy,0,-9.12205,-7.32,-2.6,-6.026490257738856
O=c1cc(C[NH+]2CCN(c3ccccc3Cl)CC2)nc(N2CC[NH+](Cc3ccccc3O)CC2)[nH]1,C35564309_decoy,TRY1,Decoy,0,-8.69145,-7.64,-1.97,-5.738163834454051
CC[NH+](CC(=O)Nc1ccccc1OC)CC(=O)N[C@H]1N=C(C2=c3ccccc3=[NH+]C2)CS1,C38775095_decoy,TRY1,Decoy,0,-7.8895,-8.46,-2.81,-7.174431244150885
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@@H](NCCc3c[nH+]c[nH]3)C[C@@H](CC(C)C)[NH+]21,C39560901_decoy,TRY1,Decoy,0,-10.0188,-7.48,-1.88,-9.661299049338744
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NC[C@@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c1F,C39594702_decoy,TRY1,Decoy,0,-9.9522,-6.21,-3.21,-6.578869961451828
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c1F,C39594710_decoy,TRY1,Decoy,0,-9.17053,-8.21,-2.35,-8.501052294453768
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630782_decoy,TRY1,Decoy,0,-7.77133,-5.67,-2.0,-5.534709615101193
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39630883_decoy,TRY1,Decoy,0,-9.84716,-7.42,-1.26,-7.149078388179128
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39663922_decoy,TRY1,Decoy,0,-9.96784,-7.88,-2.14,-12.105263563692418
CC[C@H](C)C(=O)N1C[C@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39664060_decoy,TRY1,Decoy,0,-10.0865,-6.77,-1.45,-6.688390045190132
CC[C@H](C)C(=O)N1C[C@@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39664062_decoy,TRY1,Decoy,0,-8.86911,-7.9,-3.02,-8.339357645160748
Cc1ccc(CC(=O)N2C[C@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@H]3C)C3(CC[NH2+]CC3)C2)cc1,C39674858_decoy,TRY1,Decoy,0,-9.40988,-5.86,-4.71,-5.84217108469992
Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)c1F,C39675743_decoy,TRY1,Decoy,0,-8.30323,-8.17,-3.2,-6.381978653035719
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39675758_decoy,TRY1,Decoy,0,-8.4462,-8.32,-2.61,-8.704138223580468
Cc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39675759_decoy,TRY1,Decoy,0,-9.82175,-6.7,-1.6,-6.815568872763331
Cc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39675761_decoy,TRY1,Decoy,0,-8.17552,-8.32,-2.26,-6.14137685367261
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39679078_decoy,TRY1,Decoy,0,-9.7474,-7.58,-2.31,-7.1428286907503455
CCCC[NH+]1CCC(CNC(=O)[C@@H]2CN(C(=O)c3ccc(F)cc3F)CC23CC[NH2+]CC3)CC1,C39683437_decoy,TRY1,Decoy,0,-10.4963,-5.96,-1.77,-7.208026432773789
CCCC[NH+]1CCC(CNC(=O)[C@@H]2CN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC23CC[NH2+]CC3)CC1,C39683461_decoy,TRY1,Decoy,0,-9.82669,-6.72,-2.98,-6.415443404170366
CCCC[NH+]1CCC(CNC(=O)[C@@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)CC1,C39683535_decoy,TRY1,Decoy,0,-10.8861,-6.47,-3.33,-7.018488678189677
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)CC1,C39683536_decoy,TRY1,Decoy,0,-9.13496,-7.35,-3.75,-6.66042931578897
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NC2CCN(c3cccc[nH+]3)CC2)C2(CC[NH2+]CC2)C1,C39687422_decoy,TRY1,Decoy,0,-8.61473,-6.68,-1.4,-5.747066879308372
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)NC2CCN(c3cccc[nH+]3)CC2)C2(CC[NH2+]CC2)C1,C39687423_decoy,TRY1,Decoy,0,-9.42051,-7.33,-2.98,-6.229829695686309
CC[C@H](C)CC(=O)N1C[C@H](C(=O)NC2CCN(c3[nH+]cccc3C)CC2)C2(CC[NH2+]CC2)C1,C39687701_decoy,TRY1,Decoy,0,-7.86934,-6.64,-2.3,-5.577915178556907
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NC2CCN(c3[nH+]cccc3C)CC2)C2(CC[NH2+]CC2)C1,C39687703_decoy,TRY1,Decoy,0,-8.13456,-5.88,-1.91,-5.765525152737576
S=C(NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2)CC1)Nc1ccccc1,C43527332_decoy,TRY1,Decoy,0,-9.35496,-6.66,-1.76,-6.11336224176669
N#Cc1cncc(-c2nc3c(N4CCC[C@H]([NH3+])C4)cccc3n2CC[NH2+]Cc2ccccc2)c1,C45192677_decoy,TRY1,Decoy,0,-10.6001,-7.99,-2.92,-10.068328830508356
CCC[NH+]1CCC(N2C[C@@H]([NH2+]Cc3ccc(F)c(F)c3)C[C@H]2C(=O)NCCc2ccc3c(c2)OCO3)CC1,C23339311_decoy,TRY1,Decoy,0,-10.033,-7.76,-1.56,-7.925050729714311
C[C@@H](NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1)[C@@H](c1cccs1)N1CC[NH+](C)CC1,C63663795_decoy,TRY1,Decoy,0,-8.58338,-7.42,-3.18,-6.147172505736256
C[C@@H](NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1)[C@H](c1cccs1)N1CC[NH+](C)CC1,C63663799_decoy,TRY1,Decoy,0,-8.62297,-7.99,-2.55,-6.533278700858827
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1C[C@@H](c2ccccc2)N([C@@H]2CCS(=O)(=O)C2)N1,C63694344_decoy,TRY1,Decoy,0,-7.8087,-8.7,-1.49,-7.578694870489179
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1C[C@H](c2ccccc2)N([C@@H]2CCS(=O)(=O)C2)N1,C63694349_decoy,TRY1,Decoy,0,-8.64192,-7.73,-3.57,-6.613095144185235
CSCC[C@H](NC(=O)CNC(=O)c1ccc(Br)o1)C1[NH+]=c2ccccc2=[NH+]1,C63731176_decoy,TRY1,Decoy,0,-8.99172,-7.36,-3.36,-7.066832392384681
C[NH+](C)[C@H](CNC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1ccc(F)cc1)c1cccs1,C63807620_decoy,TRY1,Decoy,0,-9.67225,-7.98,-1.33,-8.567768258907693
CC(C)CCNC(=O)c1cn(CC(C)C)cc(C(=O)NCCC2[NH+]=c3ccccc3=[NH+]2)c1=O,C64040375_decoy,TRY1,Decoy,0,-7.74845,-7.98,-3.7,-7.491580867448776
COc1cc(C[C@@]2(CCC(=O)NC[C@@H]3[NH+]=c4ccc(Cl)cc4=[NH+]3)CCC(=O)N2)ccc1F,C64044069_decoy,TRY1,Decoy,0,-8.66843,-8.07,-3.11,-6.668014047231997
COc1cc(C[C@@]2(CCC(=O)NC[C@H]3[NH+]=c4ccc(Cl)cc4=[NH+]3)CCC(=O)N2)ccc1F,C64044071_decoy,TRY1,Decoy,0,-8.04152,-7.23,-2.22,-6.667924920494959
CC(C)(O)C#Cc1ccc(C[NH+]2CCC3(CC2)C[C@@H]3C(=O)NCCC2=c3ccccc3=[NH+]C2)cc1,C64066832_decoy,TRY1,Decoy,0,-9.75987,-8.76,-3.39,-6.926892411445931
O=C(CSc1nnc2n1[C@@H](c1ccccc1)Nc1ccccc1-2)NCC1[NH+]=c2ccccc2=[NH+]1,C64427107_decoy,TRY1,Decoy,0,-7.55765,-7.56,-3.5,-5.865629838674528
CCN1C(=O)[C@H]([NH+]2CCC(C(=O)NCCC3=c4ccccc4=[NH+]C3)CC2)Nc2cccnc21,C64502350_decoy,TRY1,Decoy,0,-9.07807,-8.6,-1.45,-7.263332984956031
CCC[NH+]1CCC(N2C[C@@H]([NH2+]Cc3ccc(C(F)(F)F)cc3)C[C@H]2C(=O)NC(C)C)CC1,C23362286_decoy,TRY1,Decoy,0,-9.53551,-7.02,-1.9,-7.706432664922862
Cc1ccc2c(c1)=[NH+][C@@H](CNS(=O)(=O)c1cc([C@H]3NC(c4ccc(F)cc4)=NO3)sc1C)[NH+]=2,C64746041_decoy,TRY1,Decoy,0,-9.16983,-9.0,-1.65,-6.294975952037407
Nc1cn([C@@H]2O[C@H](CC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05810997_decoy,TRY1,Decoy,0,-6.38034,-8.53,-1.07,-7.474104113689436
CC(C)(C)C(=O)Nc1cc(NC(=O)C(C)(C)C)cc(C(=O)Nc2c[nH]c(=O)[nH]c2=O)c1,C02900986_decoy,TRY1,Decoy,0,-8.13756,-6.9,-1.45,-5.989442625932348
CCC(C)(C)NC(=O)[C@@H](c1ccc(N(C)C)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06077418_decoy,TRY1,Decoy,0,-7.69414,-7.74,-1.79,-8.593984502271278
CN(C)c1ccc([C@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1,C06135927_decoy,TRY1,Decoy,0,-9.07457,-8.25,-3.58,-8.768638513807222
CC(=O)NCCNC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccc(C(C)C)cc3)[C@@H]21,C08254691_decoy,TRY1,Decoy,0,-9.5817,-6.42,-1.3,-6.772646426896016
CC(=O)NCCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(OC(F)(F)F)cc3)S[C@@H]21,C08636375_decoy,TRY1,Decoy,0,-9.03717,-7.99,-3.24,-7.104895580285888
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccc(Cl)cc2)c1,C12477257_decoy,TRY1,Decoy,0,-7.98634,-6.82,-2.65,-7.359832533979638
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC2CCCC2)c1,C12701327_decoy,TRY1,Decoy,0,-7.95039,-5.32,-3.31,-5.278813475052421
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C)C(=O)NC2CCCC2)c1,C12701334_decoy,TRY1,Decoy,0,-7.07131,-7.41,-2.29,-7.196721090864187
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12702139_decoy,TRY1,Decoy,0,-7.27666,-7.3,-2.91,-7.440120757459505
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2cccs2)c1,C12711022_decoy,TRY1,Decoy,0,-7.91516,-5.88,-1.93,-5.731565518711162
Cc1ccc(C(=O)N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@@H](O)[C@@H](O)CO)cc1,C15775300_decoy,TRY1,Decoy,0,-9.02274,-6.32,-1.53,-6.479172822125394
Cc1ccc(C(=O)N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@H](O)[C@@H](O)CO)cc1,C15775302_decoy,TRY1,Decoy,0,-8.47478,-8.27,-1.09,-9.46004450470064
Cc1ccc(C(=O)N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@@H](O)[C@H](O)CO)cc1,C15775304_decoy,TRY1,Decoy,0,-8.13163,-6.97,-1.59,-6.447702040674029
Cc1ccc(C(=O)N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@H](O)[C@H](O)CO)cc1,C15775306_decoy,TRY1,Decoy,0,-8.30762,-8.81,-1.07,-7.632756588032913
Nc1c(Cl)c(Cl)nc(C(=O)NNC(=S)Nc2ccc([N+](=O)[O-])cc2)c1Cl,C16273821_decoy,TRY1,Decoy,0,-9.15265,-7.21,-3.74,-6.317499352126699
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3cc(Cl)ccc3O)n2N)sc2c1CCCC2,C21320303_decoy,TRY1,Decoy,0,-11.3422,-9.46,-2.45,-11.026254577052423
Nc1nc(COC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)nc(Nc2ccccc2)n1,C16804731_decoy,TRY1,Decoy,0,-7.80118,-8.54,-4.39,-7.436377487533355
Cc1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)C2CCCC2)o1,C26146804_decoy,TRY1,Decoy,0,-8.37324,-7.32,-2.58,-9.55500334634851
Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1/N=N/c1ccc(S(N)(=O)=O)cc1,C17312740_decoy,TRY1,Decoy,0,-9.86326,-7.79,-1.31,-6.769067820760944
Cc1ccc(C)c([C@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)C(=O)[C@@H]23)c1,C33703754_decoy,TRY1,Decoy,0,-6.91364,-7.09,-1.5,-6.431348874787415
C[C@H]1C[NH2+][C@@H](C(=O)NCCc2ccc(S(=O)(=O)/N=C(\[O-])NC3CCCCC3)cc2)CN1,C21983749_decoy,TRY1,Decoy,0,-8.94989,-5.84,-2.62,-4.8287570837834695
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)C(C)(C)C,C36584087_decoy,TRY1,Decoy,0,-4.39629,-4.98,-3.08,-4.102665681756389
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)C(C)(C)C,C36584088_decoy,TRY1,Decoy,0,-6.60117,-5.65,-0.78,-5.476012491099842
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc(O)cc1)C(C)(C)C,C36586365_decoy,TRY1,Decoy,0,-5.52957,-5.85,-1.36,-4.392861960264943
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc(O)cc1)C(C)(C)C,C36586366_decoy,TRY1,Decoy,0,-5.42597,-5.64,-1.77,-4.790280242404479
Cc1ccc(CN(C(=O)[C@@H]2CCC(=O)N2)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36601091_decoy,TRY1,Decoy,0,-8.59817,-5.31,-4.66,-5.721273116906045
CO[C@@H]1O[C@H](OC)[C@@](O)(CC[C@@]2(O)[C@H](C)C[C@@H](O)[C@H]3[C@@](C)(CO)CCC[C@]32C)[C@@H]1O,C36378633_decoy,TRY1,Decoy,0,-7.55808,-6.14,-2.8,-5.765631926447007
CO[C@@H]1O[C@H](OC)[C@@](O)(CC[C@@]2(O)[C@H](C)C[C@@H](O)[C@@H]3[C@@](C)(CO)CCC[C@]32C)[C@@H]1O,C36378632_decoy,TRY1,Decoy,0,-7.68041,-5.32,-3.15,-5.0072969271887935
CO[C@@H]1O[C@H](OC)[C@](O)(CC[C@@]2(O)[C@H](C)C[C@@H](O)[C@H]3[C@@](C)(CO)CCC[C@]32C)[C@@H]1O,C36378631_decoy,TRY1,Decoy,0,-6.61858,-6.33,-2.41,-5.143885516020113
CO[C@@H]1O[C@H](OC)[C@](O)(CC[C@@]2(O)[C@H](C)C[C@@H](O)[C@@H]3[C@@](C)(CO)CCC[C@]32C)[C@@H]1O,C36378630_decoy,TRY1,Decoy,0,-8.20717,-4.64,-4.47,-4.821540210842724
Cc1cccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)c1C,C38990278_decoy,TRY1,Decoy,0,-9.12398,-9.69,-1.98,-7.315133943341236
NN1[C@@H](SCC(=O)Nc2ccc(Cl)cc2)NN[C@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39007641_decoy,TRY1,Decoy,0,-9.81884,-6.51,-1.58,-6.066588190420252
NN1[C@@H](SCC(=O)Nc2ccc(F)cc2)NN[C@@H]1[C@@H]1C=C(c2ccc(Cl)cc2)N=N1,C39012408_decoy,TRY1,Decoy,0,-9.80019,-6.49,-1.59,-6.558321792071368
C[C@]1(c2ccc(NC(=N/O)/C(=N/O)c3ccccc3)cc2)NC(=O)N(c2ccccc2)N1,C39448608_decoy,TRY1,Decoy,0,-8.73475,-6.18,-1.86,-5.734332879349443
C[C@@]1(c2ccc(NC(=N/O)/C(=N/O)c3ccccc3)cc2)NC(=O)N(c2ccccc2)N1,C39448609_decoy,TRY1,Decoy,0,-7.41592,-6.55,-2.65,-5.644989381456719
Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558997_decoy,TRY1,Decoy,0,-8.42585,-8.27,-2.3,-7.293666348828597
O=C(CCCNC(=O)c1ccc(F)cc1F)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39559024_decoy,TRY1,Decoy,0,-8.62582,-9.03,-2.53,-10.740961753327516
Cc1ccc(C)c(NC(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)c1,C39592723_decoy,TRY1,Decoy,0,-8.62806,-8.55,-1.49,-6.463052352013895
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@@H](SCC(=O)Nc4c(C)cccc4C(C)C)N3N)N=N2)cc1,C38995935_decoy,TRY1,Decoy,0,-9.76451,-8.22,-1.45,-6.739331312756518
COc1ccc(C)cc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N,C40684411_decoy,TRY1,Decoy,0,-8.69692,-7.87,-2.72,-6.718210760200263
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1N1CCN(CCO)CC1,C40734449_decoy,TRY1,Decoy,0,-8.71601,-6.65,-1.52,-8.503902928939137
COc1ccc(C(=O)NNc2ncnc(Nc3ccc(Br)cn3)c2N)cc1,C40779834_decoy,TRY1,Decoy,0,-9.5154,-5.8,-2.5,-6.174008250830926
Cc1c(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)oc2c1/C(=N/NC(N)=S)CCC2,C40824599_decoy,TRY1,Decoy,0,-8.32388,-7.43,-3.75,-6.290103486619926
CC(C)(C)N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cc(Cl)cc(Cl)c1Cl,C33874518_decoy,TRY1,Decoy,0,-10.0764,-6.51,-2.58,-6.705390681892627
COc1cc2c(cc1NC(=O)/C=C(\C)NNC(=O)c1ccccc1N)oc1ccccc12,C08740481_decoy,TRY1,Decoy,0,-8.28637,-7.67,-0.81,-6.234910977965453
COc1ccc(-c2n[nH]c3c2[C@@H](c2cn(CC(N)=O)nc2-c2ccccc2)C(C#N)=C(N)O3)cc1,C08437643_decoy,TRY1,Decoy,0,-5.90228,-4.86,-2.14,-3.83070886155536
Cc1c(C(N)=O)sc2[nH]c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3O)nc(=O)c12,C62038976_decoy,TRY1,Decoy,0,-9.9722,-7.26,-1.38,-8.035658408595078
CC1=C2C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)S[C@H]2N(Cc2ccc(F)cc2)N1,C39936262_decoy,TRY1,Decoy,0,-8.78511,-8.97,-1.64,-7.848486311197034
C=CCC(CCC)(C(=O)Nc1ccc2[nH+]c(C)cc(N)c2c1)C(=O)Nc1ccc2[nH+]c(C)cc(N)c2c1,C01646553_decoy,TRY1,Decoy,0,-10.0728,-8.91,-3.86,-10.35202054769048
CC(C)(C)NC(=O)[C@@H](c1ccc(Cl)cc1)N(Cc1ccccc1F)C(=O)c1snc(C(N)=O)c1N,C06074454_decoy,TRY1,Decoy,0,-8.19146,-7.72,-3.07,-8.61978389557876
CC(C)(C)NC(=O)[C@H](c1ccc(Cl)cc1)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06074855_decoy,TRY1,Decoy,0,-8.62779,-6.31,-3.47,-6.616767946598545
CC(C)CCNC(=O)[C@@H](c1ccco1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)c(Cl)c1,C06134283_decoy,TRY1,Decoy,0,-8.27596,-6.68,-3.38,-7.2267898368667876
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccco2)cc1,C06190824_decoy,TRY1,Decoy,0,-8.29214,-6.5,-1.51,-6.034452050716944
CCC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06501166_decoy,TRY1,Decoy,0,-8.92682,-6.98,-3.46,-7.962015778338162
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCC(C)C)c1ccc(O)cc1,C06860609_decoy,TRY1,Decoy,0,-7.81172,-7.04,-3.57,-9.215990134216277
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@@H]([NH2+]CCNC(C)=O)C[C@@H](c3ccc(C(C)C)cc3)[NH+]21,C08636055_decoy,TRY1,Decoy,0,-8.18155,-5.73,-1.94,-5.548742521488335
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H]([NH2+]CCNC(C)=O)C[C@@H](c3ccc(C(C)C)cc3)[NH+]21,C08636056_decoy,TRY1,Decoy,0,-9.73585,-6.19,-3.33,-6.170664155495343
C[C@@H](C(=O)NCCc1ccc(S(N)(=O)=O)cc1)[NH+]1CCCN(c2ccc(C(F)(F)F)c[nH+]2)CC1,C08940490_decoy,TRY1,Decoy,0,-7.32679,-6.92,-2.25,-5.461762748402401
C/C(CCc1ccccc1)=N\NC(=O)c1nnn(-c2nonc2N)c1CNc1ccccc1C(N)=O,C09234747_decoy,TRY1,Decoy,0,-8.84936,-8.04,-2.21,-7.476962830583763
C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1ccc(OCC(N)=O)cc1,C09498926_decoy,TRY1,Decoy,0,-8.47269,-7.51,-2.05,-7.396213595489773
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCC(C)C)c1ccc(F)cc1,C12473037_decoy,TRY1,Decoy,0,-7.26164,-5.23,-1.61,-5.619014193901177
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)cc1,C12473172_decoy,TRY1,Decoy,0,-7.61745,-7.82,-2.43,-7.570437051474669
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c(C)c1,C12473230_decoy,TRY1,Decoy,0,-7.6878,-7.37,-1.77,-7.068722779275137
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(O)cc2)cc1C,C12474022_decoy,TRY1,Decoy,0,-8.16325,-5.31,-1.55,-5.6670378309577005
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(Cl)cc2)c1,C12479728_decoy,TRY1,Decoy,0,-8.65035,-7.79,-2.38,-8.669540783314545
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(Cl)cc2)c(C)c1,C12479770_decoy,TRY1,Decoy,0,-7.77324,-7.28,-1.32,-7.933645727689896
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](CC(C)C)C(=O)NC2CCCC2)c(C)c1,C12701863_decoy,TRY1,Decoy,0,-7.58742,-5.22,-2.14,-5.462207743153097
Cc1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C12706214_decoy,TRY1,Decoy,0,-7.37926,-5.83,-3.73,-5.578455289287709
Cc1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)o1,C12714835_decoy,TRY1,Decoy,0,-8.69124,-7.56,-3.3,-10.958829120280994
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCCC(=O)Nc1c(Cl)cccc1Cl,C20915295_decoy,TRY1,Decoy,0,-9.4493,-8.39,-1.76,-9.4555002516028
Nn1c(N/N=C/c2c(O)ccc3ccccc23)nnc1SCCC(=O)Nc1ccccc1Cl,C20916615_decoy,TRY1,Decoy,0,-10.464,-8.74,-3.12,-7.769795096982585
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(=O)OC2,C22064281_decoy,TRY1,Decoy,0,-7.0384,-5.02,-3.21,-5.287962697907087
[NH3+][C@@H](CO)c1nc(C(=O)N[C@@H](CSCc2ccccc2)C(=O)Nc2ccc([N+](=O)[O-])cc2)co1,C33596873_decoy,TRY1,Decoy,0,-10.0144,-7.36,-2.56,-8.7347173596076
Cc1cc(O)oc2c/c(=[NH+]\C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)CCC(=O)[O-])ccc1-2,C35395468_decoy,TRY1,Decoy,0,-7.72344,-7.51,-2.16,-7.977856352663189
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc(O)cc1)c1ccccc1Cl,C36544972_decoy,TRY1,Decoy,0,-6.58084,-6.33,-3.37,-5.877182450318546
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)CO)c1ccccc1Cl,C36547680_decoy,TRY1,Decoy,0,-8.82882,-6.16,-3.26,-6.512156765626143
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586648_decoy,TRY1,Decoy,0,-8.31286,-6.41,-0.79,-7.139372591624806
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1ccc(O)cc1,C36597188_decoy,TRY1,Decoy,0,-8.67696,-6.04,-2.88,-6.38120628122113
CC[C@@H](C(=O)NC[C@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(Cl)cc1,C06631858_decoy,TRY1,Decoy,0,-8.29804,-6.0,-0.33,-6.063570548503167
CCOC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C38989527_decoy,TRY1,Decoy,0,-7.90376,-9.03,-2.84,-9.619136735266304
CCCCc1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39007203_decoy,TRY1,Decoy,0,-9.92651,-9.03,-0.99,-7.876846398478706
CC[C@@H](C)c1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39007586_decoy,TRY1,Decoy,0,-10.5326,-9.17,-2.07,-8.376056546117589
CCOC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39021275_decoy,TRY1,Decoy,0,-10.0707,-8.58,-2.8,-7.937718171367888
Cc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1cccc(NC(=O)CSc3nc4ccc(C)cc4[nH]3)n1)[NH+]=2,C39253070_decoy,TRY1,Decoy,0,-9.86948,-8.68,-2.17,-9.966292310507292
C/C(=C\C(=O)OCCOCCOC(=O)/C=C(\C)NC1CC(C)(C)[NH2+]C(C)(C)C1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C12378706_decoy,TRY1,Decoy,0,-9.70609,-6.47,-2.48,-6.662849792304288
CC[NH+]1[C@@H](SCC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NN[C@H]1c1ccc(C(C)(C)C)cc1,C39923299_decoy,TRY1,Decoy,0,-8.57678,-8.26,-1.79,-7.879304248689857
CC[NH+]1[C@@H](SCC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NN[C@@H]1c1ccc(C(C)(C)C)cc1,C39923300_decoy,TRY1,Decoy,0,-10.0367,-9.0,-3.11,-9.749389241053452
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH2+]C(C)(C)CO)cc1Cl,C43024064_decoy,TRY1,Decoy,0,-8.93196,-7.86,-1.54,-6.262307465862969
Oc1ccc(CCNc2nc(NCCCOc3ccccc3-c3cccnc3)nc(N3CC[NH2+]CC3)n2)cc1,C45187028_decoy,TRY1,Decoy,0,-10.0443,-7.7,-3.74,-7.778703137602429
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)NCC[NH+]1CC=C(C2=c3ccccc3=[NH+]C2)CC1,C52627267_decoy,TRY1,Decoy,0,-11.2883,-7.9,-1.62,-7.226654688839702
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CONC1=CC[C@]2(C)C(=C1)CC[C@@H]1[C@H]2[C@H](O)C[C@@]2(C)[C@H]1CC[C@@]2(C)O,C01883964_decoy,TRY1,Decoy,0,-11.4791,-9.27,-3.13,-9.658841592278328
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1ccccc1SCc1ccccc1,C58994301_decoy,TRY1,Decoy,0,-11.4928,-10.23,-2.75,-9.549502761002383
CC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)cc1,C63489321_decoy,TRY1,Decoy,0,-9.29155,-7.95,-2.47,-7.815708480744114
O=C(CNC(=O)c1ncccc1C(=O)NCC[C@H]1C=c2ccccc2=[NH+]1)NCC[C@@H]1C=c2ccccc2=[NH+]1,C63818495_decoy,TRY1,Decoy,0,-8.40509,-10.01,-1.44,-7.365416681247765
COC(=O)[C@@H]1[C@H](NC(=O)c2ccco2)c2cc(NCc3c[nH]c(C)[nH+]3)c[nH+]c2N1CCC(C)C,C63985707_decoy,TRY1,Decoy,0,-8.81486,-5.51,-3.17,-5.516661845049313
COC(=O)C1=CN([C@H]2C[C@@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)[NH+](Cc3ccoc3)C2)NN1,C64061291_decoy,TRY1,Decoy,0,-8.23497,-6.43,-1.44,-5.950413945068791
CCOC(=O)c1sc(Nc2ccc(NC(=O)C[C@@H]([NH2+]CCOCCO)C(=O)[O-])cc2)nc1C,C65090318_decoy,TRY1,Decoy,0,-7.81172,-5.72,-2.51,-5.870146413795466
Nc1c(C(=O)Nc2ccc(OC(F)(F)F)cc2)sc(Nc2ccc(Cl)cc2)c1C(=O)NC1CC1,C03287719_decoy,TRY1,Decoy,0,-9.62979,-7.32,-3.35,-7.15248059075915
CC(C)CCNC(=O)[C@@H](c1ccc(Cl)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06134147_decoy,TRY1,Decoy,0,-7.9745,-7.87,-2.45,-7.045582631409872
CC(C)CCNC(=O)[C@@H](c1ccc(Cl)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06134154_decoy,TRY1,Decoy,0,-9.04389,-6.14,-1.03,-7.742135462757025
CC(C)CCNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06134205_decoy,TRY1,Decoy,0,-6.34993,-7.19,-1.08,-7.047508664716864
CC(C)CCNC(=O)[C@H](c1ccc(Cl)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06134458_decoy,TRY1,Decoy,0,-8.63869,-6.13,-2.43,-7.431998420610467
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccc(Cl)cc2)cc1,C06190801_decoy,TRY1,Decoy,0,-7.61749,-6.93,-3.62,-8.082506910761659
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(Cl)cc2)cc1,C06190840_decoy,TRY1,Decoy,0,-7.41154,-7.87,-1.13,-7.857357414941939
COCCNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06190845_decoy,TRY1,Decoy,0,-7.23147,-5.0,-1.7,-5.169183503917601
CCC(C)(C)NC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06077420_decoy,TRY1,Decoy,0,-9.26756,-8.45,-4.4,-9.23332377849904
CCC(C)(C)NC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06077427_decoy,TRY1,Decoy,0,-9.6386,-8.0,-2.78,-9.79250495874905
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(OC)c(OC)c1,C06462271_decoy,TRY1,Decoy,0,-8.87233,-7.17,-1.11,-8.563302569632842
CCOC(=O)CNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06547000_decoy,TRY1,Decoy,0,-6.78967,-7.67,-2.43,-7.594830171941862
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(O)cc2)cc1,C06601051_decoy,TRY1,Decoy,0,-8.67887,-5.53,-1.44,-6.453676042467118
COc1ccc(OC[C@@H](O)C[NH2+]C2CC[NH+](C[C@@H](O)COc3ccc(Cl)c(Cl)c3)CC2)cc1,C12338948_decoy,TRY1,Decoy,0,-10.1154,-7.6,-2.31,-6.93804177583847
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(F)cc2)c1C,C12473055_decoy,TRY1,Decoy,0,-7.70936,-5.74,-0.48,-6.281206216107341
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(F)cc2)c(C)c1,C12473067_decoy,TRY1,Decoy,0,-8.41632,-6.99,-2.61,-8.428052430470254
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(F)cc2)c1,C12473071_decoy,TRY1,Decoy,0,-7.5599,-6.67,-3.25,-7.912425746475317
NC(=O)c1nsc(C(=O)N(c2ccccc2F)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1N,C12473317_decoy,TRY1,Decoy,0,-8.44345,-6.65,-2.1,-6.0253977927394775
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12477072_decoy,TRY1,Decoy,0,-6.64229,-6.48,-2.57,-5.627304101372657
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(Cc2ccccc2Cl)C(=O)c2snc(C(N)=O)c2N)cc1,C12479444_decoy,TRY1,Decoy,0,-9.69842,-6.34,-2.29,-7.967404460371388
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cc(C)ccc2C)cc1,C12479550_decoy,TRY1,Decoy,0,-7.32756,-6.66,-2.97,-7.051512471181579
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12479557_decoy,TRY1,Decoy,0,-7.89814,-6.78,-3.48,-7.561744502270547
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(Cl)cc2)c(C)c1,C12479775_decoy,TRY1,Decoy,0,-8.45313,-5.29,-2.28,-5.788321345292175
Cc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2ccccc2Cl)C(=O)c2snc(C(N)=O)c2N)cc1,C12702039_decoy,TRY1,Decoy,0,-8.80341,-7.89,-1.91,-9.080167973338709
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12702164_decoy,TRY1,Decoy,0,-8.35944,-7.44,-3.75,-7.258245984771991
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccc(N(C)C)cc2)cc1C,C06280315_decoy,TRY1,Decoy,0,-8.14598,-7.28,-2.41,-7.871753261510936
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccc(N(C)C)cc2)cc1,C06245114_decoy,TRY1,Decoy,0,-8.38388,-8.75,-1.42,-8.423513619978348
COCCNC(=O)[C@@H](c1ccc2ncccc2c1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06136207_decoy,TRY1,Decoy,0,-7.70138,-6.01,-4.22,-5.746365050637954
CCCCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(O)ccc3ccccc23)n1N,C20916357_decoy,TRY1,Decoy,0,-9.84684,-9.11,-3.25,-8.601261476737033
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cc(Cl)ccc3Cl)n2N)c(O)c1,C21325635_decoy,TRY1,Decoy,0,-11.2871,-7.62,-1.82,-7.86413602936473
Cc1[nH]/c(=N\C(=S)NC(=O)c2ccc(Cl)cc2)sc1C(/C=C/c1ccco1)=N/NC(N)=S,C25585349_decoy,TRY1,Decoy,0,-10.5122,-8.54,-1.11,-8.024382354742938
Cc1[nH]/c(=N\C(=S)NC(=O)c2ccco2)sc1C(/C=C/c1ccc(Cl)cc1)=N/NC(N)=S,C25585424_decoy,TRY1,Decoy,0,-11.4275,-8.38,-3.89,-8.345009181012289
NC(=S)NN=C1c2cc(OCC[NH+]3CCCCC3)ccc2-c2ccc(OCC[NH+]3CCCCC3)cc21,C31848010_decoy,TRY1,Decoy,0,-9.13938,-8.1,-1.96,-7.748113939594402
C/C(=C\Cc1c(O)cc(C)c(C=O)c1O)CC/C=C(\C)CCCC(C)(C)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35465654_decoy,TRY1,Decoy,0,-8.04598,-7.89,-4.1,-5.881895603537422
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484852_decoy,TRY1,Decoy,0,-7.97485,-5.25,-2.88,-5.854602570854455
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1ccccc1Cl,C36545180_decoy,TRY1,Decoy,0,-7.29159,-6.1,-2.79,-6.091843127711426
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1ccccc1Cl,C36545368_decoy,TRY1,Decoy,0,-6.96855,-6.84,-3.0,-6.717456875888235
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548369_decoy,TRY1,Decoy,0,-8.1222,-7.82,-2.53,-8.296809274289508
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)c1cccc(Cl)c1,C36552855_decoy,TRY1,Decoy,0,-8.75336,-6.82,-1.89,-6.251625626800696
Cc1ccc(CN(C(=O)c2ccccc2O)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36595290_decoy,TRY1,Decoy,0,-7.35289,-6.74,-1.53,-6.060922691561605
NC(=O)c1nsc(C(=O)N(c2ccc(Cl)cc2)[C@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1N,C12706379_decoy,TRY1,Decoy,0,-7.71495,-7.16,-2.84,-8.632060900072561
C/C(=C\C(=O)OCCOC(=O)/C=C(\C)NC1CC(C)(C)[NH2+]C(C)(C)C1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C19638791_decoy,TRY1,Decoy,0,-9.33917,-8.09,-4.05,-7.040262811213238
CC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](c4cc5ccccc5o4)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C2=O)cc1,C33910429_decoy,TRY1,Decoy,0,-7.67119,-8.5,-2.12,-7.666678400614118
C[NH+](C)CCCOc1ccc(C[NH2+]CC(C)(C)c2nc(-c3ccc(Cl)c(O)c3)c(-c3ccncc3)[nH]2)cc1,C45334512_decoy,TRY1,Decoy,0,-10.5678,-7.81,-0.8,-8.181853546777413
CC(C)(C[C@@H]1CC=CO1)[C@@H]1C(=O)Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc21,C52634374_decoy,TRY1,Decoy,0,-9.6587,-8.57,-2.39,-7.374396773101133
CC(C)(CC1=NC=CC1)[C@@H]1C(=O)Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc21,C52634382_decoy,TRY1,Decoy,0,-8.97447,-9.13,-2.65,-6.781881335209883
CC(C)(CC1=CN=CC1)[C@@H]1C(=O)Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc21,C52634393_decoy,TRY1,Decoy,0,-8.96623,-8.79,-2.36,-6.875881070174051
C=CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4ccc(O)cc4O)n3)cc2s1,C58994375_decoy,TRY1,Decoy,0,-10.3755,-8.34,-2.82,-10.095038897864985
N#CN/C(=N\CCCOc1cccc(C[NH+]2CCCCC2)c1)NC[C@H](O)CNc1ccccc1[N+](=O)[O-],C13456525_decoy,TRY1,Decoy,0,-7.27815,-7.21,-3.28,-7.627554297611349
C=C(NNC(=O)c1nnn(-c2nonc2N)c1CSc1ccc(C)cc1)c1ccc(O)cc1,C01891223_decoy,TRY1,Decoy,0,-8.73329,-9.23,-1.85,-8.140701955839663
C[C@H](NC(=O)CCCCNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](CCC(=O)[O-])C(N)=O,C03851923_decoy,TRY1,Decoy,0,-8.48526,-6.61,-4.13,-6.1467797587460415
CC(C)CCNC(=O)[C@H](c1ccco1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)c(Cl)c1,C06134593_decoy,TRY1,Decoy,0,-8.91308,-5.69,-0.76,-6.229268550795398
CCC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06462052_decoy,TRY1,Decoy,0,-7.02129,-5.39,-5.58,-5.6417378452905735
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(Cc1ccccc1OC)C(=O)c1snc(C(N)=O)c1N,C06462263_decoy,TRY1,Decoy,0,-8.80027,-7.86,-3.74,-9.419876067672094
CCCC[C@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(OCC)cc1,C06481473_decoy,TRY1,Decoy,0,-7.21301,-7.38,-4.42,-7.368072780302883
CCOc1ccc([C@@H](C(=O)NC(C)(C)C)N(Cc2ccc(F)cc2)C(=O)c2snc(C(N)=O)c2N)cc1,C06601246_decoy,TRY1,Decoy,0,-7.38117,-4.06,-2.64,-4.863354489150748
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c(C)c1,C12473244_decoy,TRY1,Decoy,0,-7.02481,-7.41,-0.66,-8.677760039756262
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(O)cc2)c(C)c1,C12473817_decoy,TRY1,Decoy,0,-8.5052,-6.33,-2.95,-6.810624997909287
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(O)cc2)cc1C,C12473838_decoy,TRY1,Decoy,0,-9.53306,-5.12,-3.53,-6.00915846437676
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1,C12473912_decoy,TRY1,Decoy,0,-9.1547,-6.05,-1.72,-6.414144102752807
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(O)cc2)cc1C,C12474027_decoy,TRY1,Decoy,0,-7.47544,-5.68,-2.23,-5.565562155072633
NC(=O)c1nsc(C(=O)N(CC(=O)NC[C@@H]2CCCO2)c2ccc(C3CCCCC3)cc2)c1N,C12711533_decoy,TRY1,Decoy,0,-9.18465,-8.4,-0.84,-9.251495339245452
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(N(C)C)cc2)cc1,C06245086_decoy,TRY1,Decoy,0,-9.40662,-8.27,-2.78,-14.870039971287644
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(N(C)C)cc2)c1,C06442187_decoy,TRY1,Decoy,0,-8.83713,-7.97,-1.72,-8.577018434854597
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3nccs3)n2N)c(O)c1,C21325841_decoy,TRY1,Decoy,0,-10.6838,-8.29,-2.16,-10.062934337134513
Cc1nc(NC(=O)NC(=O)C(C)C)sc1C(/C=C/c1ccc([N+](=O)[O-])cc1)=N/NC(N)=S,C25574973_decoy,TRY1,Decoy,0,-10.6879,-6.57,-2.05,-7.985647335894206
COc1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C31155386_decoy,TRY1,Decoy,0,-6.61379,-6.88,-1.72,-6.320774195016854
CC(C)(O)[C@H]1CC=C(C(=O)OC[C@H]2O[C@@H](Oc3c(O)cc(C(=O)[O-])cc3O)[C@@H](O)[C@@H](O)[C@@H]2O)CC1,C31164645_decoy,TRY1,Decoy,0,-8.23776,-8.92,-3.36,-8.57863124525091
O=C([O-])CCc1cc(Oc2ccc3ccc(=O)oc3c2)c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C31168226_decoy,TRY1,Decoy,0,-8.08136,-8.66,-2.67,-8.71951333123237
O=C([O-])CCc1cc(Oc2ccc3ccc(=O)oc3c2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C31168230_decoy,TRY1,Decoy,0,-7.53907,-7.36,-3.3,-5.695293614422841
O=C([O-])CCc1cc(Oc2ccc3ccc(=O)oc3c2)c(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C31168238_decoy,TRY1,Decoy,0,-6.84206,-7.47,-4.38,-5.396881937328782
CC(C)(O)[C@@H]1CC=C(C(=O)OC[C@@H]2O[C@@H](Oc3c(O)cc(C(=O)[O-])cc3O)[C@@H](O)[C@@H](O)[C@H]2O)CC1,C35458876_decoy,TRY1,Decoy,0,-7.90071,-7.08,-2.67,-6.042742403517837
O=C([O-])CCc1cc(Oc2ccc3ccc(=O)oc3c2)c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1O,C35464934_decoy,TRY1,Decoy,0,-7.65046,-7.78,-1.56,-7.79088058668794
O=C([O-])CCc1cc(Oc2ccc3ccc(=O)oc3c2)c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1O,C35464941_decoy,TRY1,Decoy,0,-7.85538,-8.74,-2.1,-8.757570901012679
CCCn1c(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)nc2cc(S(N)(=O)=O)ccc21,C08892924_decoy,TRY1,Decoy,0,-9.92746,-7.54,-1.14,-6.537508515800892
COc1ccc(C)cc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC1CCCCC1)c1ccc(C)o1,C12714814_decoy,TRY1,Decoy,0,-8.66685,-5.4,-3.45,-5.782770913959433
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccncc2)cc1,C06077046_decoy,TRY1,Decoy,0,-9.03558,-7.28,-1.42,-8.626451280469022
CSC(=O)OCC1=C[C@H](O)[C@@H]2C(C(=O)[O-])=CO[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]12,C36374699_decoy,TRY1,Decoy,0,-6.93383,-4.94,-3.05,-4.815007316178416
COc1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C35454785_decoy,TRY1,Decoy,0,-5.258,-7.27,-2.75,-5.766499787121468
COc1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C31155377_decoy,TRY1,Decoy,0,-6.25743,-7.17,-2.68,-7.263156796898325
CC(C)=CCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(CC=C(C)C)c1[C@H](O)C(=O)[O-],C31155270_decoy,TRY1,Decoy,0,-8.21089,-7.93,-3.62,-8.68061946868382
CC(C)=CCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(CC=C(C)C)c1[C@@H](O)C(=O)[O-],C31155266_decoy,TRY1,Decoy,0,-7.6213,-7.09,-1.74,-7.343597015866871
CSC(=O)OCC1=C[C@H](O)[C@@H]2C(C(=O)[O-])=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]12,C31158210_decoy,TRY1,Decoy,0,-8.24919,-5.27,-3.37,-5.517260649946456
COc1cc(/C=N/N[C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc(OC)c1OC,C39709984_decoy,TRY1,Decoy,0,-7.67679,-8.59,-2.55,-7.312664947245365
CCN(CC)c1ccc(/C=N/N[C@@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C39774359_decoy,TRY1,Decoy,0,-7.86809,-8.31,-3.19,-7.147543076009011
CCN(CC)c1ccc(/C=N/N[C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C39774360_decoy,TRY1,Decoy,0,-8.17403,-8.83,-1.22,-7.697981749165019
CCN(CC)c1ccc(/C=N/N[C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C39774362_decoy,TRY1,Decoy,0,-7.51253,-8.76,-2.87,-11.728187931125245
O=[P@@]([O-])(OCCCCc1ccc2ccc3cccc4ccc1c2c34)OC1[C@@H](O)[C@@H](O)C(O)[C@@H](O)[C@H]1O,C35375784_decoy,TRY1,Decoy,0,-8.15737,-9.36,-4.05,-6.03994965506164
C=C1[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3OC(=O)/C=C\c3ccc(O)cc3)OC=C(C(=O)[O-])[C@@H]2C[C@H]1O,C49181148_decoy,TRY1,Decoy,0,-7.40124,-7.8,-2.18,-6.548097461710439
C=C1[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C(C(=O)[O-])[C@@H]2C[C@@H]1OC(=O)/C=C/c1ccc(O)cc1,C49601745_decoy,TRY1,Decoy,0,-7.88234,-7.42,-3.26,-6.355122300644765
C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(NOCC(=O)N[C@@H](C(=O)N[C@H](CO)C(=O)[O-])C(C)C)=CC[C@@]4(C)[C@@H]3CC[C@@]21C,C01872845_decoy,TRY1,Decoy,0,-9.27287,-5.86,-3.5,-5.546518800570349
C/C(=C\C(=O)Nc1ccccc1Cl)NNC(=O)/C=C(\[O-])NN/C(C)=C/C(=O)Nc1ccccc1Cl,C59502133_decoy,TRY1,Decoy,0,-9.8103,-7.51,-3.75,-7.17921743856026
C/C(=N\Nc1nc(SCCC(=O)Nc2ccc3c(c2)C(=O)NC3=O)n[nH]1)c1ccccc1O,C59830657_decoy,TRY1,Decoy,0,-8.87793,-7.11,-3.13,-6.089669869803109
COc1cc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]2)c([N+](=O)[O-])cc1O,C59881600_decoy,TRY1,Decoy,0,-8.13136,-8.12,-3.61,-9.485620147808897
C[C@H](NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)N[C@H](C)C(=O)[O-],C64062291_decoy,TRY1,Decoy,0,-6.75195,-5.74,-2.56,-5.256363284541299
N#CN/C(=N\CCCOc1cccc(C[NH+]2CCCCC2)c1)NC[C@@H](O)CNc1ccccc1[N+](=O)[O-],C13456528_decoy,TRY1,Decoy,0,-7.58779,-6.37,-3.53,-5.543394364519672
O=C([O-])CC(=O)OC[C@@H]1O[C@H](Oc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)[C@H](O)[C@H](O)[C@@H]1O,C65742758_decoy,TRY1,Decoy,0,-6.647,-7.91,-3.33,-6.226371551344814
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(=O)OC2,C65747904_decoy,TRY1,Decoy,0,-7.19765,-6.89,-2.29,-5.7769525450103325
CCCC[NH+](CCCC)C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])/C(C)=N/NC(=S)NN,C05809924_decoy,TRY1,Decoy,0,-7.26245,-6.27,-1.38,-6.831956731744894
CC(C)C[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06135018_decoy,TRY1,Decoy,0,-7.70726,-7.53,-0.61,-9.414427949300345
CC(C)C[C@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06190461_decoy,TRY1,Decoy,0,-8.20575,-4.78,-1.09,-6.105984905689125
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(F)cc2)cc1,C06190841_decoy,TRY1,Decoy,0,-7.14463,-7.83,-3.95,-7.374514794827496
CCC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1,C06462198_decoy,TRY1,Decoy,0,-8.68644,-6.28,0.16,-7.979287117535398
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06462257_decoy,TRY1,Decoy,0,-7.6014,-7.18,-4.18,-8.679103001567404
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1C,C06462276_decoy,TRY1,Decoy,0,-6.77329,-7.84,-2.19,-8.422668575231054
CCCC[C@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06481546_decoy,TRY1,Decoy,0,-8.31665,-4.29,-2.94,-5.440435539905261
CCOC(=O)CNC(=O)[C@H](C)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1OC,C06546875_decoy,TRY1,Decoy,0,-7.62792,-6.67,-3.54,-7.970399722380637
CCOc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)cc1,C06601558_decoy,TRY1,Decoy,0,-8.98111,-7.6,-3.01,-9.02342246477509
CCOC(=O)CNC(=O)[C@H](C)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1OCC,C06631381_decoy,TRY1,Decoy,0,-6.77067,-5.33,-1.48,-5.528667328970809
CC[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06631758_decoy,TRY1,Decoy,0,-7.60725,-6.47,-0.2,-5.988389266447472
COCCNC(=O)[C@H](c1ccc(F)cc1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06905049_decoy,TRY1,Decoy,0,-7.89888,-7.31,-5.68,-9.6256664785296
C=CCNC(=S)NNC(=O)c1sc2nnc(-c3ccccc3)c(-c3ccccc3)c2c1N,C08636720_decoy,TRY1,Decoy,0,-6.8938,-5.87,-4.52,-6.330763733541468
CCCCn1c(N)c(N(CCC)CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)c(=O)[nH]c1=O,C11350759_decoy,TRY1,Decoy,0,-9.53401,-6.36,-2.48,-7.018371969630242
NC(=O)c1c(NC(=O)CSc2nnc(COc3ccccc3F)n2N)sc2c1CCCC2,C11385688_decoy,TRY1,Decoy,0,-11.8124,-8.5,-2.02,-8.122824124924875
COc1ccc(C[C@H]([NH3+])C(=O)N[C@@H]2[C@@H](O)[C@@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1,C11682253_decoy,TRY1,Decoy,0,-7.35025,-8.6,-1.88,-8.142732160885867
Cc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2ccc(F)cc2)C(=O)c2snc(C(N)=O)c2N)cc1,C12702027_decoy,TRY1,Decoy,0,-8.97673,-7.56,-2.01,-9.166316918714356
Cc1ccc([C@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12702158_decoy,TRY1,Decoy,0,-7.72122,-6.37,-1.93,-6.367665406407722
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C12706206_decoy,TRY1,Decoy,0,-7.24508,-5.73,-4.21,-6.03862651285472
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)OC2,C22064274_decoy,TRY1,Decoy,0,-5.94811,-7.88,-2.52,-6.244925311165415
CCCn1c(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)nc2cc(S(N)(=O)=O)ccc21,C24424510_decoy,TRY1,Decoy,0,-8.80005,-6.61,-2.75,-7.728791289365331
Cc1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)C2CCCC2)o1,C26146812_decoy,TRY1,Decoy,0,-9.02306,-5.27,-1.33,-6.836934638836533
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1N,C26147090_decoy,TRY1,Decoy,0,-9.79878,-6.32,0.68,-7.162042368210669
Cc1cccc(NC(=O)/C(CC(=O)/C=C/c2ccc(Cl)cc2Cl)=N/NC(=S)NN)c1C,C25586113_decoy,TRY1,Decoy,0,-9.88483,-6.92,-1.6,-8.79907683151518
O=C(NCCN(CCNC(=O)NC1CCCCC1)C(=O)NC1CCCCC1)NC1CCCCC1,C35585807_decoy,TRY1,Decoy,0,-9.13778,-6.41,-2.35,-6.6651836230531005
O=C(COc1ccc(Cl)cc1Cl)N/N=C/c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C36047480_decoy,TRY1,Decoy,0,-9.68254,-5.54,-3.7,-6.098877485394565
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484853_decoy,TRY1,Decoy,0,-9.23647,-5.42,-2.15,-7.232304774218643
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1ccccc1Cl,C36545181_decoy,TRY1,Decoy,0,-8.9051,-4.27,-1.0,-5.424142799703318
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1ccccc1Cl,C36545370_decoy,TRY1,Decoy,0,-8.71207,-6.3,-1.7,-6.880808192119677
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)C(O)(c1ccccc1)c1ccccc1,C36573065_decoy,TRY1,Decoy,0,-9.19025,-6.7,-3.65,-7.647431872521635
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)C(O)(c1ccccc1)c1ccccc1)C(C)(C)C,C36588638_decoy,TRY1,Decoy,0,-6.79246,-7.41,-4.32,-6.029148258286242
CCc1ccccc1NC(=S)/N=C(\Nc1nc(C)cc(C)n1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C14158041_decoy,TRY1,Decoy,0,-8.88866,-6.7,-3.63,-7.757921042500771
CC(C)C[C@H](C(=O)NC(C)(C)C)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06190443_decoy,TRY1,Decoy,0,-9.67556,-7.31,-4.27,-10.162084052125884
COc1ccc(C[C@@H]([NH3+])C(=O)N[C@H]2[C@H](O)[C@@H](n3cnc4c(N(C)C)ncnc43)O[C@H]2CO)cc1,C03874811_decoy,TRY1,Decoy,0,-8.10543,-5.22,-1.59,-6.10031515543462
COc1ccc(C[C@@H]([NH3+])C(=O)N[C@H]2[C@@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1,C03861787_decoy,TRY1,Decoy,0,-8.74527,-7.42,-2.38,-6.236747112041433
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@H]1CCCO1)c1ccc(F)cc1,C12473165_decoy,TRY1,Decoy,0,-7.284,-6.98,-1.06,-7.3427345113227505
NC(=O)c1nsc(C(=O)N(c2ccccc2)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1N,C12473141_decoy,TRY1,Decoy,0,-8.62348,-7.4,-1.79,-8.973424269904982
CC(=O)/C(CC/C(C)=N/NC(=S)NC1CCCCC1)=C(\C)NNC(=S)NC1CCCCC1,C17013626_decoy,TRY1,Decoy,0,-10.0523,-6.63,-2.68,-6.698668847316592
CCOC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C38989525_decoy,TRY1,Decoy,0,-10.1057,-7.28,-1.49,-8.10755918667994
CCOC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39021271_decoy,TRY1,Decoy,0,-10.8369,-7.24,-2.2,-8.773337111045144
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C(C)C)N3N)N=N2)cc1,C38995938_decoy,TRY1,Decoy,0,-9.97448,-7.87,-3.08,-7.2375874753324
Nc1c(NCc2ccc3c(c2)OCO3)ncnc1NNC(=O)COc1ccc(Cl)cc1Cl,C40686237_decoy,TRY1,Decoy,0,-9.93064,-7.42,-2.1,-6.457041591087578
Nc1c(NCc2ccccc2Cl)ncnc1NNC(=O)C(c1ccccc1)c1ccccc1,C40794981_decoy,TRY1,Decoy,0,-9.48628,-7.01,-3.06,-6.438942904891912
CC[C@@H](CO)Nc1nc(Nc2sc3c(c2C(N)=O)CCC3)c2cnn(-c3ccccc3)c2n1,C41026344_decoy,TRY1,Decoy,0,-11.4164,-6.26,-2.73,-7.17361421088073
C/C(=N\NC(=S)NN)[C@H](C(=O)Nc1ccccc1C)[C@H](N1CCCCC1)C(Cl)(Cl)Cl,C48552297_decoy,TRY1,Decoy,0,-9.01586,-6.66,-2.43,-8.571626571445853
[NH2+]=C(COc1ccc(Cl)cc1Cl)NNC(=O)/C=C\NOCc1ccc(Cl)cc1Cl,C33709166_decoy,TRY1,Decoy,0,-9.96671,-7.56,-1.22,-8.084195680467836
CCC[NH+]1CCC=C(c2ccc(Nc3nc(Nc4ccccc4C(N)=O)c4cc[nH]c4n3)cc2)C1,C40916934_decoy,TRY1,Decoy,0,-8.68126,-6.51,-2.32,-6.172302092761237
CC(=O)c1ccc(NC(=O)CS[C@@H]2NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)cc1,C63489319_decoy,TRY1,Decoy,0,-8.69235,-8.34,-1.9,-8.197150995409618
CC[C@@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C04161156_decoy,TRY1,Decoy,0,-7.45956,-6.93,-0.22,-12.534039773126146
C=CCNC(=S)Nc1cccc(NC(=O)C[C@H]([NH2+]CCCCCC)C(=O)[O-])c1,C05258987_decoy,TRY1,Decoy,0,-7.54513,-5.91,-4.47,-5.712107902282972
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]CCCCCC)C(=O)[O-])c1,C05258988_decoy,TRY1,Decoy,0,-7.64821,-4.55,-2.96,-5.472630903278039
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)CSc1cc(Cl)ccc1Cl,C05295949_decoy,TRY1,Decoy,0,-8.00842,-4.77,-2.8,-5.211153601939807
OC[C@@H](O)[C@@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)c1cnn(-c2ccccc2)n1,C05734786_decoy,TRY1,Decoy,0,-6.27871,-5.77,-2.9,-4.9460309598107575
OC[C@@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@@H](O)c1cnn(-c2ccccc2)n1,C05734787_decoy,TRY1,Decoy,0,-6.32418,-6.35,-2.37,-5.224022238978554
OC[C@@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)c1cnn(-c2ccccc2)n1,C05734789_decoy,TRY1,Decoy,0,-6.10213,-6.09,-1.71,-5.5456486781860175
CC(C)(C)NC(=O)[C@H](c1ccco1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06075060_decoy,TRY1,Decoy,0,-8.79633,-6.99,-1.09,-9.637392776394842
CCOC(=O)CNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06547026_decoy,TRY1,Decoy,0,-7.76509,-6.24,-1.18,-7.319977920692694
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCOC)c1ccc(F)cc1,C06631466_decoy,TRY1,Decoy,0,-8.7769,-4.7,-3.26,-6.374656648536003
CCOC(=O)CNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1CC,C06860712_decoy,TRY1,Decoy,0,-9.18947,-6.0,-1.72,-7.359807528670365
NS(=O)(=O)c1ccc(CCNC(=O)Cc2csc(NC(=O)NCc3ccco3)n2)cc1,C09785891_decoy,TRY1,Decoy,0,-8.38713,-6.73,-2.53,-6.132424163784869
O=C(CCCSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C09956747_decoy,TRY1,Decoy,0,-4.34422,-6.86,-1.56,-5.532869774363899
O=C(CCCSc1ccccc1[N+](=O)[O-])N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C09956750_decoy,TRY1,Decoy,0,-3.49293,-6.6,-2.47,-4.788986582836514
O=C(CCCSc1ccccc1[N+](=O)[O-])N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C09956760_decoy,TRY1,Decoy,0,-3.85745,-6.11,-2.26,-3.830853723012337
OC[C@@H](O)[C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](O)c1cnn(-c2ccccc2)n1,C15276783_decoy,TRY1,Decoy,0,-5.1754,-6.69,-2.29,-5.155439198858878
OC[C@@H]1O[C@@H](O[C@H]([C@@H](O)CO)[C@@H](O)c2cnn(-c3ccccc3)n2)[C@@H](O)[C@H](O)[C@@H]1O,C15276785_decoy,TRY1,Decoy,0,-6.70514,-5.94,-2.71,-5.44207353283251
OC[C@@H]1O[C@@H](O[C@@H]([C@@H](O)CO)[C@@H](O)c2cnn(-c3ccccc3)n2)[C@@H](O)[C@H](O)[C@@H]1O,C15276789_decoy,TRY1,Decoy,0,-6.77968,-6.56,-2.06,-5.713953481072972
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)cc1,C16773342_decoy,TRY1,Decoy,0,-9.05136,-7.78,-1.67,-7.613805693497475
OC[C@@H](O)[C@@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@@H](O)c1cnn(-c2ccccc2)n1,C05734784_decoy,TRY1,Decoy,0,-6.21144,-5.52,-1.61,-4.559267874606985
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)NNC(=O)C(F)(F)F,C20834620_decoy,TRY1,Decoy,0,-7.97994,-7.87,-3.35,-6.038618588805367
CC(C)(C)c1nnc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n1N,C20842292_decoy,TRY1,Decoy,0,-10.3463,-6.68,-2.62,-7.032029843880216
CC(C)(C)C(=O)NNC(=O)CSc1nnc(N/N=C/c2cccc(O)c2)n1N,C20915827_decoy,TRY1,Decoy,0,-8.03045,-8.32,-1.14,-9.13936337899085
Cc1ccc(/C=N/Nc2nnc(SCC(=O)NNC(=O)C(C)(C)C)n2N)cc1,C20918480_decoy,TRY1,Decoy,0,-8.65519,-7.47,-1.86,-7.3890657688724355
[NH3+][C@@H](CCC(=O)N[C@H](CSCc1ccc(Br)cc1)[C@@H](O)[NH2+]CC(=O)[O-])C(=O)[O-],C21540839_decoy,TRY1,Decoy,0,-10.6018,-6.17,-2.7,-7.092830610407256
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)CSc1cc(Cl)ccc1Cl,C25386494_decoy,TRY1,Decoy,0,-8.94634,-7.04,-4.54,-7.695132136861226
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)CSc1cc(Cl)ccc1Cl,C25386501_decoy,TRY1,Decoy,0,-8.51436,-6.92,-3.83,-6.328444562474084
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)CSc1cc(Cl)ccc1Cl,C25386497_decoy,TRY1,Decoy,0,-9.38266,-6.87,-3.3,-8.445191477397685
[NH3+][C@@H](CCC(=O)N[C@H](CSCc1ccc(Br)cc1)[C@H](O)[NH2+]CC(=O)[O-])C(=O)[O-],C36384741_decoy,TRY1,Decoy,0,-8.23442,-5.48,-1.22,-5.54474637748197
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1,C12711290_decoy,TRY1,Decoy,0,-7.90364,-5.95,-2.67,-5.746872018456648
CC(C)C[C@@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06134975_decoy,TRY1,Decoy,0,-8.44879,-7.66,-4.09,-8.524733676328413
OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/c1ccc(/C=C/c2ccnc3ccccc23)cc1,C17062681_decoy,TRY1,Decoy,0,-9.36458,-7.95,-1.94,-6.558085557049772
NC(=O)c1nsc(C(=O)N(c2ccc(Cl)cc2)[C@@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1N,C12706375_decoy,TRY1,Decoy,0,-8.68124,-6.65,-1.24,-7.958688287186068
CCOc1ccc(N2C(SCC(N)=O)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362523_decoy,TRY1,Decoy,0,-6.81468,-6.6,-1.31,-6.656605567912071
CCOc1ccc(N2C(SCC(N)=O)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362525_decoy,TRY1,Decoy,0,-7.62039,-7.17,-2.13,-7.544548481116982
O=C(CCCNC(=O)c1ccsc1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558863_decoy,TRY1,Decoy,0,-8.64016,-7.29,-3.56,-6.532353822159916
CC[C@@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1,C41026427_decoy,TRY1,Decoy,0,-7.75691,-7.34,-0.77,-12.286601970172825
CC[C@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1,C41026428_decoy,TRY1,Decoy,0,-8.07785,-7.07,-2.55,-8.48048586773151
CC[C@@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41302016_decoy,TRY1,Decoy,0,-9.2007,-7.31,-3.04,-8.267213615456415
CC[C@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41302019_decoy,TRY1,Decoy,0,-7.64797,-7.42,-3.02,-8.894270966013828
O=C(CSc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2O)n1)NCCO,C59815644_decoy,TRY1,Decoy,0,-10.0253,-5.43,-0.76,-6.139091880814937
C/C(=N\Nc1nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]1)c1ccccc1O,C59830751_decoy,TRY1,Decoy,0,-8.35232,-8.07,-1.89,-9.718658755346802
C[C@H](Sc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)C(=O)NNC(=O)C1CCC1,C59879180_decoy,TRY1,Decoy,0,-8.37743,-8.42,-2.79,-7.56089017876308
C[C@@H](Sc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)C(=O)NNC(=O)C1CCC1,C59879182_decoy,TRY1,Decoy,0,-8.66228,-8.49,-3.44,-7.541074442311277
C/C(=N\Nc1nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]1)c1ccc(N)cc1,C59879584_decoy,TRY1,Decoy,0,-8.56812,-8.65,-2.65,-7.724545683028131
C/C(=N\Nc1nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]1)c1ccc(N)cc1,C59879586_decoy,TRY1,Decoy,0,-7.89152,-7.48,-1.18,-6.746753482065063
C/C(=N\Nc1nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]1)c1ccccc1O,C59883722_decoy,TRY1,Decoy,0,-7.52259,-6.78,-3.13,-5.96435085464692
CSCC[C@H](NC(=O)[C@@H]([NH3+])CCSC)C(=O)N[C@H](CCSC)C(=O)[O-],C64219373_decoy,TRY1,Decoy,0,-10.1527,-5.33,-1.54,-7.959013621270942
CC[NH+](CCCC(=O)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O)[C@@H](C)Cc1ccc(O)cc1,C65739957_decoy,TRY1,Decoy,0,-5.37039,-6.98,-3.62,-4.592917184728692
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCCNC(=O)/C(C#N)=C/c1ccc(O)c(O)c1,C03871732_decoy,TRY1,Decoy,0,-8.46992,-7.5,-3.38,-6.878507824725628
O=C1c2ccccc2C(=O)c2c(NCCC[NH2+]CCO)ccc(NCCC[NH2+]CCO)c21,C05374358_decoy,TRY1,Decoy,0,-9.76253,-5.55,-1.2,-9.26581224448342
CCC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06462039_decoy,TRY1,Decoy,0,-6.20617,-6.57,-3.39,-6.634433755588598
CCC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06462053_decoy,TRY1,Decoy,0,-8.30732,-6.84,-1.15,-7.76464099608098
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)CC)c2ccc(O)cc2)cc1,C06462055_decoy,TRY1,Decoy,0,-6.2614,-5.95,-1.55,-5.180389309006507
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(O)cc2)cc1,C06600976_decoy,TRY1,Decoy,0,-9.27509,-6.57,-3.07,-8.23419854010705
COCCNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06904996_decoy,TRY1,Decoy,0,-7.82349,-5.18,-3.24,-5.650888727173029
Cc1sc(NC(=O)CCCC(=O)Nc2sc(C)c(C)c2C(N)=O)c(C(N)=O)c1C,C02133702_decoy,TRY1,Decoy,0,-9.06305,-6.86,-3.31,-7.47575041132414
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C09296492_decoy,TRY1,Decoy,0,-9.30658,-7.38,-1.72,-7.7327063531050015
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C10004230_decoy,TRY1,Decoy,0,-7.04068,-8.0,-3.03,-7.568723516980765
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1C,C12473953_decoy,TRY1,Decoy,0,-7.61432,-4.56,-1.66,-4.731708383466537
O[C@H](C[NH2+]Cc1ccccn1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccccn2)cc1,C13081229_decoy,TRY1,Decoy,0,-8.21724,-6.19,-1.61,-6.538181164772909
O[C@H](C[NH2+]Cc1ccccn1)COc1ccc(OC[C@H](O)C[NH2+]Cc2ccccn2)cc1,C06475567_decoy,TRY1,Decoy,0,-7.94191,-6.7,-3.7,-6.2385769169454
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C08740530_decoy,TRY1,Decoy,0,-7.7474,-7.4,-3.93,-7.177056939474014
OC[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C13548726_decoy,TRY1,Decoy,0,-8.90334,-8.22,-1.59,-7.756440092906589
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C13548732_decoy,TRY1,Decoy,0,-9.13459,-7.5,-2.47,-8.39128184901026
CC[NH+](CC)CCCNC(=O)NC[C@@H]1CCC[C@@H](CNC(=O)NCCC[NH+](CC)CC)C1,C19015489_decoy,TRY1,Decoy,0,-9.2042,-6.38,-3.98,-6.744649193490465
CC[NH+](CC)CCCNC(=O)NC[C@H]1CCC[C@@H](CNC(=O)NCCC[NH+](CC)CC)C1,C19015492_decoy,TRY1,Decoy,0,-9.33103,-5.12,-2.68,-6.454275474054644
CC[NH+](CC)CCCNC(=O)NC[C@H]1CCC[C@H](CNC(=O)NCCC[NH+](CC)CC)C1,C19015496_decoy,TRY1,Decoy,0,-8.40726,-6.54,-3.86,-6.9338818332300844
CCc1c(C)sc(NC(=O)CCC(=O)Nc2sc(C)c(CC)c2C(N)=O)c1C(N)=O,C20191338_decoy,TRY1,Decoy,0,-10.607,-6.81,-2.59,-7.293118085948077
C[C@H]1CCc2c(sc(NC(=O)CCCC(=O)Nc3sc4c(c3C(N)=O)CC[C@H](C)C4)c2C(N)=O)C1,C20572204_decoy,TRY1,Decoy,0,-11.7412,-6.45,-3.83,-7.56747831961453
CC(n1cc(C[C@@H]([NH3+])C(=O)[O-])c2ccccc21)n1cc(C[C@@H]([NH3+])C(=O)[O-])c2ccccc21,C28631070_decoy,TRY1,Decoy,0,-8.02018,-5.84,-4.21,-5.641732544873209
CC(n1cc(C[C@@H]([NH3+])C(=O)[O-])c2ccccc21)n1cc(C[C@H]([NH3+])C(=O)[O-])c2ccccc21,C28631072_decoy,TRY1,Decoy,0,-6.58518,-8.25,-1.96,-7.626701022677462
CC(C)[C@H](NC=O)C(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@@H](O)COC(=O)[C@@H](NC=O)C(C)C,C31157909_decoy,TRY1,Decoy,0,-8.51611,-5.53,-3.09,-7.124922189058439
CC(C)=CCC[C@@](C)(O)[C@@H](O)C[C@@H](O)/C(C)=C/COC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C31161867_decoy,TRY1,Decoy,0,-10.3634,-7.72,-2.45,-8.302991928975382
CC(C)=CCC[C@](C)(O)[C@@H](O)C[C@@H](O)/C(C)=C/COC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C31161871_decoy,TRY1,Decoy,0,-9.23667,-8.03,-3.28,-8.902107829684478
C[C@H](O)[C@@H](O)[C@H](O)[C@@H](OCCO)Oc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1,C34898305_decoy,TRY1,Decoy,0,-9.38143,-8.41,-2.38,-7.3459133169253885
CC(C)=CCC[C@](C)(O)[C@H](O)C[C@H](O)/C(C)=C/COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C35457502_decoy,TRY1,Decoy,0,-9.78776,-6.94,-2.53,-7.641642800024492
CC(C)=CCC[C@@](C)(O)[C@@H](O)C[C@H](O)/C(C)=C/COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C35457514_decoy,TRY1,Decoy,0,-10.8322,-7.24,-2.55,-10.01200390822776
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C08740527_decoy,TRY1,Decoy,0,-8.50176,-7.48,-1.91,-8.234404043096923
CC(n1cc(C[C@H]([NH3+])C(=O)[O-])c2ccccc21)n1cc(C[C@H]([NH3+])C(=O)[O-])c2ccccc21,C13818319_decoy,TRY1,Decoy,0,-8.62207,-7.32,-4.49,-8.619084380452131
N#C/C(=C\c1ccc(O)c(O)c1)C(=O)NCCCNC(=O)/C(C#N)=C/c1ccc(O)c(O)c1,C01645882_decoy,TRY1,Decoy,0,-10.4556,-10.02,-4.22,-11.916662842878011
N#C/C(=C\c1ccc(O)c(O)c1)C(=O)NCCCCCCNC(=O)/C(C#N)=C/c1ccc(O)c(O)c1,C06007120_decoy,TRY1,Decoy,0,-10.9716,-8.89,-5.74,-11.66274241182908
CC(C)[C@@H](NC=O)C(=O)OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)COC(=O)[C@H](NC=O)C(C)C,C35455708_decoy,TRY1,Decoy,0,-8.35138,-6.16,-2.88,-10.394152496264532
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)cc1,C01757378_decoy,TRY1,Decoy,0,-7.6138,-7.12,-2.09,-7.263803029594187
[NH3+]CCCCCCNc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C38580946_decoy,TRY1,Decoy,0,-8.29067,-6.5,-3.43,-6.372188059318644
COC(CNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1)OC,C41026422_decoy,TRY1,Decoy,0,-9.22822,-6.85,-2.71,-8.281023558944183
Cc1cc(Nc2nc(NCCc3ccc(S(N)(=O)=O)cc3)nc(N)c2[N+](=O)[O-])no1,C41333815_decoy,TRY1,Decoy,0,-8.24198,-7.91,-1.03,-8.205789820596735
COC(=O)[C@H](NC(=O)[C@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(OC(F)(F)F)cc2)C1)C(C)C,C43537171_decoy,TRY1,Decoy,0,-7.89502,-6.87,-1.49,-6.425028845821757
CC(C)C[C@H](C=O)NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CCNC(=[NH2+])N1,C35024634_decoy,TRY1,Decoy,0,-11.4635,-7.1,-1.09,-9.957868477972582
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]2O)c2ccccc12,C44963625_decoy,TRY1,Decoy,0,-5.55022,-7.12,-6.09,-4.514173750792772
NC(=O)c1c(NC(=O)CCCCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)sc2c1CCCC2,C01811321_decoy,TRY1,Decoy,0,-10.1987,-5.79,-4.03,-6.633835708079414
CC(C)C[C@@H](C=O)NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1,C26185320_decoy,TRY1,Decoy,0,-10.8464,-6.13,-3.52,-8.922823473776674
NC(=O)Cc1ccc(OCC2=[NH+][C@H](C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)ON2)cc1,C63782754_decoy,TRY1,Decoy,0,-8.87253,-7.68,-2.18,-6.5743432630939225
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1[NH+]=C(COc3ccccc3C(N)=O)NO1)C[NH+]=2,C63818885_decoy,TRY1,Decoy,0,-8.2993,-7.83,-3.36,-7.117504925439537
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@@H]1N[NH2+]NN1c1ccccc1OC,C64164388_decoy,TRY1,Decoy,0,-9.18634,-7.75,-3.04,-9.605523770420712
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@@H]1N[NH2+]NN1c1ccccc1Cl,C64164805_decoy,TRY1,Decoy,0,-8.86894,-6.36,-0.94,-5.959921618572819
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@H]1N[NH2+]NN1c1ccccc1Cl,C64164809_decoy,TRY1,Decoy,0,-8.71046,-8.29,-1.57,-6.897070031414677
COc1cccc(N2N[NH2+]N[C@H]2SCC(=O)NCCC2=c3ccc(OC)cc3=[NH+]C2)c1,C64197106_decoy,TRY1,Decoy,0,-9.80367,-7.87,-2.33,-7.322315292344815
NC(=O)C[NH+]1CCC(NC(=O)c2ccc3c(c2)NC(=O)CS3)CC1,C14482380_decoy,TRY1,Decoy,0,-9.54352,-7.16,-2.81,-5.6999923673295685
C[C@H]1C[C@H](C(F)(F)C(F)(F)F)n2nc(C(=O)NCC[NH3+])cc2N1,C02554732_decoy,TRY1,Decoy,0,-8.33041,-7.02,-1.09,-8.430476042191438
C[C@@H]1Oc2ccc(NC(=O)C[NH+]3CCC(C(N)=O)CC3)cc2NC1=O,C19462163_decoy,TRY1,Decoy,0,-8.63279,-5.54,-1.25,-5.061988355571456
Nc1nc(N)nc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)n1,C26228315_decoy,TRY1,Decoy,0,-7.9829,-8.59,-1.59,-16.55824171251753
CC(C)(C[NH3+])c1nc(-c2ccc(Cl)c(O)c2)c(-c2ccncc2)[nH]1,C28563455_decoy,TRY1,Decoy,0,-9.16489,-5.51,-1.71,-5.825714642652305
C[C@H](c1ccccc1Cl)N1CC[NH+](Cc2nc(N)nc(N)n2)CC1,C29687386_decoy,TRY1,Decoy,0,-6.93504,-7.53,-1.65,-6.228494929703442
C[C@@H](c1ccccc1Cl)N1CC[NH+](Cc2nc(N)nc(N)n2)CC1,C29687392_decoy,TRY1,Decoy,0,-8.93421,-8.11,-0.73,-12.309125785534098
C[C@H](O)[C@H]([NH3+])c1nc(C(=O)Nc2ccc(N3CCOCC3)cc2)co1,C33602284_decoy,TRY1,Decoy,0,-8.21044,-7.45,-2.83,-7.761947033938377
[NH-]C(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H]([NH2+]Cc3ccccc3)[C@@H]2O)CC1,C20463877_decoy,TRY1,Decoy,0,-7.19799,-6.77,-0.05,-5.642040950363868
NC(=O)CCCC[C@@H]([NH3+])c1cc2c(cc1Br)OCCO2,C37636767_decoy,TRY1,Decoy,0,-8.69856,-6.53,-1.48,-7.248683941587919
NC(=O)CCCC[C@H]([NH3+])c1cc2c(cc1Br)OCCO2,C37636768_decoy,TRY1,Decoy,0,-8.68798,-5.95,-2.3,-5.3252303462137975
NC(=O)CCCC[C@@H]([NH3+])c1cc2c(cc1Br)OCCCO2,C37636809_decoy,TRY1,Decoy,0,-8.96283,-6.41,-2.87,-8.429224401868096
NC(=O)CCC[C@@H]([NH3+])c1cc2c(cc1Br)OCCCO2,C37636813_decoy,TRY1,Decoy,0,-8.77585,-6.79,-1.45,-7.465750287867152
CCOc1cc(Br)c([C@H]([NH3+])CCCC(N)=O)cc1OCC,C37636835_decoy,TRY1,Decoy,0,-7.23579,-5.98,-1.23,-7.93645892658771
CCOc1cc(Br)c([C@@H]([NH3+])CCCC(N)=O)cc1OCC,C37636836_decoy,TRY1,Decoy,0,-8.13696,-5.63,-3.95,-7.1479251773173145
NC(=O)CN(Cc1ccc(Br)cc1)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1,C37822325_decoy,TRY1,Decoy,0,-7.86807,-6.34,-1.39,-7.298559064191105
COc1ccc(C)cc1Nc1ncnc(NN2CC[NH+](C)CC2)c1N,C40684266_decoy,TRY1,Decoy,0,-7.48036,-6.11,-1.38,-6.272006396999303
C[NH+]1CCC(NC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)CC1,C43180407_decoy,TRY1,Decoy,0,-7.45018,-5.51,-1.67,-5.164417944761771
CC(C)([NH3+])c1noc(CSc2ccc(Br)cc2N)n1,C43403376_decoy,TRY1,Decoy,0,-10.0696,-6.08,-0.78,-6.433257036412609
Cc1ccc(Cn2ncc(Br)c2[C@@H]([NH3+])CC(N)=O)cc1,C44253846_decoy,TRY1,Decoy,0,-6.63755,-6.3,-1.28,-6.951613019564482
[H]/N=C(/O)C[C@H]([NH3+])c1ccc2oc(C(=O)c3ccc(Cl)cc3)cc2c1,C44254730_decoy,TRY1,Decoy,0,-8.96137,-6.53,-1.24,-6.296949239996638
NC(=O)CN(C(=O)c1ccc(Br)cc1O)C1CC[NH2+]CC1,C44489937_decoy,TRY1,Decoy,0,-7.84049,-6.35,-1.36,-7.257277689232084
N/C(=[NH+]\NC(=S)Nc1ccc(Cl)cc1)c1cnc(Cl)cn1,C44551665_decoy,TRY1,Decoy,0,-8.48233,-5.08,-1.31,-5.116467504250393
C[n+]1c(NNC(=O)Nc2ccccc2CC(N)=O)sc2ccccc21,C45723863_decoy,TRY1,Decoy,0,-8.34537,-7.3,-2.76,-7.282219523415811
CC(C)CSC[C@H]1O[C@@H](n2cnc3c(N)cc[nH+]c32)[C@H](O)[C@@H]1O,C48998611_decoy,TRY1,Decoy,0,-6.90964,-7.21,-2.56,-10.533707664877266
C[NH+]1CC[C@H](NS(=O)(=O)c2cc(Br)cnc2NN)C1,C49087013_decoy,TRY1,Decoy,0,-7.59762,-4.7,-2.11,-4.710533987075686
COc1cccc(N2C(=O)/C(=C/N[C@H]3CCCC[C@H]3[NH3+])C(=O)NC2=S)c1,C20292070_decoy,TRY1,Decoy,0,-8.78828,-6.43,-2.13,-5.478394666032783
CC[NH+]1CC[C@H](CNC(=O)c2cc(Br)cnc2NN)C1,C51091227_decoy,TRY1,Decoy,0,-7.41816,-5.72,-2.44,-6.119243208697241
C[C@@H](C[NH+]1CCCC1)NC(=O)c1cc(Br)cnc1NN,C51120172_decoy,TRY1,Decoy,0,-7.62116,-4.63,-1.78,-4.833707175154101
C[NH2+][C@@H](C)c1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C52066938_decoy,TRY1,Decoy,0,-7.48277,-4.6,-1.88,-4.539467472283939
C[NH2+][C@H](C)c1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C52066939_decoy,TRY1,Decoy,0,-6.95505,-6.18,-0.37,-5.095236109726613
C[NH2+][C@H](C)c1cc(Br)ccc1O[C@H](C)C(=O)NC(N)=O,C52066941_decoy,TRY1,Decoy,0,-7.65934,-6.38,-1.56,-7.383891077275717
NC(=O)C[NH+]1CCC[C@H](C(=O)NCc2cc3ccc(F)cc3[nH]c2=O)C1,C55060960_decoy,TRY1,Decoy,0,-7.67693,-6.0,-0.98,-5.017475719977886
COc1c(Br)cc(Br)cc1/C=N/NC(N)=[NH2+],C01410725_decoy,TRY1,Decoy,0,-8.15056,-5.71,-0.76,-9.134245375672217
CC(C)C[C@H]([NH3+])C(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21,C06952081_decoy,TRY1,Decoy,0,-6.5723,-5.03,-0.88,-3.487872053956868
Nc1nc(N)nc(C[NH+]2CCN(Cc3c(F)cccc3Cl)CC2)n1,C23478724_decoy,TRY1,Decoy,0,-9.25664,-6.61,-0.84,-7.506171600118119
C[C@@H](NC(=O)NC(=O)C[NH+]1CC[C@@H](C(N)=O)C1)[C@@H]1C[C@H]2CC[C@@H]1C2,C61332818_decoy,TRY1,Decoy,0,-8.01625,-5.58,-1.64,-5.573920959511614
CC(C)(CC(N)=O)C[C@@H]([NH3+])c1cc2c(cc1Br)OCCO2,C61825429_decoy,TRY1,Decoy,0,-7.96853,-5.12,-2.46,-4.964207459586449
C[C@@H](CC(N)=O)C[C@@H]([NH3+])c1cc2c(cc1Br)OCCO2,C61830294_decoy,TRY1,Decoy,0,-7.84573,-4.87,-0.81,-5.012205819631454
C[C@H]([NH2+]CC1(c2ccc(Cl)cc2)CCOCC1)C(=O)NC(N)=O,C62240624_decoy,TRY1,Decoy,0,-7.60463,-7.33,-2.7,-5.950880490723203
CC[NH2+][C@H](c1cn[nH]c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62777439_decoy,TRY1,Decoy,0,-6.79927,-4.89,-0.23,-5.115159173598375
CC[NH2+][C@@H](c1cn[nH]c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62777440_decoy,TRY1,Decoy,0,-7.21999,-5.13,-0.82,-4.657171310305095
CC[NH2+][C@@H](c1cc[nH]n1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62777441_decoy,TRY1,Decoy,0,-6.98501,-5.82,-1.59,-4.578764306614037
CC[NH2+][C@H](c1cc[nH]n1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62777442_decoy,TRY1,Decoy,0,-7.90611,-4.85,-1.14,-5.125512435484608
CNC1=C(C(=O)N[C@@H](C)c2[nH]c(-c3ccccc3)c[nH+]2)[C@H](C)NS1,C63991055_decoy,TRY1,Decoy,0,-9.39914,-6.67,-0.78,-7.175532227967036
CNC1=C(C(=O)N[C@H](C)c2[nH]c(-c3ccccc3)c[nH+]2)[C@H](C)NS1,C63991059_decoy,TRY1,Decoy,0,-8.90942,-5.69,-1.48,-5.3016520183526215
CC1(C)CC(NC(=O)NCCC(=O)NC2CCCC2)CC(C)(C)[NH2+]1,C54752542_decoy,TRY1,Decoy,0,-8.26373,-5.54,-2.77,-5.320893482131759
Cc1ccccc1NC(=O)NNC(=O)Nc1ccc(N2CCCC2)[nH+]c1,C65790201_decoy,TRY1,Decoy,0,-7.23185,-6.96,-2.18,-6.200096850064979
Cc1ccc(NC(=O)C(=O)N[C@@H]2CC[NH+]3CCCC[C@H]23)cc1C(N)=O,C67525484_decoy,TRY1,Decoy,0,-9.25387,-5.52,-1.29,-5.608743237071497
Cc1ccc(NC(=O)C(=O)N[C@H]2CC[NH+]3CCCC[C@H]23)cc1C(N)=O,C67525485_decoy,TRY1,Decoy,0,-9.8306,-6.91,-1.03,-7.070784512894891
COc1ccc(-c2cc([C@H]3C[NH+]4CC[C@H]3C[C@@H]4CNC(=S)Nc3ccccc3)n(C)n2)cc1OC,C08635523_decoy,TRY1,Decoy,0,-10.4256,-6.48,-2.02,-7.644380450133836
COc1cccc(CN2C(=O)N[C@@](C)(C3CC[NH+](Cc4cc(Cl)ccc4O)CC3)C2=O)c1OC,C12004348_decoy,TRY1,Decoy,0,-9.202,-6.1,-1.5,-6.48699118967312
CC(C)(C)NC(=O)C[NH+]1CCN(C(=O)CSc2ncc(-c3ccc(Br)cc3)[nH]2)CC1,C09338168_decoy,TRY1,Decoy,0,-9.42437,-5.38,-2.66,-5.907701802166577
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)c(C)c2[nH]c1=O)C(=S)Nc1ccccc1C(=O)OC,C12635676_decoy,TRY1,Decoy,0,-9.1497,-7.43,-2.82,-6.134020148185922
COc1ccc(CN(Cc2cccnc2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(OC)c1OC,C20568251_decoy,TRY1,Decoy,0,-8.88777,-5.27,-1.69,-5.707005520336199
CC(C)[NH+](CCCNC(=O)c1ccc(/N=C2/N[C@@H]3CS(=O)(=O)C[C@@H]3S2)cc1)C1CCCCC1,C20618100_decoy,TRY1,Decoy,0,-10.997,-7.63,-2.98,-6.768094724253088
CC(C)[NH+](CCCNC(=O)c1ccc(/N=C2\N[C@H]3CS(=O)(=O)C[C@@H]3S2)cc1)C1CCCCC1,C20618101_decoy,TRY1,Decoy,0,-9.70859,-6.49,-4.95,-5.949552791139667
CCOC(=O)c1c(NC(=O)C[NH+](C)Cc2ccc(Br)cc2)sc(C(=O)NC)c1C,C03540537_decoy,TRY1,Decoy,0,-9.56765,-5.34,-2.71,-6.380382143547149
COc1ccc(-c2n[nH]c(=S)n2CCC(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)cc1,C22619310_decoy,TRY1,Decoy,0,-9.19745,-8.17,-2.06,-7.677499841140823
CC[C@]1(C)NC(=O)N(NC(=O)C[NH+]2CCN(Cc3ccc(-c4ccc(Cl)cc4)s3)CC2)C1=O,C22932855_decoy,TRY1,Decoy,0,-8.64307,-5.91,-1.76,-4.910021100250988
Cc1ccc(C)c(NC(=O)[C@@H](C)N2CC[NH+](CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)c1,C23356494_decoy,TRY1,Decoy,0,-8.80541,-7.21,-2.43,-6.190743321623868
NC(=O)C[NH+]1CCN(c2nc(SCC(=O)N3CCCC3)nc3scc(-c4ccccc4)c23)CC1,C34774818_decoy,TRY1,Decoy,0,-8.76009,-6.96,-2.96,-6.426458454308663
O[C@@H](C[NH2+][C@H](Cc1ccccc1)c1nc(-c2ccc(Br)cc2)no1)CN1CCOCC1,C35744530_decoy,TRY1,Decoy,0,-9.79757,-7.05,-1.86,-7.263125994425407
C=C[C@](C)(O)C[NH+](CCN1CCOCC1)Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)[nH]1,C35745959_decoy,TRY1,Decoy,0,-9.34484,-7.12,-1.43,-7.368254639153589
CC[NH+](CC)[C@@H](CNC(=O)CCSCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)c1ccccc1,C36333199_decoy,TRY1,Decoy,0,-9.43481,-6.39,-2.7,-6.254236765199576
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)cc2[nH]c1=O)C(=S)Nc1ccc(OC)cc1OC,C12635537_decoy,TRY1,Decoy,0,-9.26962,-7.1,-2.95,-7.809042518175572
CC[NH+]1CCC[C@@H]1CN(Cc1cc2ccc(C)cc2[nH]c1=O)C(=S)Nc1ccccc1C(=O)OC,C12635517_decoy,TRY1,Decoy,0,-9.17454,-7.44,-3.47,-7.992705376649061
Cc1cc(C(=O)N2C[C@@H](C(=O)NC[C@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39596333_decoy,TRY1,Decoy,0,-8.27979,-6.74,-1.51,-5.8945528233418125
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCCc2ccccc2OC)C2(CC[NH2+]CC2)C1,C39636339_decoy,TRY1,Decoy,0,-9.03299,-6.48,-2.98,-6.998357274728364
COc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2cc(C)oc2C(F)(F)F)CC12CC[NH2+]CC2,C39636387_decoy,TRY1,Decoy,0,-7.04171,-5.98,-2.39,-5.256217104115745
COc1cccc(CNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3F)CC23CC[NH2+]CC3)c1OC,C39638359_decoy,TRY1,Decoy,0,-7.72632,-6.93,-2.7,-6.040046818253832
CCOc1ccccc1CCNC(=O)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39652752_decoy,TRY1,Decoy,0,-9.96859,-7.51,-2.29,-8.01096355180531
CCOc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2cc(C)oc2C(F)(F)F)CC12CC[NH2+]CC2,C39652761_decoy,TRY1,Decoy,0,-7.52189,-6.78,-1.38,-6.232724987889295
CCOc1cc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(F)c(C)c3)CC23CC[NH2+]CC3)ccc1OC,C39653377_decoy,TRY1,Decoy,0,-8.9659,-7.51,-1.63,-6.473735829789008
CCOc1cc(CCNC(=O)[C@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)ccc1OC,C39653461_decoy,TRY1,Decoy,0,-10.1591,-5.98,-1.7,-6.645644568961253
CCc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3cccc(OC(C)=O)c3C)CC23CC[NH2+]CC3)cc1,C39654429_decoy,TRY1,Decoy,0,-9.59812,-8.36,-3.66,-9.549255640353094
CCSCCNC(=O)[C@H]1CN(C(=O)c2c(Br)c(C)nn2CC)CC12CC[NH2+]CC2,C39656597_decoy,TRY1,Decoy,0,-9.29917,-6.02,-4.57,-6.376617848425163
CCCCCCNC(=O)[C@@H]1CN(C(=O)c2c(-c3ccccc3Cl)noc2C)CC12CC[NH2+]CC2,C39660315_decoy,TRY1,Decoy,0,-8.97178,-7.7,-2.31,-8.754075709410923
Cc1cc(C(=O)N2C[C@H](C(=O)NC[C@H](C)Oc3ccccc3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39665356_decoy,TRY1,Decoy,0,-8.33281,-5.48,-2.16,-6.50104158185118
COc1ccc(O[C@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(F)cc3F)CC23CC[NH2+]CC3)cc1,C39665587_decoy,TRY1,Decoy,0,-9.20247,-8.3,-3.42,-6.733419764235018
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NC[C@H](C)Oc2ccc(C)cc2)C2(CC[NH2+]CC2)C1,C39666147_decoy,TRY1,Decoy,0,-9.18011,-8.09,-4.77,-7.713709503634586
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2)Oc1cccnc1,C39668517_decoy,TRY1,Decoy,0,-8.49228,-7.95,-2.79,-7.261970790867995
COc1c(C(=O)N2C[C@@H](C(=O)NC[C@H](C)Oc3cccnc3)C3(CC[NH2+]CC3)C2)csc1Cl,C39668696_decoy,TRY1,Decoy,0,-8.65514,-7.2,-3.14,-6.670184642210746
COc1c(C(=O)N2C[C@H](C(=O)NCCCn3nc(C)cc3C)C3(CC[NH2+]CC3)C2)csc1Cl,C39671785_decoy,TRY1,Decoy,0,-9.3455,-7.13,-2.47,-6.932357398039292
Cc1cc(C)n(CCCNC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)CC23CC[NH2+]CC3)n1,C39671824_decoy,TRY1,Decoy,0,-9.77275,-6.55,-3.33,-7.070434003835171
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC23CC[NH2+]CC3)cc1,C39675454_decoy,TRY1,Decoy,0,-9.40558,-7.86,-3.08,-7.219540167444581
CC(C)COCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39683345_decoy,TRY1,Decoy,0,-9.60296,-5.84,-1.79,-6.111808906238196
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)NCc2cccc(-n3cccc3)c2)C2(CC[NH2+]CC2)C1,C39694040_decoy,TRY1,Decoy,0,-8.49768,-7.34,-1.7,-6.469840191381521
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCc2cccc(-n3cccc3)c2)C2(CC[NH2+]CC2)C1,C39694138_decoy,TRY1,Decoy,0,-7.75618,-8.17,-3.17,-6.94898992534128
Cc1onc(-c2ccccc2)c1C(=O)N1C[C@H](C(=O)NCCSC(C)(C)C)C2(CC[NH2+]CC2)C1,C39696560_decoy,TRY1,Decoy,0,-7.94498,-6.11,-2.52,-5.850599222601621
Cc1onc(-c2ccccc2)c1C(=O)N1C[C@@H](C(=O)NCCSC(C)(C)C)C2(CC[NH2+]CC2)C1,C39696561_decoy,TRY1,Decoy,0,-9.24462,-7.17,-1.32,-10.777629149829258
CN(C)c1ccc(-c2cc([C@H]3C[NH+]4CC[C@@H]3C[C@@H]4CNC(=S)Nc3cccc(C#N)c3)n(C)n2)cc1,C43525499_decoy,TRY1,Decoy,0,-10.2826,-8.0,-1.55,-6.6144300191738665
COc1ccc([C@@H]2c3ccc(O)cc3Oc3nc[n+](CCc4ccc(OC)c(OC)c4)c(N)c32)cc1,C09584022_decoy,TRY1,Decoy,0,-10.0639,-7.33,-2.98,-7.203994726906527
Cc1ccccc1[C@H](OC[C@@H](O)CN1CC[NH+](Cc2nc3ccccc3c(=O)[nH]2)CC1)c1ccccc1,C22933881_decoy,TRY1,Decoy,0,-8.36416,-7.7,-2.23,-6.957622273899623
Cc1ccc(C)c(NC(=O)CS[C@H]2Nc3nccnc3C(=O)N2CCC2=c3ccccc3=[NH+]C2)c1,C63541331_decoy,TRY1,Decoy,0,-9.69419,-8.37,-3.77,-9.124587467710182
Cc1ccc2c(c1)=C(CCNC(=O)CCC(=O)N1CCS[C@@H]3[C@H]1[C@H](C)NN3c1ccccc1)C[NH+]=2,C63666770_decoy,TRY1,Decoy,0,-9.85364,-7.77,-3.16,-6.517901859819229
Cc1ccc2c(c1)=C(CCNC(=O)C[S@@+]([O-])C[C@@H]1CNN(c3ccccc3)[C@@H]1n1cccc1)C[NH+]=2,C63697962_decoy,TRY1,Decoy,0,-8.19741,-8.03,-2.42,-7.682375514062768
CC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)OC[C@H]1CC(=O)N2C=C(Br)C=C[C@@H]2N1,C63731506_decoy,TRY1,Decoy,0,-9.18221,-7.67,-2.8,-6.642020466562128
COCCN1C(=O)/C(=C\NC[C@@H](C2=c3ccccc3=[NH+]C2)c2ccccc2Cl)C(=O)NC1=S,C64050310_decoy,TRY1,Decoy,0,-8.11121,-8.31,-2.9,-7.966050299920152
Cc1ccc2c(c1)=C(CCNC(=O)CSC[C@@H]1N=N[C@@H](C(=O)Nc3cccc(F)c3)S1)C[NH+]=2,C64538796_decoy,TRY1,Decoy,0,-9.55126,-6.52,-3.17,-7.077681902465996
C[C@]1(CO)[C@@H]2CC[C@@H](O)[C@@H](CC(=O)NCc3ccco3)[C@]2(C)CC[C@H]1OC(=O)NC1CCCCC1,C04236591_decoy,TRY1,Decoy,0,-9.86187,-7.19,-3.26,-6.429821175614507
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCc1cccs1,C04237017_decoy,TRY1,Decoy,0,-10.9835,-7.72,-2.97,-8.313169281030456
C[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(=O)NC2CCCC2)c1N)c1ccc(F)cc1,C00898334_decoy,TRY1,Decoy,0,-8.75869,-5.88,-3.18,-6.850575019182707
O=C1NC(=S)S[C@H]1CNc1ccc(Cc2ccc(NC[C@@H]3SC(=S)NC3=O)cc2)cc1,C03065474_decoy,TRY1,Decoy,0,-10.1825,-6.78,-1.67,-6.74025880111182
CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NN=Cc1ccc(OCC(N)=O)c(Br)c1,C10041880_decoy,TRY1,Decoy,0,-10.7971,-6.25,-3.17,-6.610393945193884
Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=S)NC(=O)c1ccccc1Br,C12500891_decoy,TRY1,Decoy,0,-10.0046,-7.78,-2.35,-7.724812862402056
O=C(NNC(=S)NC[C@H]1CCCO1)c1ccc(NS(=O)(=O)c2cc(Cl)sc2Cl)cc1,C12533340_decoy,TRY1,Decoy,0,-10.0225,-7.38,-1.7,-7.469548286917396
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2,C13130136_decoy,TRY1,Decoy,0,-11.1651,-7.64,-2.04,-7.276394718618734
CCCOc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCCC3)cc1Br,C14647540_decoy,TRY1,Decoy,0,-11.1018,-6.6,-2.0,-6.662433312306288
COc1ccccc1NC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)Nc2ccccc2OC)[C@@H]1c1ccc(O)cc1,C15081124_decoy,TRY1,Decoy,0,-8.16736,-7.82,-2.93,-9.959473487299476
O=C(/C=C/c1cc(O)cc(O)c1)Nc1cccc2c(S(=O)(=O)Nc3ccc([N+](=O)[O-])cc3)cccc12,C15230536_decoy,TRY1,Decoy,0,-8.68929,-7.5,-2.73,-5.851292935097048
CC(=O)Nc1ccc(NC(=S)N[C@@H](NC(=O)/C=C/c2ccccc2)C(Cl)(Cl)Cl)cc1,C03103688_decoy,TRY1,Decoy,0,-8.30214,-7.3,-3.18,-6.487705763375359
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCCC2,C16322261_decoy,TRY1,Decoy,0,-10.8494,-6.2,-3.08,-6.149724814276164
COc1ccc(/C=C2\N=C(SCc3nc(N)nc(N)n3)N(c3ccc(Cl)c(OC)c3)C2=O)cc1,C17671261_decoy,TRY1,Decoy,0,-10.5996,-8.38,-1.83,-8.513456032600956
CC[C@@H](C)Cc1c(C)sc2nc(SCC(=O)Nc3sc4c(c3C(N)=O)CCC4)[nH]c(=O)c12,C18580846_decoy,TRY1,Decoy,0,-9.28741,-5.98,-1.69,-5.6747673746943725
CCN(CC)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)N/N=C(\C)c2cc(O)ccc2O)cc1,C20072233_decoy,TRY1,Decoy,0,-9.57994,-7.72,-2.66,-8.267205452238747
O=C(CSc1n[nH]c(N/N=C/c2cccc(Br)c2)n1)N[C@@H]1Nc2ccccc2S1,C20533736_decoy,TRY1,Decoy,0,-10.1185,-8.04,-2.95,-9.400701765961688
COc1ccc(NC(=S)NNC(=O)c2cnn3c2N[C@H](c2ccccc2)C[C@@H]3C(F)F)c(OC)c1,C02794063_decoy,TRY1,Decoy,0,-7.78563,-7.24,-3.26,-5.880755080675452
COc1ccc(NC(=S)NNC(=O)c2cnn3c2N[C@@H](c2ccccc2)C[C@@H]3C(F)F)c(OC)c1,C02794061_decoy,TRY1,Decoy,0,-8.86469,-8.76,-0.93,-7.610671533664306
O=C(NNC(=S)Nc1cccc2ccccc12)c1cnn2c1N[C@H](c1ccccc1)C[C@H]2C(F)F,C02792330_decoy,TRY1,Decoy,0,-7.79752,-9.03,-2.57,-7.469424170036333
Nn1c(N/N=C/c2cccc(Cl)c2Cl)nnc1SCC(=O)Nc1cccc2ccccc12,C21316178_decoy,TRY1,Decoy,0,-10.2917,-5.62,-2.63,-6.564814317325373
C/C(=N\Nc1nnc(SCC(=O)Nc2cc(Cl)ccc2Cl)n1N)c1ccc2c(c1)OCO2,C21318126_decoy,TRY1,Decoy,0,-10.9564,-9.82,-3.68,-10.060946831045086
C/C(=N\Nc1nnc(SCC(=O)Nc2sc3c(c2C#N)CCCC3)n1N)c1ccc(F)cc1,C21323468_decoy,TRY1,Decoy,0,-11.3832,-6.87,-4.6,-6.273467633043084
CC(=O)Nc1ccc(NC(=S)N[C@@H](NC(=O)/C=C\c2ccccc2)C(Cl)(Cl)Cl)cc1,C27496285_decoy,TRY1,Decoy,0,-7.00931,-6.22,-2.95,-5.3737176566778375
C[C@@H](Sc1nnc(Nc2cccc(Br)c2)s1)C(=O)Nc1sccc1C(N)=O,C31693301_decoy,TRY1,Decoy,0,-10.5464,-7.84,-3.46,-8.105859882089792
CCCCNc1ccc(S(N)(=O)=O)cc1NC(=O)CC12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2,C12619816_decoy,TRY1,Decoy,0,-10.2303,-5.44,-4.53,-5.9880304996255775
N#CC1=C(SCC(N)=O)N[C@@](O)(C(F)(F)F)[C@@H](C(=O)c2cccs2)[C@H]1c1ccccc1Cl,C33928148_decoy,TRY1,Decoy,0,-8.24658,-4.54,-2.74,-7.52531500246426
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1ccc2c(c1)OCO2)c1cccc(Cl)c1,C36486623_decoy,TRY1,Decoy,0,-9.67678,-7.88,-1.89,-11.860529263366011
O=C(NC1CCCCC1)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccccc1Cl,C36505978_decoy,TRY1,Decoy,0,-8.16345,-6.95,-1.84,-7.44139303422639
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc(O)cc2)N(C)C(=O)c2cccc(O)c2O)cc1,C36531244_decoy,TRY1,Decoy,0,-8.94381,-7.75,-2.03,-7.723256339985288
CN(C(=O)Cc1ccc2c(c1)OCO2)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36534317_decoy,TRY1,Decoy,0,-9.44685,-5.89,-1.24,-6.206755355213801
COc1ccccc1NC(=O)[C@H]1C(=O)C[C@@](C)(O)[C@@H](C(=O)Nc2ccccc2OC)[C@H]1c1ccc(O)cc1,C36556601_decoy,TRY1,Decoy,0,-7.69486,-7.33,-1.05,-6.961997484449691
Cc1ccc(CN(C(=O)c2ccc(Cl)cc2)[C@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36558770_decoy,TRY1,Decoy,0,-8.90304,-4.39,-3.8,-5.829322989427361
Cc1ccc(CN(C(=O)C#Cc2ccccc2)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36596841_decoy,TRY1,Decoy,0,-8.65691,-6.44,-3.59,-6.182511157285121
O=C(NC1CCCCC1)[C@H](c1ccc(O)c(O)c1)N(C(=O)Cn1nnc2ccccc21)c1cccc(O)c1,C00902617_decoy,TRY1,Decoy,0,-10.0302,-6.71,-1.29,-7.0143023035588055
O=C(NC[C@@H]1NN[C@H](SCc2nc3ccccc3c(=O)[nH]2)N1c1ccccc1)c1ccccc1F,C39969422_decoy,TRY1,Decoy,0,-7.99895,-7.25,-2.49,-6.168885192251665
Cc1c(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)oc2c1/C(=N/NC(=S)Nc1ccccc1)CCC2,C40825286_decoy,TRY1,Decoy,0,-8.45067,-7.2,-2.15,-5.802989225828131
COCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)Nc1ccccc1,C43553369_decoy,TRY1,Decoy,0,-8.61902,-7.06,-1.57,-6.865914863286749
C[C@]12CC[C@@H](OC(=O)NC3CCCCC3)[C@@](C)(CO)[C@@H]1CC[C@@H](O)[C@H]2CC(=O)NCc1ccco1,C43553786_decoy,TRY1,Decoy,0,-9.45524,-5.84,-2.23,-6.031252994764851
C=CCN(C)C(=O)C[C@@H]1c2nc(Nc3cccc(O)c3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C44681461_decoy,TRY1,Decoy,0,-9.1267,-7.87,-1.78,-8.450316981483745
COc1ccccc1N(CCC(N)=O)C(=O)CSc1nc(N)c2c3c(sc2n1)C[C@@H](C)CC3,C45555380_decoy,TRY1,Decoy,0,-9.69026,-6.91,-3.34,-6.954672880970128
Cc1ccc(SCc2c(C(=O)N/N=C/c3cc(Cl)ccc3O)nnn2-c2nonc2N)cc1,C01876952_decoy,TRY1,Decoy,0,-10.3869,-8.98,-4.17,-8.555057414553733
O=C(NNC(=S)NCc1ccccc1)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc(Cl)cc1)N2,C02794074_decoy,TRY1,Decoy,0,-8.69779,-8.12,-2.22,-6.393422163499798
CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(I)c(O)cc2O)cc1,C58892987_decoy,TRY1,Decoy,0,-9.48423,-6.95,-1.71,-7.032385076904153
C=CCc1cccc(/C=N/NC(=O)CSc2nnc(-c3ccc(Br)cc3)n2N)c1O,C58988471_decoy,TRY1,Decoy,0,-10.1611,-6.67,-2.59,-6.654454170678617
COc1cccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)cc3Br)n[nH]2)c1O,C59016825_decoy,TRY1,Decoy,0,-9.28676,-6.06,-2.67,-6.503448623767532
C[C@@H](Sc1n[nH]c(N/N=C/c2ccc3ccc4cccc5ccc2c3c45)n1)C(=O)NNC(=O)C1CCC1,C59879728_decoy,TRY1,Decoy,0,-10.4972,-7.51,-3.94,-6.5717516476256055
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Cc2cccs2)N1C1CCCCC1,C39938766_decoy,TRY1,Decoy,0,-10.0798,-8.8,-2.51,-9.661042545258246
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(Cc2cccs2)N1C1CCCCC1,C39938768_decoy,TRY1,Decoy,0,-9.47648,-6.47,-3.79,-7.71356729935999
NC(=O)C1CCN(C(=O)CSc2nnc(-c3sc4ncccc4c3N)n2Cc2ccco2)CC1,C64794431_decoy,TRY1,Decoy,0,-10.3314,-7.95,-2.9,-7.140953365264556
CC(CO)(CO)[NH2+]C[C@H](O)COc1ccc(OC(F)(F)F)cc1,C03045603_decoy,TRY1,Decoy,0,-6.15399,-5.8,-3.34,-4.460090996459935
C=CCOC[C@H](O)C/C=C/COC[C@H](O)C[NH2+]CCN1CCNC1=O,C04975705_decoy,TRY1,Decoy,0,-8.54058,-5.54,-2.28,-6.064474871364041
C=CCOC[C@H](O)C/C=C/COC[C@@H](O)C[NH2+]CCN1CCNC1=O,C04975712_decoy,TRY1,Decoy,0,-8.04313,-5.38,-1.39,-6.151280867066902
C[NH+](C)CCCNc1nc(N)c([N+](=O)[O-])c(NC[C@H]2CCCO2)n1,C05176079_decoy,TRY1,Decoy,0,-6.64063,-5.97,-1.02,-7.468247958552894
CCOc1cc(C[NH2+]CCO)cc(Br)c1OCC(N)=O,C08253726_decoy,TRY1,Decoy,0,-8.07386,-4.06,-2.61,-5.794163224642131
Nc1nc(NCCOCCO)nc(N2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-],C09161238_decoy,TRY1,Decoy,0,-6.5467,-6.22,-0.84,-6.161217207000319
CCOc1cc(C[NH2+]CCOCCO)cc(Cl)c1OCC(N)=O,C10435700_decoy,TRY1,Decoy,0,-9.3872,-5.15,-1.76,-5.746911695426679
COc1ccc(OC)c(C[NH2+]CCCCCc2n[nH]c(N)c2C#N)c1,C08725298_decoy,TRY1,Decoy,0,-7.47071,-6.09,-1.58,-6.447039890401076
COc1cccc(C[NH2+]CCCCCc2n[nH]c(N)c2C#N)c1OC,C14075268_decoy,TRY1,Decoy,0,-8.04007,-6.19,-1.09,-6.549669956563987
CCCCN(C(=O)C[NH+](C)CC(=O)NCCOC)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C15051309_decoy,TRY1,Decoy,0,-7.69695,-6.26,-3.74,-7.275688861120549
OC[C@H]1[C@@H](O)[C@@H](O)[C@@H](O)C[NH+]1CCCCCCOCC(F)(F)F,C22065506_decoy,TRY1,Decoy,0,-7.40962,-5.22,-3.26,-7.1773504761636016
OC[C@H]1[C@H](O)[C@@H](O)[C@@H](O)C[NH+]1CCCCCCOCC(F)(F)F,C22065512_decoy,TRY1,Decoy,0,-8.13253,-6.01,-1.58,-6.933474366520361
COc1cc(C[NH2+]CCNC[C@@H](C)O)cc(Cl)c1OCC(N)=O,C22075765_decoy,TRY1,Decoy,0,-7.92626,-5.23,-3.1,-5.260850519482879
COc1cc(C[NH2+]CCCO)c(Br)cc1OCC(N)=O,C36612915_decoy,TRY1,Decoy,0,-8.22341,-5.53,-3.13,-7.128597599534926
CC(C)[C@H]([NH3+])C(=O)OC[C@H](CO)OCn1cnc2c1N[C@H](N)NC2=O,C38664641_decoy,TRY1,Decoy,0,-7.75704,-6.92,-0.49,-8.78462893398587
CC(C)[C@H]([NH3+])C(=O)OC[C@@H](CO)OCn1cnc2c1N[C@@H](N)NC2=O,C38664643_decoy,TRY1,Decoy,0,-9.27767,-6.81,-1.58,-8.25043532701017
CC(C)[C@H]([NH3+])C(=O)OC[C@H](CO)OCn1cnc2c1N[C@@H](N)NC2=O,C38664644_decoy,TRY1,Decoy,0,-7.64146,-7.08,-1.65,-7.146274393676806
CC(C)(C)OC(=O)NC(=NCCCCCC[NH3+])NC(=O)OC(C)(C)C,C15809947_decoy,TRY1,Decoy,0,-8.99777,-6.35,-1.13,-10.325080039822122
CCC(=O)c1ccc(OC[C@H](O)C[NH2+][C@H](C)[C@H](O)c2ccc(O)cc2)cc1,C40162333_decoy,TRY1,Decoy,0,-8.07272,-7.51,-2.04,-7.714447214227766
Nc1c(NCCCn2cc[nH+]c2)ncnc1NCCc1ccccc1,C40726086_decoy,TRY1,Decoy,0,-7.29894,-6.17,-2.98,-5.485634051143237
CCOc1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40782735_decoy,TRY1,Decoy,0,-6.79944,-7.32,-2.57,-6.616178039685242
CCOc1cc(Br)c([C@H]([NH3+])COCC(N)=O)cc1OCC,C41072142_decoy,TRY1,Decoy,0,-7.45772,-6.15,-2.52,-7.044678809274516
CCOC(=O)C1=C(CS/C(N)=[NH+]/CC(C)C)NC(=O)N[C@@H]1c1ccco1,C44793318_decoy,TRY1,Decoy,0,-6.9279,-4.75,-2.5,-4.678917739873767
CCOC(=O)C1=C(CS/C(N)=[NH+]/CC(C)C)NC(=O)N[C@H]1c1ccco1,C44793321_decoy,TRY1,Decoy,0,-6.93989,-5.96,-4.01,-5.538131197493025
CC[NH+](CC)[C@H](CNC(=O)NNC(=O)C(=O)NC1CC1)CC(C)C,C45538683_decoy,TRY1,Decoy,0,-8.04565,-5.81,-2.17,-6.043533932498327
CCCC[NH+](CC(N)=O)CC(=O)NCC(=O)Nc1cccc(Cl)c1C,C45805420_decoy,TRY1,Decoy,0,-7.336,-6.69,-3.42,-6.207862429166208
Cc1[nH+]ccn1CCCNC(=O)Nc1ccccc1OCCC(N)=O,C47879281_decoy,TRY1,Decoy,0,-6.9009,-5.81,-2.51,-6.049040977440934
NC(=O)CSc1ccccc1NC(=O)NCCCCn1cc[nH+]c1,C56604210_decoy,TRY1,Decoy,0,-8.4653,-5.88,-1.51,-6.977504119417257
N/C(NCCCNc1ccc(C(F)(F)F)cn1)=[NH+]/C[C@H]1CCCO1,C58162937_decoy,TRY1,Decoy,0,-7.81587,-6.7,-1.46,-6.527130502008614
C[NH+](C)[C@H](CNC(=O)Nc1ccccc1OCCC(N)=O)c1ccco1,C47876993_decoy,TRY1,Decoy,0,-7.72984,-6.23,-2.09,-6.790380362353971
C[NH+](CCCNC(=O)C[C@H](NC(N)=O)c1cccs1)CC(F)(F)F,C60649486_decoy,TRY1,Decoy,0,-7.72667,-6.22,-0.89,-6.4879017907339565
CC[NH+](CC)CCn1/c(=N/C(=O)CCCCNC(N)=O)[nH]c2ccccc21,C61050822_decoy,TRY1,Decoy,0,-7.90222,-6.42,-2.37,-6.988417458281086
COCC[NH+]1CC[C@H](CNC(=O)Nc2ccc(OCC(N)=O)cc2C)C1,C62404881_decoy,TRY1,Decoy,0,-8.4463,-6.29,-0.97,-6.323391892934703
CCCNC(=O)C[NH+]1CCC(NC(=O)[C@@H](CCC)NC(N)=O)CC1,C63686151_decoy,TRY1,Decoy,0,-7.60632,-5.04,-2.94,-5.526540448072022
NC(=O)CCn1cc(C[NH2+]CCNc2cccnc2)c2ccccc21,C63870731_decoy,TRY1,Decoy,0,-6.81752,-5.26,-1.77,-4.966258717610596
CCOCCCNC(=O)C1CC[NH+](CCCC(=O)NC(N)=O)CC1,C58289817_decoy,TRY1,Decoy,0,-7.04421,-5.73,-3.06,-5.899870319861539
COC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)NCCCn1cc[nH+]c1,C64885724_decoy,TRY1,Decoy,0,-6.91278,-4.64,-2.82,-4.729128980080797
CCOC(=O)N[C@H](C(=O)NNC(=O)NCCCn1cc[nH+]c1)C(C)C,C64886065_decoy,TRY1,Decoy,0,-5.99396,-4.79,-2.38,-4.758127024323246
CCCC[C@@H](NC(N)=O)C(=O)NNC(=O)c1ccc(C[NH+](CC)CC)o1,C65124577_decoy,TRY1,Decoy,0,-8.1965,-5.13,-2.8,-6.534103158527162
CCCCCCOc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115451_decoy,TRY1,Decoy,0,-7.62615,-5.36,-1.22,-5.185510400257812
CCCCCCOc1ccccc1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115452_decoy,TRY1,Decoy,0,-8.27506,-4.57,-3.24,-5.543624585976597
CCOCCOc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115465_decoy,TRY1,Decoy,0,-7.9463,-6.28,-2.22,-8.65113151996086
CCOCCOc1ccccc1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115466_decoy,TRY1,Decoy,0,-7.63503,-5.32,-1.67,-5.760518470051739
CC[C@@H](C)[NH+](C)CCNC(=O)NCCNC(=O)c1n[nH]c2ccccc12,C66194862_decoy,TRY1,Decoy,0,-7.50543,-6.92,-2.92,-6.459822651452046
COc1cc(C[NH2+][C@@H](CO)CC(C)C)cc(OC)c1OCC(N)=O,C67224141_decoy,TRY1,Decoy,0,-7.57792,-5.51,-3.57,-5.211037219499906
COCC[NH+](C)CCCNC(=O)C(=O)Nc1ccc(C)c(C(N)=O)c1,C67525042_decoy,TRY1,Decoy,0,-8.31041,-5.68,-3.23,-6.647069428038514
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCCC(N)=O)c2C1,C67525418_decoy,TRY1,Decoy,0,-9.00944,-7.27,-1.36,-8.069986876392576
CC[C@@H](C)NC(=O)CCNC(=O)NC[C@@H](O)C[NH+]1CCC(C)CC1,C67629782_decoy,TRY1,Decoy,0,-7.76608,-5.08,-3.75,-5.682543178056866
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)OC(C)(C)C)CC1,C67638814_decoy,TRY1,Decoy,0,-7.39689,-6.42,-2.2,-5.688278683003604
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)OC(C)(C)C)CC1,C67638815_decoy,TRY1,Decoy,0,-8.20323,-5.07,-4.07,-5.144004802673655
Cc1cc(C)c2cc(C#N)c(NCCNC(=S)NCCC[NH+]3CCOCC3)[nH+]c2c1,C04964361_decoy,TRY1,Decoy,0,-10.2673,-5.75,-2.9,-6.511071654136517
C=CCNC(=S)Nc1cccc(NC(=O)C[C@H]([NH2+]Cc2ccco2)C(=O)[O-])c1,C05258974_decoy,TRY1,Decoy,0,-7.73097,-5.41,-5.24,-6.207246252821787
NC(=O)c1c(NC(=O)COC(=O)c2ccccc2NCCO)sc2c1CCC2,C05278276_decoy,TRY1,Decoy,0,-10.6734,-6.86,-3.93,-10.562180233136091
CC(C)CCNC(=O)[C@@H](c1ccco1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06134280_decoy,TRY1,Decoy,0,-8.45174,-7.3,-2.41,-8.266593019144915
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2ccc(C)o2)c1,C11764888_decoy,TRY1,Decoy,0,-9.01268,-7.06,-2.73,-8.814264952476025
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2ccc(C)o2)c1,C11764896_decoy,TRY1,Decoy,0,-8.82396,-7.05,-2.73,-8.530870043695993
COc1ccc(C[NH2+]CCc2c(C)n[nH]c2C)c(OC[C@H](O)C[NH+]2CCCC2)c1,C11813729_decoy,TRY1,Decoy,0,-8.16312,-7.29,-0.88,-7.460805749204528
COc1ccc(C[NH2+]CCc2c(C)n[nH]c2C)c(OC[C@@H](O)C[NH+]2CCCC2)c1,C11813730_decoy,TRY1,Decoy,0,-8.52927,-6.74,-1.93,-7.405552269256258
Cc1n[nH]c(SCC[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCCCC2)n1,C12093194_decoy,TRY1,Decoy,0,-8.70213,-5.59,-2.02,-6.708159579854876
Cc1n[nH]c(SCC[NH2+]Cc2ccccc2OC[C@H](O)C[NH+]2CCCCC2)n1,C12093199_decoy,TRY1,Decoy,0,-7.27322,-4.93,-1.61,-5.461585932069588
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CC(C)(C)OC)c1,C12475745_decoy,TRY1,Decoy,0,-7.66277,-6.22,-3.33,-6.066926697589001
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CC(C)(C)OC)c1,C12475750_decoy,TRY1,Decoy,0,-8.07948,-5.08,-4.29,-7.194114244413862
COc1cc(C[NH2+]CCc2c[nH]cn2)ccc1OC[C@@H](O)C[NH+]1CCSCC1,C11819566_decoy,TRY1,Decoy,0,-8.14048,-6.67,-1.63,-7.703959135461
CCCCCCO[C@@H]1O[C@@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14438552_decoy,TRY1,Decoy,0,-4.63029,-6.03,-2.51,-5.070016665830417
CCCCCCO[C@H]1O[C@@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14438554_decoy,TRY1,Decoy,0,-5.48872,-6.05,-2.56,-4.87288187052398
CCCCCCO[C@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14438558_decoy,TRY1,Decoy,0,-5.5982,-6.42,-3.06,-4.69299373983046
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2ccncc2C)c1,C15062580_decoy,TRY1,Decoy,0,-8.35995,-6.78,-2.24,-6.985038807139734
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2ccncc2C)c1,C15062582_decoy,TRY1,Decoy,0,-7.57421,-6.42,-2.27,-5.386062376970262
O[C@@H](COc1cccc(C[NH2+]CCSc2ncn[nH]2)c1)C[NH+]1CCCCCC1,C15069151_decoy,TRY1,Decoy,0,-9.44684,-6.31,-1.29,-7.360013548117267
O[C@H](COc1cccc(C[NH2+]CCSc2ncn[nH]2)c1)C[NH+]1CCCCCC1,C15069153_decoy,TRY1,Decoy,0,-9.76134,-6.62,-0.62,-8.163363162643623
O=C1NCCN1CC[NH2+]Cc1cccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)c1,C15072532_decoy,TRY1,Decoy,0,-8.65006,-6.69,-1.85,-6.133363520861019
O=C1NCCN1CC[NH2+]Cc1cccc(OC[C@@H](O)C[NH+]2CCc3ccccc3C2)c1,C15072534_decoy,TRY1,Decoy,0,-8.27397,-7.08,-1.82,-6.137088082238238
COc1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cc([N+](=O)[O-])c1[O-],C20836309_decoy,TRY1,Decoy,0,-8.80275,-6.37,-1.65,-6.056549233790245
CCCCCCO[C@H]1O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C35455019_decoy,TRY1,Decoy,0,-4.55418,-6.2,-1.78,-4.587887281094356
O=C(/C=C/c1ccc(O)cc1)NCCCCNC(=O)/C=C/c1ccc(O)c(O)c1,C35465989_decoy,TRY1,Decoy,0,-9.65397,-9.59,-4.2,-8.575191930580974
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(=O)OC2,C35645502_decoy,TRY1,Decoy,0,-6.27967,-6.98,-2.5,-4.842907282542475
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1ccc(O)cc1,C36597190_decoy,TRY1,Decoy,0,-8.6951,-5.72,-3.12,-6.144942766623039
CCC[C@@H](C(=O)NC(C)(C)C)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06500952_decoy,TRY1,Decoy,0,-7.65922,-6.69,-1.41,-10.90744931899837
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(O)cc2)c1N,C12474129_decoy,TRY1,Decoy,0,-8.04035,-7.97,-2.26,-9.919417335411168
C[C@@H](CNC(=O)[C@H]1N[NH2+]C2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363325_decoy1,TRY1,Decoy,0,-8.10062,-7.05,,-5.907072262010376
C[C@H](CNC(=O)[C@H]1N[NH2+]C2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363326_decoy1,TRY1,Decoy,0,-9.34054,-6.79,,-6.704999573268739
C[C@@H](CNC(=O)[C@@H]1N[NH2+]C2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363327_decoy,TRY1,Decoy,0,-8.88685,-5.78,-2.61,-5.972078564260098
C[C@H](CNC(=O)[C@@H]1N[NH2+]C2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363328_decoy1,TRY1,Decoy,0,-9.36235,-7.15,,-6.112619838342776
COc1cc(C[NH2+]CC2=CC=C[C@H]3N=CC=C23)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C39394217_decoy,TRY1,Decoy,0,-8.98846,-5.49,-3.92,-5.156981727255469
COc1cc(C[NH2+]CC2=CC=C[C@H]3N=CC=C23)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C39394219_decoy,TRY1,Decoy,0,-9.18112,-6.95,-3.38,-6.020413013770899
COc1cc(C[NH2+]CC2=CC=C[C@@H]3N=CC=C23)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C39394223_decoy,TRY1,Decoy,0,-9.87425,-7.62,-2.06,-6.21830978051173
C[NH2+]CCC[NH2+]Cc1ccc(OC[C@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C40719302_decoy,TRY1,Decoy,0,-7.97385,-6.63,-2.87,-5.8570121337193735
C[NH2+]CCC[NH2+]Cc1ccc(OC[C@@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C40719303_decoy,TRY1,Decoy,0,-7.9723,-6.14,-3.02,-5.211559504199185
CCCNC(=O)C[NH+]1CCC(NC(=O)NCCC[NH+]2C[C@H](C)C[C@H](C)C2)CC1,C61959991_decoy,TRY1,Decoy,0,-9.13866,-6.8,-4.1,-6.712331582465481
O=C(CS[C@@H]1NN[C@H](NCc2ccco2)S1)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C64684760_decoy,TRY1,Decoy,0,-8.8222,-7.4,-2.31,-6.590969127269112
CCCC[C@H](NC(N)=O)C(=O)NCCNc1ncc(C(F)(F)F)cc1Cl,C65580777_decoy,TRY1,Decoy,0,-7.74002,-6.88,-3.53,-6.411409530541643
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NC1CC[NH+](CC(=O)NCCC)CC1,C66596905_decoy,TRY1,Decoy,0,-8.942,-5.88,-2.48,-6.518178044771939
CCCC[NH+]1CCCC[C@H]1CNC(=O)NC1CC[NH+](CC(=O)NCCC)CC1,C66596906_decoy,TRY1,Decoy,0,-8.53631,-5.72,-1.97,-6.1229789253326645
CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC1,C67120523_decoy,TRY1,Decoy,0,-8.56453,-5.87,-4.11,-5.728855552620968
COc1cc(C[NH2+]CC(C)(C)[NH+]2CCC[C@@H](C)C2)cc(OC)c1OCC(N)=O,C67222404_decoy,TRY1,Decoy,0,-7.12902,-6.64,-2.75,-5.307833538086021
COc1cc(C[NH2+]CC(C)(C)[NH+]2CCC[C@H](C)C2)cc(OC)c1OCC(N)=O,C67222405_decoy,TRY1,Decoy,0,-8.18711,-6.49,-3.34,-5.758355413298293
COc1cc(C[NH2+][C@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)cc(OC)c1OCC(N)=O,C67251528_decoy,TRY1,Decoy,0,-8.15196,-6.66,-5.03,-5.729671720523526
COc1cc(C[NH2+][C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)cc(OC)c1OCC(N)=O,C67251529_decoy,TRY1,Decoy,0,-7.96335,-6.82,-3.02,-6.707887803607262
COc1cc(C[NH2+][C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)cc(OC)c1OCC(N)=O,C67251533_decoy,TRY1,Decoy,0,-8.30049,-6.2,-2.8,-5.551131306252485
COc1ccc(-c2cc(=O)c3c(O)c(OC)c(O[C@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C03978447_decoy,TRY1,Decoy,0,-7.30997,-7.59,-3.04,-5.681152435444764
COC(=O)[C@H](NC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(C(C)=O)cc2)C1)C(C)C,C04151682_decoy,TRY1,Decoy,0,-9.87587,-5.06,-2.72,-6.13694323463618
CC(=O)N[C@@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C05260493_decoy,TRY1,Decoy,0,-5.58848,-6.07,-3.38,-5.083336542443539
CCOC(=O)C1=C(C)N(NC(N)=O)C2([NH3+])N(NC(N)=O)C(C)=C(C(=O)OCC)C12C(=O)OCC,C05723331_decoy,TRY1,Decoy,0,-5.86513,-4.99,-2.22,-5.339273542177999
N#CCc1ccc([C@H](C#N)/C(CCCC(=O)Nc2cccc([N+](=O)[O-])c2)=N\NC(=O)NN)cc1,C05891712_decoy,TRY1,Decoy,0,-8.02421,-8.65,-3.44,-7.970995064290725
N#CCc1ccc([C@@H](C#N)/C(CCCC(=O)Nc2cccc([N+](=O)[O-])c2)=N\NC(=O)NN)cc1,C05891716_decoy,TRY1,Decoy,0,-7.69705,-9.01,-1.66,-7.642114635252853
CCOC(=O)CNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06547135_decoy,TRY1,Decoy,0,-9.39112,-7.96,-1.16,-14.361516312502753
CCOCCCN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCC(C)C)c1ccc(O)cc1,C06600068_decoy,TRY1,Decoy,0,-9.34847,-7.03,-4.28,-9.338161532849105
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCOC)c1ccc(O)cc1,C06631408_decoy,TRY1,Decoy,0,-7.13548,-6.57,-2.18,-7.948101944253428
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2cccc(F)c2)nnn1-c1nonc1N,C02444748_decoy,TRY1,Decoy,0,-7.39984,-7.24,-1.58,-6.71910252535341
CCOc1cc(C(=O)NCC(=O)NNc2ncnc(N)c2[N+](=O)[O-])cc(OCC)c1OCC,C09391674_decoy,TRY1,Decoy,0,-7.46453,-7.46,-2.91,-7.665831640625714
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2ncnc(N)c2[N+](=O)[O-])cc1,C09391676_decoy,TRY1,Decoy,0,-7.31995,-7.36,-3.03,-6.6160006883212
CN(C)c1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)cc1,C09309327_decoy,TRY1,Decoy,0,-9.60606,-8.06,-2.59,-7.251586297574358
CCNc1nc2c(c(=O)[nH]c(=O)n2C)n1CC(O)Cn1c(NCC)nc2c1c(=O)[nH]c(=O)n2C,C10049610_decoy,TRY1,Decoy,0,-8.64062,-7.8,-2.0,-9.436040145951331
CC(C)C(=O)Oc1ccccc1/C=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975160_decoy,TRY1,Decoy,0,-7.32061,-7.59,-2.22,-7.857269254569608
C/C(COc1cccc([N+](=O)[O-])c1)=N/Nc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975265_decoy,TRY1,Decoy,0,-7.74381,-8.14,-3.43,-7.478940066743152
C/C(COc1cccc([N+](=O)[O-])c1)=N/Nc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975267_decoy,TRY1,Decoy,0,-6.506,-8.09,-3.81,-6.590125279437388
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1,C12473908_decoy,TRY1,Decoy,0,-7.9369,-6.47,-2.08,-6.35191590005048
Cn1cnc(Sc2c(O)cc(O)c3c2C[C@@H](C(=O)[O-])[NH2+][C@H]3Cc2ccc(O)cc2)c1C[C@@H]([NH3+])C(=O)[O-],C05545536_decoy,TRY1,Decoy,0,-10.9524,-6.63,-3.91,-7.772428011233587
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13515148_decoy,TRY1,Decoy,0,-5.29956,-6.72,-2.45,-4.852346156912932
Cn1cnc(Sc2c(O)cc(O)c3c2C[C@H](C(=O)[O-])[NH2+][C@@H]3Cc2ccc(O)cc2)c1C[C@@H]([NH3+])C(=O)[O-],C14516284_decoy,TRY1,Decoy,0,-7.28124,-7.39,-2.84,-6.376885840007367
Cn1cnc(Sc2c(O)cc(O)c3c2C[C@@H](C(=O)[O-])[NH2+][C@@H]3Cc2ccc(O)cc2)c1C[C@@H]([NH3+])C(=O)[O-],C14516290_decoy,TRY1,Decoy,0,-6.88873,-7.94,-3.54,-5.513935455389011
COCCNC(=S)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCN(c4cccc[nH+]4)CC3)[NH+]2C1,C15708167_decoy,TRY1,Decoy,0,-6.33452,-6.34,-1.76,-4.834253619182884
O=C(N/N=C/[C@H](O)[C@H](O)[C@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](O)CO)c1ccccc1Cl,C15775363_decoy,TRY1,Decoy,0,-7.99389,-7.98,-3.19,-7.173038284184972
O=C(N/N=C/[C@H](O)[C@H](O)[C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](O)CO)c1ccccc1Cl,C15775367_decoy,TRY1,Decoy,0,-7.67439,-7.87,-3.68,-6.308090997222841
CCCCN(C(=O)CCC(=O)OCC(=O)NC(=O)NCC)c1c(N)n(CCC)c(=O)[nH]c1=O,C16050381_decoy,TRY1,Decoy,0,-8.51312,-6.64,-3.32,-7.013912437822188
O=C(NNC(=S)Nc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=S)Nc1ccc([N+](=O)[O-])cc1,C16221219_decoy,TRY1,Decoy,0,-7.79855,-6.65,-2.08,-6.310043251138436
CCOc1ccc(CC(=O)N/N=C\C(=N/NC(=O)Cc2ccc(OCC)cc2)[C@@H](O)[C@H](O)[C@@H](O)CO)cc1,C16915345_decoy,TRY1,Decoy,0,-9.26771,-8.43,-2.85,-7.928968504130051
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3Cl)n2)s1,C20833458_decoy,TRY1,Decoy,0,-10.6004,-7.51,-3.37,-9.151953946342086
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCc3nnc(C)o3)s2)n[nH]1)c1ccc(N)cc1,C20836879_decoy,TRY1,Decoy,0,-10.385,-8.87,-3.65,-9.597897383393306
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1)c1cccnc1,C20837260_decoy,TRY1,Decoy,0,-10.204,-5.83,-2.21,-6.800024407108603
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1)c1ccc([N+](=O)[O-])cc1,C20838012_decoy,TRY1,Decoy,0,-11.2259,-6.88,-3.58,-6.82323954959934
CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)cn1,C20838096_decoy,TRY1,Decoy,0,-9.70754,-7.45,-4.48,-6.846379867204897
O=c1c(OCCO)c(-c2ccc(OCCO)c(OCCO)c2)oc2cc(OCCO)cc(OCCO)c12,C28219858_decoy,TRY1,Decoy,0,-10.6955,-5.86,-3.26,-7.408602045262231
CC(C)Cn1c(N)c(C(=O)CSc2nnc(CCC(N)=O)n2Cc2ccco2)c(=O)[nH]c1=O,C28947205_decoy,TRY1,Decoy,0,-8.93891,-7.89,-2.88,-8.022110165397104
CCOC(=O)CNC(=O)CNC(=O)CNC(=O)CCCCSc1nc(N)nc2[nH]cnc12,C05349415_decoy,TRY1,Decoy,0,-8.22624,-5.53,-2.77,-6.161269202481587
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])Cc2ccc(O)cc2)[C@H](O)[C@@H]1O,C38665107_decoy,TRY1,Decoy,0,-9.52734,-9.33,-2.31,-7.562597277956853
O=C(N/N=C/[C@@H](O)[C@@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1Cl,C33957525_decoy,TRY1,Decoy,0,-7.39368,-6.92,-1.77,-5.436049892966029
COc1c(C)c[nH+]c(CN2CC(=O)N([C@H](C)C(=O)NCC[NH+](C)C)c3c(Cl)nc(N)nc32)c1C,C43076247_decoy,TRY1,Decoy,0,-8.34,-5.5,-2.44,-6.623676932381367
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1ccc(O)c(OC)c1,C33904198_decoy,TRY1,Decoy,0,-8.12316,-6.9,-1.91,-6.5843067673840086
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)OC2,C44963892_decoy,TRY1,Decoy,0,-5.66871,-7.31,-1.94,-4.523492205181936
COc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H]2O)c1OC,C49601374_decoy,TRY1,Decoy,0,-6.81439,-5.79,-1.56,-5.321557337312916
NC(=O)Cn1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CN2CCc3ccccc32)c(-c2ccccc2)n1,C01873574_decoy,TRY1,Decoy,0,-10.418,-8.24,-1.47,-8.152706498248266
COc1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)c([N+](=O)[O-])cc1O,C59881584_decoy,TRY1,Decoy,0,-9.0475,-7.64,-3.87,-9.26623065123551
COc1cc(/C=N/Nc2nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]2)c([N+](=O)[O-])cc1O,C59881597_decoy,TRY1,Decoy,0,-7.89742,-7.63,-3.45,-6.93140794521229
COCCn1cc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)cn1,C59887442_decoy,TRY1,Decoy,0,-10.0093,-5.82,-2.59,-7.012553025936396
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1,C59888376_decoy,TRY1,Decoy,0,-10.0817,-8.93,-3.14,-10.483886852655964
COC(=O)[C@@H]1[NH+]=c2cccc(OC)c2=C1NC(=O)CN1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C38669791_decoy,TRY1,Decoy,0,-6.26191,-5.36,-3.13,-5.65296942487419
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64044484_decoy,TRY1,Decoy,0,-6.86639,-7.69,-3.21,-6.004723143817573
CC(C)(C)CC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NC1CCCC1,C03841082_decoy,TRY1,Decoy,0,-11.1399,-7.81,-1.66,-8.011165731743542
CCOC(=O)[C@@](NC(=O)COc1ccccc1)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C03670099_decoy,TRY1,Decoy,0,-9.33197,-6.21,-2.34,-7.593870572009324
CC(C)(C)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]3CC(=O)NC2CC2)cc1,C04222334_decoy,TRY1,Decoy,0,-10.2626,-9.06,-2.13,-7.504728303772351
CCCCCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCc1cc(F)cc(F)c1,C04237043_decoy,TRY1,Decoy,0,-11.7804,-8.73,-3.09,-9.237330318847158
CSCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NC1CCCCC1,C04260515_decoy,TRY1,Decoy,0,-10.4983,-7.08,-3.54,-7.377974351145577
Nn1c(SCc2ccccc2CSc2nnc(C3CCCCC3)n2N)nnc1C1CCCCC1,C08921016_decoy,TRY1,Decoy,0,-12.1445,-7.45,-3.48,-7.71783070628608
COc1cc([C@H]2C(C#N)=C(N)Oc3nc(SCc4ccccc4Cl)nc(N)c32)cc(OC)c1OC,C12418730_decoy,TRY1,Decoy,0,-9.012,-5.99,-2.14,-6.805409004160491
S=C(Nc1ccc2c(c1)OCCO2)NC1CCC(NC(=S)Nc2ccc3c(c2)OCCO3)CC1,C12543380_decoy,TRY1,Decoy,0,-9.85204,-7.87,-1.46,-7.389424225070348
CCCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1ccccc1C(=O)NCCO,C14651564_decoy,TRY1,Decoy,0,-9.56915,-7.49,-2.5,-8.245441655565951
Cc1cc(O)ccc1N[C@@H]([C@H](Nc1ccc(O)cc1C)n1nnc2ccccc21)n1nnc2ccccc21,C16282735_decoy,TRY1,Decoy,0,-9.03214,-8.52,-1.84,-8.662886598696339
O=C(NC(=S)Nc1ccc2nc(NC(=S)NC(=O)c3cccs3)sc2c1)c1cccs1,C16430536_decoy,TRY1,Decoy,0,-11.7696,-7.51,-3.46,-7.940617931216953
C=CCOC(=O)/N=c1/[nH]c2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)Nc1ccccc1,C06131157_decoy,TRY1,Decoy,0,-9.72136,-6.62,-3.07,-7.624923475641314
Nn1c(N/N=C/c2ccc(Cl)cc2Cl)nnc1SCC(=O)Nc1cccc(Cl)c1Cl,C20527923_decoy,TRY1,Decoy,0,-10.9968,-9.5,-1.79,-10.089089254555718
Cc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)NNC(=S)Nc4ccccc4C)cc3N2)cc1C,C02794187_decoy,TRY1,Decoy,0,-9.20668,-9.0,-1.83,-6.405539120264315
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3cccc4ccccc34)n2N)sc2c1CCCC2,C20805782_decoy,TRY1,Decoy,0,-11.7882,-9.99,-1.28,-11.00982361289612
O=C(CCSc1n[nH]c(N/N=C/c2c(O)ccc3ccccc23)n1)Nc1ccc(OC(F)(F)F)cc1,C20907740_decoy,TRY1,Decoy,0,-9.14506,-8.83,-3.79,-7.5535460106545
Nn1c(N/N=C/c2cccc3ccccc23)nnc1SCCC(=O)Nc1c(Cl)cccc1Cl,C20912779_decoy,TRY1,Decoy,0,-9.91539,-8.86,-2.02,-9.643429330542435
O=C(CCSc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1)Nc1ccc(Br)cc1,C21080453_decoy,TRY1,Decoy,0,-11.1028,-8.28,-2.69,-8.299449614051767
Cc1cc(C)cc(OCc2nnc(S[C@H](C)C(=O)NC(=O)NC34CC5CC(CC(C5)C3)C4)n2N)c1,C24272286_decoy,TRY1,Decoy,0,-9.53264,-7.08,-1.44,-6.053795421034146
C[C@H]1CCc2c(sc(NC(=O)CSc3nnc(NCc4ccc(F)cc4)s3)c2C(N)=O)C1,C24507082_decoy,TRY1,Decoy,0,-12.1053,-8.07,-3.33,-8.789881796916877
C[C@]1(CO)[C@H]2CC[C@@H](O)[C@@H](CC(=O)NCc3cccs3)[C@]2(C)CC[C@H]1OC(=O)Nc1ccccc1,C06137717_decoy,TRY1,Decoy,0,-9.55126,-6.13,-2.48,-7.832982553791695
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1cccc(O)c1)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500463_decoy,TRY1,Decoy,0,-8.26861,-5.48,-1.47,-6.25837150770339
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500471_decoy,TRY1,Decoy,0,-8.35834,-5.28,-4.87,-6.187983278552334
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)Cc1cccc(Cl)c1Cl,C36500959_decoy,TRY1,Decoy,0,-10.1197,-6.15,-2.48,-6.979023723809812
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccc(F)cc1,C36506222_decoy,TRY1,Decoy,0,-8.51997,-7.47,-4.83,-9.867566302442086
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1ccc2c(c1)OCO2)c1ccccc1Cl,C36546331_decoy,TRY1,Decoy,0,-8.54414,-8.12,-2.51,-8.795794082394186
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl,C36549951_decoy,TRY1,Decoy,0,-6.33957,-6.28,-3.53,-5.702563164588096
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1,C36553074_decoy,TRY1,Decoy,0,-6.34475,-6.36,-4.58,-5.894760618020262
COCC(=O)N(c1cccc(Cl)c1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36553562_decoy,TRY1,Decoy,0,-8.29217,-6.04,-4.52,-6.318189914821351
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1ccc(Br)cc1)C(C)(C)C,C36583877_decoy,TRY1,Decoy,0,-7.23186,-6.9,-2.58,-6.585312446212294
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1cccc(Cl)c1Cl)C(C)(C)C,C36587166_decoy,TRY1,Decoy,0,-7.31536,-7.39,-1.52,-6.20806546111885
Cc1ccc(CN(C(=O)C[C@H](C)c2ccccc2)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36598525_decoy,TRY1,Decoy,0,-8.81448,-5.58,-2.43,-6.3350443783567005
CCOc1ccc(/C=C/C2=Cc3c(sc(NC(=O)CSc4n[nH]c(N)n4)c3C#N)C(C)(C)C2)cc1,C08829623_decoy,TRY1,Decoy,0,-8.98368,-7.39,-3.4,-6.751152035589733
Cc1ccc(NC(=O)CSC2=NN[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(Cl)cc2)c(C)c1,C39363062_decoy,TRY1,Decoy,0,-7.13684,-8.51,-3.01,-7.65911811397792
C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(N)c1Cl)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C39561242_decoy,TRY1,Decoy,0,-10.7623,-8.66,-3.48,-8.055505724933905
COc1ccccc1Nc1nc2c(c(=O)[nH]1)[C@@H](C(=O)Nc1ccccc1Sc1ccccc1)CC(=O)N2,C40400057_decoy,TRY1,Decoy,0,-8.34709,-8.34,-1.02,-6.801154613404342
Cc1cc([C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(N2CCN(CCO)CC2)c1N,C40688664_decoy,TRY1,Decoy,0,-11.0532,-6.74,-2.1,-6.277947771333091
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NCCN2CCOCC2)c1N,C40688793_decoy,TRY1,Decoy,0,-9.64602,-6.32,-2.28,-6.298831274516302
Nc1c(NNC(=O)c2ccccc2Br)ncnc1N(Cc1ccccc1)Cc1ccccc1,C40709604_decoy,TRY1,Decoy,0,-8.30145,-7.25,-0.77,-7.971170176577009
Cc1c(C(=O)NNC(=O)c2ccccc2Cl)oc2c1/C(=N/NC(=S)Nc1ccccc1)CCC2,C40825290_decoy,TRY1,Decoy,0,-8.48462,-7.62,-2.54,-6.386722479263901
NC(=O)c1c(Nc2nc(NCc3cccnc3)nc3c2cnn3-c2ccccc2)sc2c1CCCC2,C41025966_decoy,TRY1,Decoy,0,-9.01811,-9.09,-0.07,-8.805802212563293
NC(=O)c1c(Nc2nc(NCc3ccc(F)cc3)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026325_decoy,TRY1,Decoy,0,-9.14591,-6.42,-2.54,-6.948104550347648
C=CCNC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)NCc2cc(F)cc(F)c2)[C@]1(C)CO,C43553775_decoy,TRY1,Decoy,0,-9.57887,-6.59,-3.64,-7.304489776862719
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)NC1CCCC1,C43554224_decoy,TRY1,Decoy,0,-10.6156,-7.46,-2.87,-7.646133328443788
C=CCOC(=O)/N=c1/[nH]c2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)Nc1ccccc1,C43554268_decoy,TRY1,Decoy,0,-10.236,-7.04,-2.6,-7.800873939628536
CCCCCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)NCCOC,C43554317_decoy,TRY1,Decoy,0,-10.8272,-5.13,-3.39,-6.779244793608802
COc1ccc([C@@H](CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)c2c[nH]c3ccccc23)cc1,C45864133_decoy,TRY1,Decoy,0,-9.51475,-6.43,-2.75,-6.53292966226279
Nn1c(SCCCC(=O)N/N=C/c2cc(Cl)ccc2O)nnc1-c1ccccc1Br,C58990215_decoy,TRY1,Decoy,0,-10.1098,-7.44,-3.67,-6.947669584285662
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Cl)ccc3O)n2)c(Br)c1,C59018585_decoy,TRY1,Decoy,0,-11.245,-9.0,-3.71,-11.799366385453736
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NCc2ccc(C(F)(F)F)cc2)n[nH]1,C59887686_decoy,TRY1,Decoy,0,-10.2943,-8.19,-3.48,-8.236180578907513
C[NH+](C)CCCNC(=S)N(CCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C04160504_decoy,TRY1,Decoy,0,-8.89183,-5.27,-1.94,-5.973360886241006
[H]/N=C1\SC(N)=C(C#N)[C@H](c2ccc(OCC[NH+]3CCOCC3)c(OCC)c2)[C@H]1C#N,C04036757_decoy,TRY1,Decoy,0,-7.83251,-6.4,-1.28,-5.796517051534988
C[C@]1(CO)[C@H]2Cc3sc(-c4cccnc4)nc3[C@@H](CC(=O)NCC[NH+]3CCOCC3)[C@]2(C)CC[C@H]1O,C04260530_decoy,TRY1,Decoy,0,-10.692,-7.43,-2.38,-7.112252992039038
Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c1C[NH+]1CCCC1,C03665040_decoy,TRY1,Decoy,0,-8.11294,-6.38,-3.06,-6.272822945032777
Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])c1C[NH+]1CCCCC1,C09057165_decoy,TRY1,Decoy,0,-7.59326,-6.08,-3.6,-5.133891581994999
C[NH+](C)Cc1c(C(=O)N/N=C/c2ccc(C(F)(F)F)cc2)nnn1-c1nonc1N,C02389850_decoy,TRY1,Decoy,0,-8.37677,-7.36,-1.13,-9.869371205993914
COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)c(OC)c1OC,C03640485_decoy,TRY1,Decoy,0,-8.64308,-6.89,-2.77,-9.2035157556574
CCCn1c(N)c(C(=O)C[NH+]2CCN(S(=O)(=O)N(CC)CC)CC2)c(=O)[nH]c1=O,C11671082_decoy,TRY1,Decoy,0,-7.16544,-6.4,-3.53,-7.527654501335683
CC(=O)Nc1ccc(NC(=O)C(=O)NCC[NH+]2CCN(c3ccc(F)cc3)CC2)cc1,C11901216_decoy,TRY1,Decoy,0,-7.90956,-7.96,-1.41,-5.775018795953505
CN(C)c1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCOCC2)cc1,C03095466_decoy,TRY1,Decoy,0,-8.61168,-7.11,-3.02,-7.386356615252263
CCCOc1ccc(N2C(=O)C[C@@H]([NH+]3CCC(Nc4ccc(F)cc4)(C(N)=O)CC3)C2=O)cc1,C10078886_decoy,TRY1,Decoy,0,-8.54205,-8.44,-3.03,-6.996365804622429
COc1ccc(OC[C@@H](O)Cn2c(N3CC[NH2+]CC3)nc3c2c(=O)[nH]c(=O)n3C)cc1,C06444838_decoy,TRY1,Decoy,0,-8.20905,-6.92,-1.64,-8.059128467860514
C[NH+](C)Cc1c(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)nnn1-c1nonc1N,C02195482_decoy,TRY1,Decoy,0,-8.35671,-5.55,-4.01,-4.948373883047956
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C13689493_decoy,TRY1,Decoy,0,-8.39411,-1.16,-4.65,-3.886605085263081
O=C1NC[C@@H](CCC(=O)N2CCCC2)[NH+]2C[C@@H](NC(=S)NCc3ccco3)C[C@@H]12,C15707533_decoy,TRY1,Decoy,0,-7.86625,-6.09,-2.51,-5.749630733024974
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1cccc(OC)c1OC,C19925899_decoy,TRY1,Decoy,0,-8.74178,-6.32,-2.56,-7.269274671163716
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1,C19925900_decoy,TRY1,Decoy,0,-7.95791,-7.98,-1.5,-10.195496616419272
Nc1nonc1-n1nnc(C[NH+]2CCCCC2)c1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1,C19927071_decoy,TRY1,Decoy,0,-7.7343,-7.85,-3.59,-7.372945870903893
CCOc1ccc(/C=N/NC(=O)c2c(C[NH+]3CCCC3)nnn2-c2nonc2N)cc1,C19927090_decoy,TRY1,Decoy,0,-8.5653,-7.68,-2.22,-8.566897095340442
Nc1nonc1-n1nnc(C[NH+]2CCCC2)c1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1,C19927154_decoy,TRY1,Decoy,0,-7.59136,-7.9,-2.7,-7.039961010884338
CCOc1ccccc1/C=N/NC(=O)c1c(C[NH+]2CCCC2)nnn1-c1nonc1N,C19927181_decoy,TRY1,Decoy,0,-8.07922,-7.03,-0.51,-8.142993906279322
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C(\C)c1ccc([N+](=O)[O-])cc1,C19928369_decoy,TRY1,Decoy,0,-7.63682,-6.77,-1.09,-7.493514749021801
CC[C@@H](Sc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccc(Br)cc1)C(=O)NCCOC,C02927067_decoy,TRY1,Decoy,0,-8.91223,-5.88,-3.15,-8.259588597708392
CCNC(=O)C[NH+]1CCN(C(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1,C29334915_decoy,TRY1,Decoy,0,-6.38699,-6.7,-3.21,-5.4255277680224525
COCCn1c(N)c(C(=O)C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(=O)[nH]c1=O,C28928291_decoy,TRY1,Decoy,0,-6.76775,-7.22,-3.11,-5.577255455325518
C[NH+](Cc1c(C(=O)N/N=C/c2ccncc2)nnn1-c1nonc1N)C1CCCCC1,C09308251_decoy,TRY1,Decoy,0,-8.46209,-8.37,-2.9,-8.255951561937266
C[NH+]1[C@@H](CCC(=O)NCc2ccc(F)cc2)CNC(=O)[C@@H]2[C@H]1CCN2Cc1ncc[nH]1,C22922833_decoy,TRY1,Decoy,0,-8.39386,-7.69,-1.77,-6.889348700322689
CCOC(=O)c1c(NC(=O)[C@@H](C)[NH2+]CC(=O)N[C@H]2CCS(=O)(=O)C2)sc2c1CC[C@@H](C)C2,C36386093_decoy,TRY1,Decoy,0,-8.92962,-6.1,-3.09,-6.66478002860632
O=C(C[C@@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(CCO)CC1)Nc1ccc(F)cc1,C22933492_decoy,TRY1,Decoy,0,-6.15108,-7.26,-1.37,-5.130887210959473
O=C(C[C@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(CCO)CC1)Nc1ccc(F)cc1,C22933490_decoy,TRY1,Decoy,0,-7.45308,-7.54,-2.66,-8.152708369682138
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39632128_decoy,TRY1,Decoy,0,-8.97293,-6.46,-1.76,-6.941070477309416
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39632130_decoy,TRY1,Decoy,0,-9.85685,-4.72,-4.65,-5.7257992888838585
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39632133_decoy,TRY1,Decoy,0,-9.25147,-5.63,-2.29,-6.197729286385411
O=C(NNc1ncnc(Nc2cc[nH+]cc2)c1[N+](=O)[O-])c1ccc(Cl)c([N+](=O)[O-])c1,C40586428_decoy,TRY1,Decoy,0,-6.04229,-5.81,-4.25,-5.392438867782749
O=C(NNc1ncnc(NCC[NH+]2CCCCC2)c1[N+](=O)[O-])c1ccccc1[N+](=O)[O-],C40622697_decoy,TRY1,Decoy,0,-5.46002,-7.38,-1.14,-10.34203284871914
O=C(Cc1ccc([N+](=O)[O-])cc1)NNc1ncnc(NCC[NH+]2CCCCC2)c1[N+](=O)[O-],C40622748_decoy,TRY1,Decoy,0,-7.93872,-5.97,-1.3,-5.761764533351856
C[NH+]1CCN(Nc2ncnc(NNC(=O)Cc3ccc([N+](=O)[O-])cc3)c2[N+](=O)[O-])CC1,C40623688_decoy,TRY1,Decoy,0,-5.70171,-6.04,-1.96,-4.741600614172109
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1,C40658162_decoy,TRY1,Decoy,0,-6.86985,-6.5,-3.59,-5.486214910338712
O=C(Cc1ccc([N+](=O)[O-])cc1)NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-],C40659263_decoy,TRY1,Decoy,0,-6.52627,-5.65,-2.59,-4.96614886664081
CCc1ccc(-[n+]2c(SCC(=O)NCc3ccco3)nc3n[nH]c(C)c3c2N)cc1,C33626475_decoy,TRY1,Decoy,0,-10.2568,-8.03,-1.1,-9.721134835762289
O=C(CCCNC(=O)NC1CCCCC1)N[C@@H]1CS(=O)(=O)C[C@@H]1[NH+]1CCCCC1,C60362725_decoy,TRY1,Decoy,0,-9.32767,-8.0,-1.72,-7.56009952103243
O=C(CCCNC(=O)NC1CCCCC1)N[C@H]1CS(=O)(=O)C[C@@H]1[NH+]1CCCCC1,C60362726_decoy,TRY1,Decoy,0,-8.94861,-6.03,-3.87,-6.135863907683037
O=C(CCCNC(=O)NC1CCCCC1)N[C@@H]1CS(=O)(=O)C[C@H]1[NH+]1CCCCC1,C60362727_decoy,TRY1,Decoy,0,-10.1514,-7.47,-1.83,-8.009524296295531
CC(=O)N/C(=C\C1=c2ccccc2=[NH+]C1)C(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C63136705_decoy,TRY1,Decoy,0,-8.05924,-6.59,-1.6,-6.017983323518049
CC(=O)N/C(=C\C1=c2ccccc2=[NH+]C1)C(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C63136707_decoy,TRY1,Decoy,0,-8.32206,-7.93,-2.26,-7.818476223358976
COc1ccc2c(c1)=C(CCNC(=O)C(=O)Nc1ccc([C@@H]3NN=C(C)O3)cc1)C[NH+]=2,C63807346_decoy,TRY1,Decoy,0,-8.38294,-8.01,-3.48,-6.613529171890473
COc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@@H]3NN[C@@H](C(C)C)S3)CC1=O)C[NH+]=2,C63941321_decoy,TRY1,Decoy,0,-9.32777,-7.7,-1.77,-7.344397683112152
CC(C)CNC(=O)C1=CN(C2CCN(C(=O)CCC3=c4ccccc4=[NH+]C3)CC2)NN1,C64625932_decoy,TRY1,Decoy,0,-8.05875,-8.2,-1.52,-6.600611287126651
Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(O)c1/C=[NH+]/CCc1ccc(S(N)(=O)=O)cc1,C13556670_decoy,TRY1,Decoy,0,-8.05289,-6.23,-2.51,-5.252715872820806
CCNc1nc(NCC)[n+]2c(n1)SC[C@]2(O)Nc1ccc(OCC)cc1[N+](=O)[O-],C67321314_decoy,TRY1,Decoy,0,-5.76691,-5.64,-2.24,-5.667499990354844
COc1ccc(Cl)cc1-c1ccc2c(c1)C(=O)N1CC[C@H](NC(=O)[C@@H]3CSC[NH2+]3)C[C@H]1C(=O)N2,C04222251_decoy,TRY1,Decoy,0,-7.65266,-6.55,-0.17,-5.205292008161707
COc1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3Cc3c[nH]c4ccccc34)C(=O)Nc3ccccc32)c1,C08876554_decoy,TRY1,Decoy,0,-7.50151,-8.93,-1.42,-8.817072133231767
CCC(=O)Nc1ccc2c(c1)CC1(C(=O)NC(=O)NC1=O)[C@@H]1C[NH+](Cc3ccc4c(c3)OCO4)CCN21,C09215878_decoy,TRY1,Decoy,0,-8.28306,-7.67,-1.76,-6.193255141148404
C[C@@H](c1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1-c1ccc(F)cc1)[NH+](C)C,C09512639_decoy,TRY1,Decoy,0,-11.0488,-7.7,-2.09,-8.024352676502097
C[C@@H]1CCc2c(sc3nc(C[NH+]4CCOCC4)nc(NCc4ccc(S(N)(=O)=O)s4)c23)C1,C09584819_decoy,TRY1,Decoy,0,-11.5135,-6.35,-0.81,-7.226189226993905
C[NH+]1CCc2c(sc(NC(=O)[C@@H]3CCCN(S(=O)(=O)c4ccc(Cl)s4)C3)c2C(N)=O)C1,C10751896_decoy,TRY1,Decoy,0,-11.2007,-7.54,-1.25,-7.34757095735405
COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3Cc3c[nH]c4ccccc34)C(=O)Nc3ccccc32)cc1,C11851753_decoy,TRY1,Decoy,0,-8.38585,-8.31,-0.86,-5.739382584203995
COc1ccc(N2C(=O)[C@H]3[C@H](Cc4c[nH]c5ccccc45)[NH2+][C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C11851755_decoy,TRY1,Decoy,0,-7.96237,-8.49,-0.97,-7.784053666995318
[H]/N=C1\[C@H](C(=O)NCC[NH+]2CCOCC2)/C(=N/C)S[C@H]1C(=O)Nc1ccc(C)cc1Br,C09403468_decoy,TRY1,Decoy,0,-8.9895,-7.16,-1.91,-6.995536902876113
COc1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3Cc3c[nH]c4ccccc34)C(=O)Nc3ccccc32)c1,C12889606_decoy,TRY1,Decoy,0,-8.46512,-9.22,-1.11,-6.599837515994195
O=C(NC[C@H]1COc2ccccc2O1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C14992365_decoy,TRY1,Decoy,0,-9.02367,-6.23,-1.94,-6.189899025607428
CCOc1ccccc1NC(=O)CSc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccc(Br)cc1,C02927057_decoy,TRY1,Decoy,0,-9.93424,-8.24,-0.84,-11.783062452461088
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C16011813_decoy,TRY1,Decoy,0,-8.12675,-7.51,-3.05,-5.672709243411828
CCOc1ccc(N2C(=O)Nc3ccc(Br)cc3[C@]2(O)C(=O)NCCC[NH+](C)C)cc1,C03670621_decoy,TRY1,Decoy,0,-8.66843,-6.28,-2.15,-6.070114175209216
C[NH+]1[C@@H](SCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccc(F)cc2)NN[C@@H]1c1cccc(Br)c1,C38610021_decoy,TRY1,Decoy,0,-8.67883,-8.06,-2.46,-6.493955879181922
CC(C)S(=O)(=O)C1=C[C@H]2C[NH+]3N[P@@](=O)(c4ccccc4O)OC[C@@H]3C[C@@H]2C=C1c1ccccc1O,C39467136_decoy,TRY1,Decoy,0,-7.55465,-6.53,-2.37,-4.637982833634665
CC(C)S(=O)(=O)C1=C[C@@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467606_decoy,TRY1,Decoy,0,-7.74277,-6.47,-2.05,-4.856879939451741
CC(C)S(=O)(=O)C1=C[C@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467608_decoy,TRY1,Decoy,0,-8.18913,-6.35,-2.69,-5.21518329286446
O=[P@@]1(S(=O)(=O)Oc2ccccc2)N[NH+]2C[C@@H]3C=C(O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39469625_decoy,TRY1,Decoy,0,-6.11931,-5.54,-1.94,-4.321762596590604
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39597838_decoy,TRY1,Decoy,0,-8.50492,-5.94,-2.31,-4.765769261207833
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39597842_decoy,TRY1,Decoy,0,-9.39838,-6.84,-0.89,-5.4921819801940295
CC1=NN(C(C)(C)C)[C@H](C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)C1,C39656084_decoy,TRY1,Decoy,0,-8.78668,-6.2,-3.32,-6.496611843172187
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39674062_decoy,TRY1,Decoy,0,-9.62988,-9.27,-2.16,-8.357666886014533
O=C(NCc1nc2ccccc2c(=O)[nH]1)[C@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39676301_decoy,TRY1,Decoy,0,-9.98626,-9.56,-1.58,-10.75487200303068
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)c1C,C39684162_decoy,TRY1,Decoy,0,-8.75278,-9.16,-3.98,-6.516813444476486
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)[C@@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)c[nH]c12,C39684195_decoy,TRY1,Decoy,0,-8.90022,-8.47,-1.81,-7.110996475409858
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)[C@@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)c[nH]c12,C39684196_decoy,TRY1,Decoy,0,-9.31727,-9.78,-1.56,-6.910897806274519
CCSc1ncccc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C39695796_decoy,TRY1,Decoy,0,-7.35026,-6.56,-1.63,-5.40581847670009
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](C(F)(F)F)O1,C39695829_decoy,TRY1,Decoy,0,-9.93382,-9.35,-1.86,-8.926115241025963
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44695549_decoy,TRY1,Decoy,0,-7.94464,-9.14,-2.55,-8.073507354746129
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44695551_decoy,TRY1,Decoy,0,-9.08904,-7.24,-1.59,-6.5895530031984
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1Cl,C44714199_decoy,TRY1,Decoy,0,-8.66018,-6.3,-2.15,-6.325504991614307
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1Cl,C44714203_decoy,TRY1,Decoy,0,-9.65977,-8.05,-1.75,-7.475488699852149
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C44714216_decoy,TRY1,Decoy,0,-9.504,-6.87,-2.23,-6.291833226761696
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C44714218_decoy,TRY1,Decoy,0,-9.00762,-8.72,-1.63,-7.312313569811182
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C44714220_decoy,TRY1,Decoy,0,-8.37305,-7.83,-0.79,-5.943626032838498
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2cnc3c(c(C)nn3C)c2Cl)CC12CC[NH2+]CC2,C44714284_decoy,TRY1,Decoy,0,-9.4467,-8.83,-1.84,-7.562494088796292
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714556_decoy,TRY1,Decoy,0,-8.84168,-7.25,-2.54,-8.085268035362224
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44728477_decoy,TRY1,Decoy,0,-9.56617,-8.77,-3.42,-8.089843671420674
COc1c(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)csc1Cl,C39695814_decoy,TRY1,Decoy,0,-8.85168,-6.75,-2.15,-5.7717827623226405
COc1c(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)csc1Cl,C44737434_decoy,TRY1,Decoy,0,-9.20317,-6.46,-2.44,-6.106656580657283
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)[C@@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)[nH]c2c1,C44737461_decoy,TRY1,Decoy,0,-10.0388,-10.08,-1.82,-8.477404155471222
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)N3NC=C(C(=O)Nc4cc5c(cc4[C@H](C)O)OCO5)C3=[NH+]2)cc1,C12847177_decoy,TRY1,Decoy,0,-8.01906,-6.82,-1.16,-5.755220464167085
CCOc1cc([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc(Br)c1OC,C12507757_decoy,TRY1,Decoy,0,-8.97985,-6.95,-1.4,-6.295730933405099
CCOc1c(Br)cc([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc1OC,C12551860_decoy,TRY1,Decoy,0,-9.59657,-6.0,-2.43,-7.022235758658749
Cc1cc(C)cc(N2C(=O)[C@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)c1,C63472951_decoy1,TRY1,Decoy,0,-6.67312,-8.18,,-5.798668098110671
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@@H](c4ccccc4O)[NH2+][C@@](CC4=c5ccccc5=[NH+]C4)(C(=O)[O-])[C@@H]3C2=O)c1,C63472952_decoy,TRY1,Decoy,0,-6.98615,-8.68,-1.98,-5.9026697918022935
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)cc1,C63473050_decoy1,TRY1,Decoy,0,-7.39611,-8.99,,-9.473128612006802
Cc1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)c1,C63478219_decoy,TRY1,Decoy,0,-5.87708,-8.06,-2.08,-5.351133670180344
O=C(NCCC1=c2ccccc2=[NH+]C1)C1=C2N[C@H](NC(=O)c3ccc4c(c3)OCO4)S[C@@H]2CCC1,C64375495_decoy,TRY1,Decoy,0,-9.84135,-7.76,-2.37,-7.152030068177777
O=C1C(Br)=C(N2CC[NH+](CCOCCO)CC2)C(=O)c2c(O)ccc(O)c21,C01637576_decoy,TRY1,Decoy,0,-8.5719,-6.7,-2.78,-5.710012968541438
CCC[NH+]1CCc2c(sc(NC(=O)CCCS(=O)(=O)c3ccccc3)c2C(N)=O)C1,C09911329_decoy,TRY1,Decoy,0,-9.3601,-7.41,-2.63,-9.150793407389695
C[C@@]1(CSc2ccccc2C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)NC(=O)NC1=O,C12751951_decoy,TRY1,Decoy,0,-8.14625,-5.71,-0.25,-6.613139553658357
O=C(NC[C@@H]1CCCO1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C15002754_decoy,TRY1,Decoy,0,-9.03164,-7.87,-3.43,-6.717010588422728
O=C(NC[C@H]1CCCO1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C15002758_decoy,TRY1,Decoy,0,-8.17916,-7.84,-1.1,-5.454468276813499
COc1cc([C@H]2c3cc4c(cc3[C@H](OCC[NH3+])[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O,C16957928_decoy,TRY1,Decoy,0,-8.02992,-5.44,-3.6,-5.064805782802955
COc1cc(C(=O)NCC(=O)N2CCC3(CC2)[NH2+]CCc2[nH]cnc23)cc(OC)c1OC,C09410799_decoy,TRY1,Decoy,0,-9.33969,-6.97,-3.66,-6.093593089734987
CCOc1cc(C(=O)N[C@@H](C)C(=O)N2CCC3(CC2)[NH2+]CCc2[nH]cnc23)cc(OCC)c1OCC,C09410026_decoy,TRY1,Decoy,0,-8.37509,-7.48,-4.26,-7.672243050014098
COCc1[nH]nc2c1[C@@H](c1ccc(OCC[NH+]3CCOCC3)c(OC)c1)C(C#N)=C(N)O2,C09272430_decoy,TRY1,Decoy,0,-7.91555,-6.59,-1.03,-6.195643056263275
NS(=O)(=O)c1ccc(CC[NH2+][C@H]2CC(=O)N(c3ccc(I)cc3)C2=O)cc1,C18250373_decoy,TRY1,Decoy,0,-9.88923,-7.6,-2.42,-6.250801676209201
CCCCn1c(N)c(N(C(=O)C[NH+]2CCC[C@H]2C(=O)N(C)C)C2CCCC2)c(=O)[nH]c1=O,C22014604_decoy,TRY1,Decoy,0,-6.6448,-6.4,-1.69,-6.143760807669875
CC[C@@]1(C)NC(=O)N(NC(=O)C[NH+]2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)C1=O,C25055022_decoy,TRY1,Decoy,0,-8.1189,-7.14,-3.69,-5.6417440487505095
COC(=O)/C=C/C(=O)N[C@@H]1CC[C@]2(O)[C@@H]3Cc4ccc(O)c5c4[C@]2(CC[NH+]3CC2CC2)[C@@H]1O5,C33740735_decoy,TRY1,Decoy,0,-6.9262,-6.79,-1.85,-5.1529896514399365
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C22130752_decoy,TRY1,Decoy,0,-9.42646,-7.87,-1.71,-6.682599277222432
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C[NH+](C)[C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C36398786_decoy,TRY1,Decoy,0,-7.5773,-6.18,-2.83,-5.833106277269574
CCC[NH+]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)c2C(N)=O)C1,C36629138_decoy,TRY1,Decoy,0,-9.05384,-6.66,-1.37,-5.577289264235184
COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CC[NH+]3CC2CC2)[C@H]1O5,C03995756_decoy,TRY1,Decoy,0,-8.61436,-6.45,-2.65,-6.215426075032056
O=C(NCCOCCO)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39601504_decoy,TRY1,Decoy,0,-8.73708,-6.4,-2.24,-5.620691660624175
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39601506_decoy,TRY1,Decoy,0,-7.76875,-6.54,-1.26,-5.495482069484715
O=C(NCCOCCO)[C@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39601553_decoy,TRY1,Decoy,0,-8.1909,-4.77,-2.45,-5.6077132434099735
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39601555_decoy,TRY1,Decoy,0,-7.33821,-6.58,-1.2,-5.259241059778411
O=C(NCCOCCO)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39601579_decoy,TRY1,Decoy,0,-6.26354,-4.96,-2.76,-4.961701151163305
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39601581_decoy,TRY1,Decoy,0,-6.53082,-6.37,-3.14,-5.043554173259253
O=C(NCCOCCO)[C@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39601739_decoy,TRY1,Decoy,0,-8.81978,-5.9,-0.96,-5.611691306580103
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39601741_decoy,TRY1,Decoy,0,-8.41395,-6.86,-2.55,-6.045206468531427
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)c1F,C39601756_decoy,TRY1,Decoy,0,-7.82597,-5.17,-1.91,-5.345045209811987
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)c1F,C39601758_decoy,TRY1,Decoy,0,-8.81326,-6.52,-1.19,-6.261058650010141
COc1c(C(=O)N2C[C@@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)csc1Cl,C39601869_decoy,TRY1,Decoy,0,-8.64522,-5.84,-1.58,-5.704438020787131
O=C(NCCOCCO)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39602037_decoy,TRY1,Decoy,0,-9.40052,-6.33,-2.75,-6.059891866009376
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)NCCCO)C3(CC[NH2+]CC3)C2)cc1Cl,C39605527_decoy,TRY1,Decoy,0,-8.90974,-5.83,-1.46,-5.937104011541993
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)NCCCO)C3(CC[NH2+]CC3)C2)cc1Cl,C39605529_decoy,TRY1,Decoy,0,-8.84844,-6.53,-4.09,-6.110754658162596
COc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39631537_decoy,TRY1,Decoy,0,-8.70359,-5.98,-2.4,-6.131770750154293
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631742_decoy,TRY1,Decoy,0,-10.591,-6.94,-3.23,-7.970626443779339
Cc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685698_decoy,TRY1,Decoy,0,-7.72954,-4.73,-2.41,-5.4859959599339945
CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)CC1,C39685811_decoy,TRY1,Decoy,0,-9.92119,-8.33,-1.02,-8.20391810137252
CSCCC(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685820_decoy,TRY1,Decoy,0,-9.3094,-5.73,-2.07,-6.280430849390011
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685894_decoy,TRY1,Decoy,0,-8.0328,-6.12,-4.8,-6.074909261816564
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)nn1C,C39685910_decoy,TRY1,Decoy,0,-9.65785,-7.86,-2.88,-7.65952581184657
Cc1nn(C)c(C)c1C[NH+]1CCN(CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC(C)C)CC1,C39972291_decoy,TRY1,Decoy,0,-9.39671,-6.69,-3.59,-7.136853739195464
C[NH+]1CCN(Nc2ncnc(NNC(=O)c3ccccc3Br)c2[N+](=O)[O-])CC1,C40623654_decoy,TRY1,Decoy,0,-6.99503,-7.05,-2.02,-6.405037742174084
Nc1c(N2CCN(CCO)CC2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40734572_decoy,TRY1,Decoy,0,-9.43528,-6.44,-3.12,-5.408387072567538
NC(=O)C1(c2ccc(-c3ccc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)cn2)[C@@H]2C[NH2+]C[C@@H]21,C40940621_decoy,TRY1,Decoy,0,-8.30715,-6.32,-3.15,-4.917100783228638
COc1cc(OC)cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44713648_decoy,TRY1,Decoy,0,-8.59833,-7.37,-0.93,-6.382539589030233
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1OC,C44713694_decoy,TRY1,Decoy,0,-8.04343,-6.47,-2.02,-6.3602363208554245
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(OC)c1,C44713726_decoy,TRY1,Decoy,0,-7.86721,-5.97,-1.87,-5.754966004783209
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C44713829_decoy,TRY1,Decoy,0,-8.59926,-6.46,-0.63,-6.258216037523057
COc1ccc(OC)c(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714136_decoy,TRY1,Decoy,0,-7.87713,-7.15,-1.74,-5.958598970642552
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)no1,C44728479_decoy,TRY1,Decoy,0,-9.00875,-9.45,-2.45,-7.328435558108019
CC[C@@H](C)NC(=O)CSc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(Br)cc1,C34145556_decoy,TRY1,Decoy,0,-10.1047,-7.82,-1.82,-10.00842696306372
CCOc1ccc(N2CCN3C(=O)[C@@H](C(=O)NCCC4=c5ccccc5=[NH+]C4)NN[C@H]32)cc1,C63694381_decoy,TRY1,Decoy,0,-6.31267,-6.65,-1.08,-5.424005307927755
COC(=O)/C=C/C(=O)N[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CC[NH+]3CC2CC2)[C@H]1O5,C02539826_decoy,TRY1,Decoy,0,-7.56186,-5.15,-4.65,-4.701458179260726
COc1cc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)[NH2+]CCc2nc[nH]c23)cc(OC)c1OC,C08738583_decoy,TRY1,Decoy,0,-8.3346,-5.81,-2.78,-5.041156384938259
Nc1nonc1-n1nnc(C(=O)N/N=C\c2ccc(Br)s2)c1C[NH+]1CCOCC1,C08826759_decoy,TRY1,Decoy,0,-8.83421,-5.43,-1.49,-5.817939956589403
O=C1CCc2cc(S(=O)(=O)Nc3cccc(S(=O)(=O)NC4=[NH+]CCC4)c3)ccc2N1,C09713490_decoy,TRY1,Decoy,0,-8.29406,-8.13,-2.82,-6.4547755659887445
COC(C/[NH+]=C/[C@]12CC[C@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O)OC,C12660333_decoy,TRY1,Decoy,0,-10.3089,-6.11,-2.46,-7.016722301560177
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C[NH+](C)CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C12820195_decoy,TRY1,Decoy,0,-7.61689,-7.42,-1.73,-5.902785419393725
CCOc1cc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)[NH2+]CCc2nc[nH]c23)cc(OCC)c1OCC,C08996596_decoy,TRY1,Decoy,0,-8.59307,-5.57,-2.02,-6.090651349201537
Cc1noc(C)c1S(=O)(=O)N1CCC[NH+]([C@H](C)C(=O)Nc2sccc2C(N)=O)CC1,C14075313_decoy,TRY1,Decoy,0,-7.7662,-5.74,-2.66,-5.652199516949286
CCN(CC)C(=O)[C@@H]1CCC[NH+](Cc2ccc(C(=O)NCC3(O)CCCCC3)c(=O)[nH]2)C1,C14960509_decoy,TRY1,Decoy,0,-8.66593,-7.03,-4.07,-6.34037544906781
CC[C@@]1(C)NC(=O)N(NC(=O)C[NH+](C)CC(=O)Nc2ccc(OC(F)(F)F)cc2)C1=O,C15483319_decoy,TRY1,Decoy,0,-6.20341,-5.75,-3.59,-4.365686960563246
Cc1c(C(N)=O)sc(NC(=O)C[NH+]2CCN(S(C)(=O)=O)CC2)c1C(=O)OC(C)C,C19644889_decoy,TRY1,Decoy,0,-9.22282,-6.24,-1.82,-6.328181371523269
CC1(C)Cc2c(c(N3CCOCC3)nc3sc4c(NCCCC[NH3+])ncnc4c23)CO1,C20358301_decoy,TRY1,Decoy,0,-9.42975,-5.25,-4.52,-4.95092695313925
COc1cc(C(=O)NCC(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc(OC)c1OC,C20573589_decoy,TRY1,Decoy,0,-9.68163,-6.08,-1.87,-5.688461181762532
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccc3c(c2)OCCO3)c(=O)[nH]c1=O,C21581676_decoy,TRY1,Decoy,0,-7.82782,-7.3,-4.61,-5.665512886179973
CCCCn1c(N)c(N(C(=O)C[NH+]2CCC[C@@H]2C(=O)N(C)C)C2CCCC2)c(=O)[nH]c1=O,C22014600_decoy,TRY1,Decoy,0,-7.88612,-5.27,-2.53,-5.850939706521789
NC(=O)c1c(NC(=O)CN2CC[NH+](CC(=O)N3CCCCCC3)CC2)sc2c1CCC2,C22803669_decoy,TRY1,Decoy,0,-8.81034,-7.27,-2.34,-5.903579606574212
Cc1nn(-c2ccccc2)c(C)c1[C@@H]1C(=O)NCC[NH+]1CC(=O)NC(=O)NCc1ccco1,C24215053_decoy,TRY1,Decoy,0,-6.03011,-7.01,-2.28,-5.318838168831358
Cc1ccc(S(=O)(=O)N2CC[NH+]([C@H](C)C(=O)Nc3sccc3C(N)=O)CC2)c(C)c1,C25677454_decoy,TRY1,Decoy,0,-7.41716,-7.62,-2.61,-5.521992886902973
Cc1ccc(S(=O)(=O)N2CC[NH+]([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)c(C)c1,C25677458_decoy,TRY1,Decoy,0,-8.74735,-6.78,-1.71,-6.715923565543261
COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2(O)[C@@H]3Cc4ccc(O)c5c4[C@]2(CC[NH+]3CC2CC2)[C@H]1O5,C25992361_decoy,TRY1,Decoy,0,-8.54349,-6.55,-3.54,-6.321464923211776
N#C/C(C(=O)CN1CC[NH+](CC(=O)Nc2ccc(F)cc2)CC1)=C1/NC(=O)c2ccccc2N1,C28724168_decoy,TRY1,Decoy,0,-7.99431,-9.05,-4.14,-6.882331742209021
COC(=O)/C=C/C(=O)N[C@H]1CC[C@]2(O)[C@@H]3Cc4ccc(O)c5c4[C@]2(CC[NH+]3CC2CC2)[C@@H]1O5,C33740737_decoy,TRY1,Decoy,0,-7.67476,-7.12,-2.49,-5.92878637090597
COc1cc([C@@H]2[NH2+][C@@H](C(=O)[O-])Cc3[nH]c[nH+]c32)cc(Br)c1OCc1ccccn1,C21146882_decoy,TRY1,Decoy,0,-8.88805,-7.13,-2.85,-5.703874839760418
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C22130754_decoy,TRY1,Decoy,0,-8.74656,-8.13,-1.35,-6.123014017554332
CSCC[C@@H](NC(=O)c1ccc(Br)o1)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C25106797_decoy,TRY1,Decoy,0,-10.1253,-7.66,-3.14,-7.233492186657118
COc1cc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)c([N+](=O)[O-])cc1OC,C36629505_decoy,TRY1,Decoy,0,-9.17513,-6.68,-2.21,-6.614323159731878
C[NH+]1CCN(Cc2c(C(=O)N/N=C/c3cccc(Br)c3)nnn2-c2nonc2N)CC1,C19371906_decoy,TRY1,Decoy,0,-9.95125,-7.09,-4.17,-6.960108561121097
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)CSc2nc(C(F)(F)F)cc(=O)[nH]2)CC1,C23386246_decoy,TRY1,Decoy,0,-8.27372,-6.98,-3.19,-5.588367342039472
CC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H](c2ccc3c(c2)OCO3)N2CC[NH+](C)CC2)c1,C38624809_decoy,TRY1,Decoy,0,-10.169,-7.78,-2.4,-7.543184969039346
COc1c(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)csc1Cl,C39601867_decoy,TRY1,Decoy,0,-8.08998,-4.94,-3.96,-5.570564884527971
CC(=O)Oc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631236_decoy,TRY1,Decoy,0,-7.62669,-6.5,-1.75,-5.784301819445314
CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)CC1,C39631689_decoy,TRY1,Decoy,0,-9.9543,-8.12,-2.48,-8.2329821520946
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685814_decoy,TRY1,Decoy,0,-9.46518,-4.2,-2.01,-5.759662863910649
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685815_decoy,TRY1,Decoy,0,-8.72317,-5.94,-1.5,-6.00508695968559
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2ccncc2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685833_decoy,TRY1,Decoy,0,-9.38828,-6.5,-3.91,-6.351034040329679
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685908_decoy,TRY1,Decoy,0,-9.30305,-5.57,-1.51,-6.309165738218124
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39693424_decoy,TRY1,Decoy,0,-9.57898,-6.97,-4.09,-7.0662865045862056
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39693505_decoy,TRY1,Decoy,0,-9.17838,-7.44,-1.48,-6.415742964545741
COc1c(C(=O)N2C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)csc1Cl,C39693516_decoy,TRY1,Decoy,0,-8.75815,-6.45,-1.68,-6.8482723008379205
COc1ccc(Br)cc1-c1nc(C[NH+]2CCC(C(=O)NCC(N)=O)CC2)c(C)o1,C40985384_decoy,TRY1,Decoy,0,-10.183,-6.23,-1.48,-6.149015124169361
COc1cc(OC)cc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44713647_decoy,TRY1,Decoy,0,-9.39477,-7.41,-2.86,-6.582321779276597
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1OC,C44713693_decoy,TRY1,Decoy,0,-7.69822,-7.17,-3.09,-5.750556762107749
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1OC,C44713696_decoy,TRY1,Decoy,0,-7.50839,-5.21,-2.78,-5.340406290481145
CCOc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713869_decoy,TRY1,Decoy,0,-8.18258,-6.4,-2.07,-6.196769890865875
COc1ccc(OC)c(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714134_decoy,TRY1,Decoy,0,-9.28215,-7.51,-1.19,-6.743620815741602
CC(C)OC(=O)N(C)[C@H]1C[NH2+][C@H](C(=O)N2CC=C(c3ccccc3)CC2)[C@@H](C(=O)NO)C1,C45287296_decoy,TRY1,Decoy,0,-7.91452,-6.75,-2.11,-6.06713066275024
[NH3+]C1CCN(Cc2ccn3ncnc(Nc4ccc5c(cnn5Cc5cccnc5)c4)c23)CC1,C28903151_decoy,TRY1,Decoy,0,-7.97508,-7.47,-2.92,-5.591147946805626
CCOC[C@@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(OC)ccc4=[NH+]C3)C2)S1,C63557266_decoy,TRY1,Decoy,0,-7.50872,-6.6,-2.33,-5.621734091047582
CCOC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(OC)ccc4=[NH+]C3)C2)S1,C63557269_decoy,TRY1,Decoy,0,-7.96857,-5.36,-2.18,-5.078237577996038
CC(C)[C@@H](NS(=O)(=O)c1ccccc1)[C@@H]1[NH+]=C(c2ccc3c(c2)[nH]c(=O)c(=O)n3C)NO1,C64890546_decoy,TRY1,Decoy,0,-8.9054,-8.08,-1.78,-6.061723828203921
[NH3+][C@H]1CCc2c(ccc(O)c2O)C1,C05784462_decoy,TRY1,Decoy,0,-7.95052,-5.21,-0.99,-3.129248024757856
C[NH2+]C[C@@H](O)c1ccc(O)c(O)c1F,C13807918_decoy,TRY1,Decoy,0,-6.74629,-4.96,-0.97,-4.149653082943365
[NH3+][C@@H]1Nc2ccccc2NC1=O,C01870439_decoy,TRY1,Decoy,0,-7.60949,-6.7,-0.43,-7.86967808477181
CC(C)=C/C(C)=N/NC(N)=[NH2+],C04900856_decoy,TRY1,Decoy,0,-7.73249,-5.12,0.16,-10.058867733659264
C/[NH+]=C(/NN)Nc1cc(C)c(C)cc1C,C12368030_decoy,TRY1,Decoy,0,-6.3755,-5.09,-1.43,-3.82323541735744
Nc1nc2c(s1)C[C@@H]([NH3+])CC2,C12650535_decoy,TRY1,Decoy,0,-7.61374,-6.03,-0.76,-5.078647398812959
Nc1nc(CCC[NH3+])cs1,C19089082_decoy,TRY1,Decoy,0,-7.10054,-5.07,-1.06,-8.861273123776028
Cc1nc(N)c(C#N)c(C)c1CC[NH3+],C20397254_decoy,TRY1,Decoy,0,-7.87036,-5.63,-2.31,-6.778869071442617
[NH3+][C@@H](c1ccccc1)c1ccc(O)c(O)c1O,C21957766_decoy,TRY1,Decoy,0,-7.39769,-6.03,-0.5,-5.025548655124262
CC(C)=C1CC[C@@H](C)C/C1=N/[NH+]=C(N)N,C17351996_decoy,TRY1,Decoy,0,-8.31119,-6.38,-0.73,-7.983158089616819
C/C([NH3+])=C(/C#N)c1csc(N)n1,C18140967_decoy,TRY1,Decoy,0,-7.79518,-5.67,-0.71,-6.287073296597825
Cc1[nH+]n(C(C)C)c(N)c1N,C34333809_decoy,TRY1,Decoy,0,-7.15376,-4.31,-1.13,-3.2483184451898826
C[NH2+]C[C@@H](O)c1ccc(N)cc1,C34925791_decoy,TRY1,Decoy,0,-6.10486,-5.65,-0.58,-6.4438189392302325
NNc1nnc(C[NH3+])c2ccccc12,C36139218_decoy,TRY1,Decoy,0,-6.8773,-5.68,-0.88,-4.381878623732321
Cc1[nH+]c(NC[C@@H](C)O)ccc1N,C36245045_decoy,TRY1,Decoy,0,-6.73073,-3.94,-0.68,-3.854242151317986
CC(C)NC(=O)N[C@@H]1C[C@H]1[NH3+],C36263145_decoy,TRY1,Decoy,0,-7.09996,-4.98,0.32,-10.920321905113251
CC(C)(C)NC(=O)N[C@@H]1C[C@H]1[NH3+],C36263278_decoy,TRY1,Decoy,0,-6.83642,-4.83,-0.27,-8.118862794376584
CC[C@H]([NH3+])Cc1ccc(O)cc1O,C36778833_decoy,TRY1,Decoy,0,-8.25764,-6.67,-0.83,-7.872632479669507
CC(C)(CO)NC(=O)C1([NH3+])CCCC1,C37479473_decoy,TRY1,Decoy,0,-8.38547,-3.67,-0.25,-4.814411867885898
Cc1n[nH]c(C)c1NC(=O)C1([NH3+])CCCC1,C37479511_decoy,TRY1,Decoy,0,-7.05503,-4.61,-0.76,-4.056800626050661
C[C@H]([NH2+][C@H]1CCCC[C@@H]1O)C(N)=O,C37691504_decoy,TRY1,Decoy,0,-6.72912,-5.25,-1.54,-3.871239967947323
C[C@]([NH3+])(CO)c1ccc(O)cc1,C38124560_decoy,TRY1,Decoy,0,-7.3153,-6.28,-0.64,-7.419751061601529
CC(C)On1[nH+]cc(N)c1N,C39133700_decoy,TRY1,Decoy,0,-6.40759,-4.1,-0.61,-3.38924302278492
[NH3+]C1(c2n[nH]c(=O)[nH]2)CCCC1,C42040134_decoy,TRY1,Decoy,0,-7.06249,-4.15,-0.53,-3.6011378026483896
C[C@@]([NH3+])(C(=O)Nc1cc[nH]n1)C1CC1,C42414829_decoy,TRY1,Decoy,0,-5.53724,-5.75,-1.67,-6.480257423079757
Nc1cc(=O)[nH]c(SC2CC[NH2+]CC2)n1,C43501312_decoy,TRY1,Decoy,0,-7.24798,-5.97,-1.65,-5.977825943946101
C[C@@H](/C(N)=N/O)[NH+]1CCC[C@H](CO)C1,C43516051_decoy,TRY1,Decoy,0,-7.44997,-5.04,0.27,-4.397210741159532
NC(=O)C[C@@H]([NH3+])[C@H]1COC2(CCCCC2)O1,C44253236_decoy,TRY1,Decoy,0,-8.51339,-4.45,-0.74,-5.130042698941148
C[C@@H]([NH3+])Cc1ccc(O)c(O)c1O,C33861551_decoy,TRY1,Decoy,0,-6.85709,-6.38,-0.43,-6.3304503513271175
C[C@@H]([NH3+])Cc1c[nH]nc1-c1ccc(O)cc1,C44463320_decoy,TRY1,Decoy,0,-7.69062,-5.93,-0.14,-13.594130349759588
Cc1cc(C)c(C[C@@H]([NH3+])CO)[nH]1,C44464301_decoy,TRY1,Decoy,0,-7.61819,-4.33,-0.89,-3.999814530589114
[NH3+][C@@H](CO)Cc1cccc2cc[nH]c12,C44465105_decoy,TRY1,Decoy,0,-7.83771,-5.73,-0.61,-7.656090867054297
N[C@H](C[NH3+])c1cccc2c1oc1ccccc12,C44472329_decoy,TRY1,Decoy,0,-8.60169,-5.14,-0.39,-4.094098320672442
N/[NH+]=c1/[nH]cc(F)c(N)c1F,C02386480_decoy,TRY1,Decoy,0,-6.86808,-6.4,0.82,-7.4164943143419215
[NH3+][C@H]1CCCc2cc(O)c(O)cc2C1=O,C39100401_decoy,TRY1,Decoy,0,-7.1989,-5.51,-0.2,-4.234127039036865
Nc1c[nH+]cc(-c2ccncc2)c1N,C47212703_decoy,TRY1,Decoy,0,-6.497,-6.69,-0.21,-9.019904733427303
Nc1c[nH+]ccc1N[C@H]1CCCNC1=O,C50397342_decoy,TRY1,Decoy,0,-6.85091,-4.56,-0.37,-4.109896267353965
Nc1nc(CCC2CC[NH2+]CC2)n[nH]1,C50929613_decoy,TRY1,Decoy,0,-7.14136,-6.73,-1.05,-6.561304135398631
C[C@@H]1C[C@H]1[NH2+]CC(=O)NC(N)=O,C52287600_decoy,TRY1,Decoy,0,-5.85266,-5.19,-2.81,-7.050100563308157
Nc1c(NCC[NH3+])ccc2scnc12,C52815327_decoy,TRY1,Decoy,0,-7.70545,-6.29,-0.69,-7.594296159785164
Cc1ccc(-c2[nH+]cn(N)c2N)c(C)c1,C52838205_decoy,TRY1,Decoy,0,-7.00001,-5.67,-0.71,-6.359432340111914
CC(C)Cc1[nH+]c(C2CCCC2)n(N)c1N,C52839472_decoy,TRY1,Decoy,0,-6.6966,-4.62,-1.85,-3.861961253229324
CC(C)c1[nH+]c(C2CCCC2)c(N)n1N,C52839891_decoy,TRY1,Decoy,0,-6.68268,-5.53,-2.5,-3.8512108910870273
Nc1ccc(-c2[nH]c(CO)c[nH+]2)cc1,C58824286_decoy,TRY1,Decoy,0,-6.5793,-6.95,0.21,-10.289394968813308
Nc1ccc2nc(C[NH3+])cn2c1,C62152603_decoy,TRY1,Decoy,0,-6.53447,-6.39,0.31,-5.9963553350419465
[NH3+][C@H](c1ccc2c(c1)CC(=O)N2)c1cc[nH]n1,C62775878_decoy,TRY1,Decoy,0,-7.01487,-6.15,-0.32,-4.300100315895427
CC1(C)CCCN1C(=O)[C@@H]([NH3+])CC(N)=O,C63071983_decoy,TRY1,Decoy,0,-6.57095,-4.78,-1.47,-4.503186980995152
Cc1cccc([C@@H]2NC(=S)[NH+]=C(N)N2)c1,C34926974_decoy,TRY1,Decoy,0,-9.96941,-4.85,-0.37,-4.743601920307726
NC1=[NH+]C(=S)N[C@H](C2CC2)N1,C34927005_decoy,TRY1,Decoy,0,-9.17823,-4.92,-1.26,-4.066725822033069
NC(=S)NNC1=[NH+]CCCCC1,C04748343_decoy,TRY1,Decoy,0,-6.30736,-5.44,-0.02,-9.858172299011883
NS(=O)(=O)c1ccc(OCCCOc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c([N+](=O)[O-])c1,C04016738_decoy,TRY1,Decoy,0,-6.22471,-7.27,-4.11,-5.755321320386639
O=C(CCS(=O)(=O)CC[NH+]1CCCCC1)NCNC(=O)CCS(=O)(=O)CC[NH+]1CCCCC1,C06142586_decoy,TRY1,Decoy,0,-8.93272,-6.98,-2.41,-9.72246121727536
COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)c(OC)c1OC,C02340090_decoy,TRY1,Decoy,0,-8.89334,-6.17,-2.73,-6.216215902989531
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2nncn2C)ccc1O,C09233448_decoy,TRY1,Decoy,0,-9.41009,-7.37,-1.47,-6.915723177236889
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSC2=NCCS2)ccc1O,C09329906_decoy,TRY1,Decoy,0,-10.6806,-6.84,-3.97,-7.599701118810727
CCOC(=O)C1=C(CSc2nnc([C@@H]3COc4ccccc4O3)n2N)NC(=O)N[C@H]1c1ccco1,C09669688_decoy,TRY1,Decoy,0,-8.35175,-7.0,-2.2,-6.096978426214124
CCOC(=O)C1=C(CSc2nnc([C@H]3COc4ccccc4O3)n2N)NC(=O)N[C@H]1c1ccco1,C09669690_decoy,TRY1,Decoy,0,-7.01489,-7.83,-2.79,-5.503515782266754
COc1cc(NC(=O)C(C)C)c(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1OC,C09922454_decoy,TRY1,Decoy,0,-10.1116,-7.15,-3.0,-8.350948843665426
CCOc1ccccc1Nc1nnc(SCC(=O)c2c(N)n(CCOC)c(=O)[nH]c2=O)s1,C09804674_decoy,TRY1,Decoy,0,-8.05271,-7.1,-3.86,-6.339896645843735
CC1CC[NH+](CCS(=O)(=O)CCC(=O)NCNC(=O)CCS(=O)(=O)CC[NH+]2CCC(C)CC2)CC1,C06142587_decoy,TRY1,Decoy,0,-8.62782,-5.69,-3.13,-6.051299691929885
CCCCN(C(=O)CN1C(=O)NC2(CCC(C)CC2)C1=O)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13039307_decoy,TRY1,Decoy,0,-7.65898,-6.76,-1.87,-5.237484330290712
NS(=O)(=O)c1ccc(CCNC(=O)CCCCCn2c(=S)[nH]c3cc4c(cc3c2=O)OCO4)cc1,C02974409_decoy,TRY1,Decoy,0,-9.14198,-7.76,-4.25,-6.492256397133507
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2cc(OC)c(OC)cc2OC)nnn1-c1nonc1N,C02321747_decoy,TRY1,Decoy,0,-8.58391,-6.91,-4.17,-6.428527450186148
CCCCN(C(=O)COC(=O)c1c(C)[nH]c(C(=O)OCC)c1C)c1c(N)n(CCC)c(=O)[nH]c1=O,C14903855_decoy,TRY1,Decoy,0,-8.86374,-6.64,-2.72,-7.230850373147225
CCOC(=O)C1=C(COC(=O)/C=C/C(=O)OCC2=C(C(=O)OCC)CNC(=O)N2)NC(=O)NC1,C18335002_decoy,TRY1,Decoy,0,-8.84428,-6.8,-2.16,-7.86933690053219
COc1ccc(/C(C)=N/NC(=O)c2c(C[NH+]3CCCCC3)nnn2-c2nonc2N)cc1[N+](=O)[O-],C19926996_decoy,TRY1,Decoy,0,-7.15977,-7.25,-1.66,-6.219130776001348
O=C(COC(=O)/C=C/C(=O)OCC(=O)NC(=O)NCc1ccco1)NC(=O)NCc1ccco1,C20868314_decoy,TRY1,Decoy,0,-8.52114,-5.79,-3.98,-7.382430768055161
CC(=O)Nc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2c(C)nn(C(C)C)c2C)n1,C20905183_decoy,TRY1,Decoy,0,-9.40773,-8.13,-3.02,-7.768719656092434
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NCc2ccccc2Cl)n1N,C20911394_decoy,TRY1,Decoy,0,-7.9641,-7.47,-1.23,-6.617257958640275
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1N,C20911890_decoy,TRY1,Decoy,0,-8.93449,-6.59,-2.91,-6.887930333049529
COCCSc1nnc(NC(=O)CSc2nnc(N/N=C/c3ccc(C)cc3)n2N)s1,C20917646_decoy,TRY1,Decoy,0,-10.7462,-7.19,-4.32,-7.156284515759367
CCCSc1nnc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)s1,C20920855_decoy,TRY1,Decoy,0,-9.98434,-7.48,-3.98,-9.534297527394878
CC[C@@H](C)Sc1nnc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)s1,C20921125_decoy,TRY1,Decoy,0,-10.1144,-7.77,-3.27,-8.706568350396438
CC(C)Sc1nnc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)s1,C20921771_decoy,TRY1,Decoy,0,-10.0468,-6.02,-2.31,-5.881885615326306
COC(=O)[C@@H]1O[C@@H](On2c(N)nc(N3CCCCC3)cc2=[NH2+])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22064213_decoy,TRY1,Decoy,0,-6.93014,-5.13,-4.35,-5.359933597542176
CCCCn1c(N)c(N(Cc2ccco2)C(=O)Cc2csc(NC(=O)C3CC3)n2)c(=O)[nH]c1=O,C23055798_decoy,TRY1,Decoy,0,-7.49414,-7.1,-4.6,-6.503298545597348
COC(=O)[C@@H](CCCCCCC[C@@H](C(=O)OC)C1=Nc2nnc(N)n2C1=O)C1=Nc2nnc(N)n2C1=O,C17197410_decoy,TRY1,Decoy,0,-8.45605,-8.34,-2.67,-12.414008268548825
COCCOC(=O)c1c(NC(=O)COC(=O)C23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)sc(C(N)=O)c1C,C18323579_decoy,TRY1,Decoy,0,-11.3065,-6.78,-2.09,-7.443043502842318
CCCCN1C(=O)N=C([O-])[C@@H](N(CCOC)C(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)[C@@H]1[NH3+],C38800641_decoy,TRY1,Decoy,0,-6.89223,-6.96,-2.27,-6.448476017843426
CCOC(=O)CNC(=O)CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1cc(C)ccc1C,C39361883_decoy,TRY1,Decoy,0,-8.79135,-7.48,-3.49,-9.085159915948788
CCOc1ccc(N2C(SCC(=O)Nc3nccs3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362580_decoy,TRY1,Decoy,0,-7.86661,-7.61,-0.65,-6.552802990309628
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)NCCCn4cc[nH+]c4)C4(CC[NH2+]CC4)C3)cccc12,C39630392_decoy,TRY1,Decoy,0,-8.54752,-9.3,-1.67,-7.409566136770718
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)no1,C39634838_decoy,TRY1,Decoy,0,-9.21565,-5.74,-2.05,-5.71252225970448
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)no1,C39679043_decoy,TRY1,Decoy,0,-8.27793,-5.39,-3.41,-6.239966160313606
O=C(COc1ccc(Cl)cc1Cl)NNc1ncnc(NNC(=O)c2ccncc2)c1[N+](=O)[O-],C40658934_decoy,TRY1,Decoy,0,-8.22368,-6.39,-3.39,-5.78256108036995
O=C(COc1ccc(Cl)cc1Cl)NNc1ncnc(NNC(=O)c2ccco2)c1[N+](=O)[O-],C40659153_decoy,TRY1,Decoy,0,-8.19485,-8.22,-1.26,-6.337965501262137
COc1ccc(OC[C@@H](O)Cn2c(N/N=C\c3ccccc3O)nc3c2c(=O)[nH]c(=O)n3C)cc1,C48523170_decoy,TRY1,Decoy,0,-8.27869,-8.03,-2.79,-6.813833041694436
CC(C)OC[C@@H](O)Cn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(=O)[nH]c(=O)n2C,C08996127_decoy,TRY1,Decoy,0,-9.67027,-6.87,-3.39,-8.192847105052996
CCC/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1nncn1C)c1ccc(O)cc1,C09286668_decoy,TRY1,Decoy,0,-9.06252,-7.5,-2.41,-7.859389369164391
COc1ccc(OC[C@H](O)Cn2c(N/N=C/c3ccccc3O)nc3c2c(=O)[nH]c(=O)n3C)cc1,C08935130_decoy,TRY1,Decoy,0,-9.34324,-8.32,-3.05,-7.388951475793592
C[C@H](OC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC(=O)NC1CCCC1)C(=O)NC(=O)NC1CCCC1,C58149230_decoy,TRY1,Decoy,0,-8.63012,-7.4,-3.35,-9.350571385335702
C[C@@H](OC(=O)/C=C/C(=O)O[C@H](C)C(=O)NC(=O)NC1CCCC1)C(=O)NC(=O)NC1CCCC1,C58149238_decoy,TRY1,Decoy,0,-9.23625,-8.07,-2.03,-9.099686097935752
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(F)cc3F)n[nH]2)c([N+](=O)[O-])cc1O,C59039946_decoy,TRY1,Decoy,0,-8.78549,-8.56,-3.71,-9.710994445375302
COc1cc(/C=N/Nc2nc(SCC(=O)NCc3nnc(C(C)C)o3)n[nH]2)c([N+](=O)[O-])cc1O,C59881555_decoy,TRY1,Decoy,0,-8.79742,-7.72,-3.19,-9.418059023354925
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2c(Cl)cccc2Cl)n[nH]1,C59887582_decoy,TRY1,Decoy,0,-10.474,-8.41,-2.19,-7.941173205459585
COc1ccc2nc(NC(=O)CSc3n[nH]c(N/N=C/c4c(C)nn(CCO)c4C)n3)sc2c1,C59888317_decoy,TRY1,Decoy,0,-10.2744,-9.18,-3.12,-10.00001052093976
COCCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3cc(Cl)ccc3Cl)n2N)cn1,C59913994_decoy,TRY1,Decoy,0,-9.88308,-7.59,-2.4,-8.011591471621442
CCCCNS(=O)(=O)c1ccc2[nH]c(SCC(=O)c3c(N)n(C)c(=O)n(C)c3=O)nc2c1,C06147685_decoy,TRY1,Decoy,0,-8.15577,-6.75,-3.65,-5.727937454749258
COCCC(=O)N[C@@H]1c2cc(NCc3ccncc3)c[nH+]c2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1C(=O)OC,C63994049_decoy,TRY1,Decoy,0,-8.60086,-7.4,-2.26,-6.616126547051245
COCCC(=O)N[C@H]1c2cc(NCc3ccncc3)c[nH+]c2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1C(=O)OC,C63994052_decoy,TRY1,Decoy,0,-8.09934,-7.55,-1.97,-6.752150657420945
C[C@]12CC[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3ccncc3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08744508_decoy,TRY1,Decoy,0,-8.3088,-6.74,-1.11,-5.547971742810628
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3ccncc3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08744510_decoy,TRY1,Decoy,0,-9.06107,-7.8,-2.28,-7.029031102893188
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790241_decoy,TRY1,Decoy,0,-7.59575,-6.47,-3.59,-4.530930051621408
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790243_decoy,TRY1,Decoy,0,-8.59998,-6.07,-2.18,-4.814534242539558
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08791026_decoy,TRY1,Decoy,0,-7.41425,-6.95,-2.21,-5.298531341068942
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@H]([C@@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08791028_decoy,TRY1,Decoy,0,-8.62121,-6.07,-1.09,-4.9721778585019925
O=C1[C@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@H]2C(=O)N1C[C@H]1CCCO1,C08876483_decoy,TRY1,Decoy,0,-7.81413,-9.43,-1.67,-6.491436026204267
C[C@H](O)[C@@H]1[NH2+][C@]2(C(=O)Nc3ccc(Br)cc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C08995115_decoy,TRY1,Decoy,0,-9.51613,-6.47,-2.73,-6.246611209904993
C[C@@H](O)[C@@H]1[NH2+][C@]2(C(=O)Nc3ccc(Br)cc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C08995117_decoy,TRY1,Decoy,0,-9.09406,-6.0,-2.05,-7.853756829067824
CC(C)(C)N1C(=O)[C@@H]2[C@@H]([C@H](O)c3ccc(Cl)cc3)[NH2+][C@@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C1=O,C08996030_decoy,TRY1,Decoy,0,-8.57782,-7.8,-0.61,-6.858295031587272
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C09334202_decoy,TRY1,Decoy,0,-8.09601,-5.86,-1.35,-5.098476393875946
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C09334206_decoy,TRY1,Decoy,0,-8.71543,-5.96,-2.38,-4.929217085008015
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@@H]([C@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12882394_decoy,TRY1,Decoy,0,-7.62181,-6.55,-1.85,-5.557597456414547
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@H]([C@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12882396_decoy,TRY1,Decoy,0,-8.13923,-5.81,-3.42,-5.2370494040664095
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3cccnc3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08918632_decoy,TRY1,Decoy,0,-10.4907,-8.34,-0.57,-6.251221283620179
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3ccncc3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08740516_decoy,TRY1,Decoy,0,-10.3107,-5.89,-1.72,-5.593009623874056
C[C@@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C17180706_decoy,TRY1,Decoy,0,-8.27629,-6.97,-1.37,-5.557327680368589
CN1CCN(C(=O)CC[C@@H]2CNC(=O)[C@@H]3C[C@H](NC(=O)Nc4cccc(Cl)c4)C[NH+]23)CC1,C15708608_decoy,TRY1,Decoy,0,-9.61895,-7.95,-1.22,-6.6607530427778405
C[C@@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493933_decoy,TRY1,Decoy,0,-8.62899,-6.48,-1.16,-5.666788173420892
C[C@@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493941_decoy,TRY1,Decoy,0,-9.8618,-8.72,-1.84,-7.352702905881238
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493944_decoy,TRY1,Decoy,0,-9.26978,-7.0,-1.67,-5.607040439070752
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39597804_decoy,TRY1,Decoy,0,-9.44903,-6.75,-2.65,-6.295635801942821
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C39673929_decoy,TRY1,Decoy,0,-9.03455,-7.48,-0.49,-6.260517278101967
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39673951_decoy,TRY1,Decoy,0,-9.85554,-6.44,-2.27,-6.409772721823285
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39673966_decoy,TRY1,Decoy,0,-7.57359,-7.96,-1.7,-6.620062386240037
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c1F,C39674018_decoy,TRY1,Decoy,0,-9.71691,-9.27,-1.61,-8.269432747269471
CSCCC(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676459_decoy,TRY1,Decoy,0,-11.8103,-7.46,-1.89,-8.34362795040119
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685835_decoy,TRY1,Decoy,0,-8.71006,-6.21,-2.29,-6.21062046916379
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c(C)c1,C39695836_decoy,TRY1,Decoy,0,-8.62562,-6.45,-1.37,-5.84641727207491
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867041_decoy,TRY1,Decoy,0,-9.7603,-7.14,-2.86,-6.110618498071784
C[C@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867043_decoy,TRY1,Decoy,0,-9.42319,-7.3,-0.97,-6.112678710750278
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867045_decoy,TRY1,Decoy,0,-8.66976,-6.05,-2.46,-4.903504116312479
C[C@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=[NH+]/C3CCCCC3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867046_decoy,TRY1,Decoy,0,-8.92499,-6.4,-0.95,-5.836545138901391
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C44713653_decoy,TRY1,Decoy,0,-8.42983,-6.12,-2.1,-5.799521859170958
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C44713723_decoy,TRY1,Decoy,0,-9.50274,-7.67,-1.82,-6.416108315525736
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C44713739_decoy,TRY1,Decoy,0,-8.77821,-8.19,-2.52,-6.617944687826992
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C44713748_decoy,TRY1,Decoy,0,-7.62911,-6.41,-2.99,-6.464729842151794
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C44713879_decoy,TRY1,Decoy,0,-8.41905,-7.23,-2.03,-5.844725727028521
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C44714114_decoy,TRY1,Decoy,0,-8.38847,-8.92,-1.91,-6.4932702695925135
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C44714120_decoy,TRY1,Decoy,0,-8.27768,-6.28,-1.58,-6.386628137044626
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C44714359_decoy,TRY1,Decoy,0,-9.53298,-6.1,-3.79,-6.5464056301161655
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C44714629_decoy,TRY1,Decoy,0,-9.54396,-7.75,-3.66,-8.117928112729194
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695855_decoy,TRY1,Decoy,0,-8.21286,-9.14,-2.95,-8.262859333322224
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695688_decoy,TRY1,Decoy,0,-9.77008,-8.62,-2.74,-7.615304339794711
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C)c(F)c4)CC34CC[NH2+]CC4)[nH]c2c1,C39695769_decoy,TRY1,Decoy,0,-8.74692,-7.53,-2.82,-6.502418420548013
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695854_decoy,TRY1,Decoy,0,-8.11676,-8.92,-2.05,-7.741898451576009
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)[nH]c2c1,C44737563_decoy,TRY1,Decoy,0,-7.8566,-7.1,-2.4,-5.537125179063168
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)[nH]c2c1,C44737566_decoy,TRY1,Decoy,0,-7.96023,-5.96,-1.76,-5.516400556717654
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4sccc4C)CC34CC[NH2+]CC4)[nH]c2c1,C44737576_decoy,TRY1,Decoy,0,-9.68923,-6.19,-2.22,-5.998385987445588
NC(=O)C1=C2CCCC[C@@H]2S[C@H]1NC(=O)CSc1nnc(C2=c3ccccc3=[NH+]C2)n1C1CC1,C63896768_decoy,TRY1,Decoy,0,-9.67677,-8.67,-3.24,-8.256882408791027
COc1ccc(Cl)cc1-c1ccc2c(c1)C(=O)N1CCN(C(=O)C[NH3+])C[C@H]1C(=O)N2,C04236054_decoy,TRY1,Decoy,0,-9.38222,-6.4,-0.29,-5.569681415848313
CC[NH+]1C[C@]2(C)CC[C@H](OC)[C@]34[C@@H]2[C@H](O)[C@@]2(OCO[C@@]25C[C@H](OC)[C@H]2C[C@]3(O)[C@@H]5[C@H]2O)[C@@H]14,C08214990_decoy,TRY1,Decoy,0,-6.56398,-5.87,-1.42,-5.757912283013407
C[C@@H](O)[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C09059146_decoy,TRY1,Decoy,0,-8.17756,-6.39,-1.69,-5.238916273308521
Cc1cc2c(c(=O)n1CC[NH+](C)C)[C@@]1(C(=O)Nc3ccccc31)C(C#N)=C(N)O2,C09355672_decoy,TRY1,Decoy,0,-6.62299,-4.93,-0.96,-4.899738219486799
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)n(C2CC2)c(S)nc1=O,C09358587_decoy,TRY1,Decoy,0,-6.90938,-5.6,-1.91,-4.550524673256056
COc1cccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(O)ccc2O3)c1,C12330106_decoy,TRY1,Decoy,0,-9.33801,-6.42,-2.92,-5.346505795264597
COc1cccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(O)ccc2O3)c1,C12330110_decoy,TRY1,Decoy,0,-10.0715,-6.02,-2.02,-6.7544462083862
CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@H]([NH2+]Cc2ccc(CO)o2)C1,C12575520_decoy,TRY1,Decoy,0,-8.71688,-8.13,-1.17,-7.861553442732403
CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@@H]([NH2+]Cc2ccc(CO)o2)C1,C12575525_decoy,TRY1,Decoy,0,-8.75391,-8.18,-3.28,-6.760368166939831
COc1ccc2c3c([nH]c2c1)[C@@H]1C[C@H]2[C@H](C[C@H](O)[C@@H](OC)[C@H]2CO)C[NH+]1CC3,C13145027_decoy,TRY1,Decoy,0,-7.39839,-4.8,-2.96,-4.542875016187116
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3cccc(F)c3)C[NH+]12,C15708409_decoy,TRY1,Decoy,0,-7.39907,-4.52,-2.46,-4.839369156199488
O=C(NCC1([NH+]2CCSCC2)CCCC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1,C29369810_decoy,TRY1,Decoy,0,-8.16671,-5.26,-1.56,-4.9301875349941895
[NH3+]C1CC(NS(=O)(=O)c2cc(Br)ccc2Br)C1,C36265773_decoy,TRY1,Decoy,0,-8.60822,-6.04,-5.13,-1.3528527634400314
C[NH+](C)CCCNC(=O)[C@H]1C[C@H]2CC[C@]1(C)C[C@]21NC(=O)c2cccnc2N1,C36735119_decoy,TRY1,Decoy,0,-8.3795,-4.95,-2.96,-5.57013942457171
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@H](O)C[C@]2(C)[C@@]1(O)C(=O)C[NH3+],C39953900_decoy,TRY1,Decoy,0,-6.64197,-7.65,-2.77,-4.369926647812541
C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@H](O)C[C@]2(C)[C@@]1(O)C(=O)C[NH3+],C39953901_decoy,TRY1,Decoy,0,-7.79093,-6.05,-2.25,-5.301872091021553
CC[C@@H](C)Nc1ncnc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1N,C40799426_decoy,TRY1,Decoy,0,-8.37584,-7.86,-2.86,-7.13556278144666
[NH3+]CCCCNS(=O)(=O)c1ccc(Br)cc1Br,C40826925_decoy,TRY1,Decoy,0,-9.94,-5.96,-1.56,-7.9592524809932765
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NC1CC[NH+](C2CC2)CC1,C41241423_decoy,TRY1,Decoy,0,-7.78267,-7.17,-0.22,-5.947709026601444
C[C@@H]1CCCC[NH+]1[C@@H](C)CNC(=O)C(=O)Nc1ccc(N2CCNC2=O)cc1,C41645782_decoy,TRY1,Decoy,0,-8.52582,-6.2,-1.95,-5.733200857958625
C[C@H]1CCCC[NH+]1[C@@H](C)CNC(=O)C(=O)Nc1ccc(N2CCNC2=O)cc1,C41645785_decoy,TRY1,Decoy,0,-8.76496,-6.68,-1.61,-5.764073053774015
CC[C@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713758_decoy,TRY1,Decoy,0,-7.71252,-5.99,-2.12,-5.451641424716514
Cc1ccnc(NC(=O)C2CC[NH+]([C@@H](C)C(=O)NC(=O)NC(C)(C)C)CC2)c1,C47261810_decoy,TRY1,Decoy,0,-7.68242,-6.74,-1.92,-7.691649530953242
CC(=O)N(C)Cc1ccccc1NC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C48605009_decoy,TRY1,Decoy,0,-8.32873,-6.12,-0.93,-5.564698372658987
CC[C@@H](C)N1C(=O)[C@@H]2[C@@H]([C@@H](C)O)[NH2+][C@@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C05350651_decoy,TRY1,Decoy,0,-6.95967,-7.06,-1.24,-7.1499623029015895
CC[NH+]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(F)cc2Br)C1,C52592374_decoy,TRY1,Decoy,0,-7.64904,-6.14,-1.56,-5.283446368147453
COc1ccc2[nH]cc(C3=CC[NH+]([C@H](C)C(=O)NC(=O)NC(C)C)CC3)c2c1,C53073556_decoy,TRY1,Decoy,0,-7.3808,-7.45,-2.15,-5.729658145884174
COc1ccc2[nH]cc(C3=CC[NH+]([C@@H](C)C(=O)NC(=O)NC(C)C)CC3)c2c1,C53073558_decoy,TRY1,Decoy,0,-6.93037,-6.54,-1.47,-4.945363930764753
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C\NCCN3CC[NH2+]CC3)C2=O)cc1,C19361848_decoy,TRY1,Decoy,0,-8.57249,-5.97,-1.35,-5.569048974038663
O=C(NCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1ccc(Br)o1,C20622771_decoy,TRY1,Decoy,0,-9.34793,-6.98,-2.73,-5.919358008809599
CNC(=O)NC(=O)[C@@H](C)S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39760393_decoy,TRY1,Decoy,0,-6.78821,-5.97,-1.45,-5.587157185719016
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)Nc1cc(C(F)(F)F)c[nH]c1=O,C63162447_decoy,TRY1,Decoy,0,-7.7555,-6.37,-2.56,-5.804392232212969
C[C@H]([NH3+])CCNS(=O)(=O)c1cc(Br)ccc1Br,C63170872_decoy,TRY1,Decoy,0,-8.25317,-5.91,-1.78,-7.566557997814887
C[C@@H]([NH3+])CCNS(=O)(=O)c1ccc(Br)cc1Br,C63170899_decoy,TRY1,Decoy,0,-8.93841,-6.06,-2.2,-7.578138094312796
C[C@]12C(=O)N(c3ccccc3C(=O)NN)C(=O)N1CCC1=c3ccccc3=[NH+][C@@H]12,C63351393_decoy,TRY1,Decoy,0,-6.64386,-8.95,-3.98,-7.283530015039488
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)NC(=S)N(C4CC4)[C@H]3O)[C@@H]1[NH+]=2,C63375617_decoy,TRY1,Decoy,0,-6.68161,-5.86,-2.21,-4.448295350210314
O=C1Nc2ccccc2NC12CCN(C[C@]1(O)CCC[NH+]3CCCC[C@@H]31)CC2,C63832494_decoy,TRY1,Decoy,0,-8.21892,-7.44,-3.91,-5.563464774583903
Cc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@@H]3NN[C@H](C)S3)CC1=O)C[NH+]=2,C63948113_decoy,TRY1,Decoy,0,-6.7141,-6.18,-2.08,-4.689418889162449
Cc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)N[C@@H]3NN[C@H](C)S3)CC1=O)C[NH+]=2,C63948116_decoy,TRY1,Decoy,0,-8.97313,-6.51,-1.39,-5.512793045643608
Cc1cccc(N2C(=O)[C@@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)C(O)=N[C@@H]2O)c1C,C63985297_decoy,TRY1,Decoy,0,-7.3962,-7.24,-1.1,-5.886540987676583
Cc1ccccc1N1C(=O)[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@@H]1O,C64019303_decoy,TRY1,Decoy,0,-7.36207,-6.35,-1.19,-4.794790745617125
Cc1nc2nc(N)nn2c(C)c1CC(=O)NCC(C)(C)[NH+]1C[C@H](C)C[C@H](C)C1,C54260322_decoy,TRY1,Decoy,0,-8.17846,-7.19,-2.46,-5.698131389022454
Cc1cc(C(=O)N[C@@H]2CCC[NH+](CC(N)=O)C2)c2nc3n(c2n1)CCCCC3,C66449090_decoy,TRY1,Decoy,0,-7.78746,-6.71,-1.5,-4.965652477247684
O=C(NCC[NH+]1CCc2sccc2C1)NCc1n[nH]c(-c2cccs2)n1,C66701175_decoy,TRY1,Decoy,0,-9.75712,-6.74,-2.89,-6.454115179771529
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1ccc(Br)c(F)c1,C67235988_decoy,TRY1,Decoy,0,-6.51428,-5.46,-1.55,-5.041931665788052
O=C1NC(=O)C2(CCC(C(=O)NC3CC[NH+](CC4CCCCC4)CC3)CC2)N1,C67271395_decoy,TRY1,Decoy,0,-7.49911,-7.06,-0.28,-5.022382217330946
O=C(NCCC(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12)c1ccccc1F,C20573644_decoy,TRY1,Decoy,0,-8.38989,-8.56,-1.64,-7.615104583821119
C[C@H]1CCC[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)C1,C67397858_decoy,TRY1,Decoy,0,-10.3339,-6.88,-1.77,-6.553660804802883
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2cc3c(cc2Cl)OCCO3)CC1,C67538519_decoy,TRY1,Decoy,0,-9.20913,-6.43,-1.82,-5.651646014502375
CNC(=O)[C@@H]1C[C@@H](n2cc(C(C)(C)NC(=O)c3ccccc3Cl)nn2)C[NH2+]1,C67654828_decoy,TRY1,Decoy,0,-8.0078,-8.34,-1.27,-7.752928249206664
[NH3+][C@H](CSC(c1ccccc1)(c1ccc(CO)cc1)c1ccc(CO)cc1)C(=O)[O-],C05052724_decoy,TRY1,Decoy,0,-6.31175,-6.58,-1.43,-5.591309897589981
CC(=O)c1c(C)cc2cccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c2c1O,C05085272_decoy,TRY1,Decoy,0,-6.00281,-7.65,-1.38,-6.196266319039502
O=C(Cc1ccccc1)c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1O,C05124371_decoy,TRY1,Decoy,0,-7.48015,-6.62,-3.1,-6.08609982132975
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@H](C)O)C[C@H]3O,C05437592_decoy,TRY1,Decoy,0,-9.02603,-8.23,-2.26,-5.523041901280135
O=c1[nH]c2ccccc2nc1/C(=N\Nc1ccccc1F)[C@H](O)[C@@H](O)CO,C05286485_decoy,TRY1,Decoy,0,-7.88752,-7.57,-3.12,-6.684893437628966
NNC(=O)c1nn(-c2ccc(Br)cc2)c(=O)c2c(N)scc12,C05896392_decoy,TRY1,Decoy,0,-8.15579,-6.24,0.0,-4.636935038187449
C[C@H](OC(=O)c1ccc(Cl)cc1N)C(=O)Nc1sccc1C(N)=O,C07302544_decoy,TRY1,Decoy,0,-9.25282,-6.64,-0.61,-8.062495113387751
C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl,C08723911_decoy,TRY1,Decoy,0,-8.07929,-6.18,-0.91,-7.059118595621243
C[C@H](OC(=O)c1cccc(Cl)c1N)C(=O)Nc1sccc1C(N)=O,C08878509_decoy,TRY1,Decoy,0,-8.15678,-6.8,-1.4,-10.91533444539679
C[C@@]1(Oc2c[nH]c3ccccc23)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970334_decoy,TRY1,Decoy,0,-6.83328,-5.91,-1.38,-4.872230339074463
CC1(C)CC(=O)C2=C(C1)Nc1nc(N)nc(N)c1[C@H]2c1ccc(Cl)cc1,C10339086_decoy,TRY1,Decoy,0,-6.9781,-5.94,-0.51,-3.926792831842213
O=C(Cc1ccccc1)c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C11666956_decoy,TRY1,Decoy,0,-6.89209,-6.38,-2.23,-5.587281429562605
O=C(Cc1ccccc1)c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1O,C11666961_decoy,TRY1,Decoy,0,-6.76591,-7.41,-1.97,-5.874837852523189
C[C@@]1(Oc2c[nH]c3cc(Cl)ccc23)O[C@@H](CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C12358932_decoy,TRY1,Decoy,0,-7.8459,-5.78,-1.61,-5.071378106873274
CCOC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@@H]1c1cccs1,C12412685_decoy,TRY1,Decoy,0,-7.52516,-6.42,-1.23,-7.30956080067356
N#CC1=C(N)Oc2[nH]nc(-c3ccc4ccccc4c3)c2[C@@H]1c1ccc(O)c(O)c1,C06720228_decoy,TRY1,Decoy,0,-6.41123,-6.68,-1.28,-4.693438654913906
Nc1nc(N)c(-c2ccc(Cl)cc2)c(CCCNC(=O)CBr)n1,C13283448_decoy,TRY1,Decoy,0,-8.68725,-6.76,-5.22,-8.378990043832344
Nc1nc(N)c([N+](=O)[O-])c(Nc2ccc(I)cc2)n1,C04826167_decoy,TRY1,Decoy,0,-5.94636,-5.59,-1.51,-3.888662693847116
COc1cc(/C=N/NC(N)=S)c(Br)cc1OCC(N)=O,C13747668_decoy,TRY1,Decoy,0,-8.44085,-4.81,-1.38,-5.2127923244196746
[NH3+][C@@H](CSC(c1ccccc1)(c1ccc(CO)cc1)c1ccc(CO)cc1)C(=O)[O-],C16954832_decoy,TRY1,Decoy,0,-8.54412,-5.92,-1.03,-6.224601140241798
COc1ccc(Cl)cc1NC(=O)c1sc2nc(N)c(C#N)cc2c1N,C20000511_decoy,TRY1,Decoy,0,-7.63469,-6.3,-0.93,-5.950533927702352
OC[C@H]1O[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@@H](O)[C@H]1O,C00642935_decoy,TRY1,Decoy,0,-7.38534,-5.78,-1.51,-4.631170777090777
N#Cc1cc2c(N)c(C(=O)NCCc3ccccc3Cl)sc2nc1N,C26052185_decoy,TRY1,Decoy,0,-9.21385,-7.69,-0.86,-6.40734261524374
Cc1cc(N[C@H](O)C(Cl)(Cl)Cl)nc(NNC(=S)[S-])[nH+]1,C26949916_decoy,TRY1,Decoy,0,-8.5189,-4.83,-1.1,-8.619802212695927
CC(C)[C@H](NC(N)=O)C(=O)NNC(=O)c1cc2c(s1)CCCCCC2,C28083080_decoy,TRY1,Decoy,0,-8.59911,-5.75,-1.54,-6.143521452737315
CC1=C[C@@H]([C@H]2NN[C@@H](SCC(=O)Nc3cc(C)cc(C)c3)N2N)N=N1,C38994640_decoy,TRY1,Decoy,0,-9.08263,-5.78,-1.74,-5.84808446162477
CC1=C[C@@H]([C@H]2NN[C@H](SCC(=O)Nc3cccc(C)c3C)N2N)N=N1,C38999470_decoy,TRY1,Decoy,0,-8.41637,-8.25,-3.06,-7.308040997159746
CC1=C[C@@H]([C@@H]2NN[C@@H](SCC(=O)Nc3c(C)cccc3C)N2N)N=N1,C39007487_decoy,TRY1,Decoy,0,-7.35674,-7.86,-1.76,-8.974660670168863
N#Cc1cc2c(N)c(C(=O)Nc3cc(Cl)ccc3Cl)sc2nc1N,C39335088_decoy,TRY1,Decoy,0,-8.06097,-6.71,-0.03,-5.371868769052797
CSc1nnc(N)n1[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCCC2,C40172183_decoy,TRY1,Decoy,0,-7.6949,-6.62,-1.76,-5.654793870008615
Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2N)nc1,C40784464_decoy,TRY1,Decoy,0,-9.26059,-5.83,-2.04,-7.09547703533098
Nc1c(NNC(=O)c2ccco2)ncnc1Nc1ccc(F)c(Cl)c1,C40794467_decoy,TRY1,Decoy,0,-7.79018,-5.46,-1.51,-5.223463426559415
C[C@@H](Oc1c(N)cc(C#N)cc1I)C(=O)NC(N)=O,C43415319_decoy,TRY1,Decoy,0,-7.47973,-6.12,-0.7,-4.935928947246055
C[C@@]1(Oc2c[nH]c3cc(Cl)ccc23)O[C@H](CO)[C@](C)(O)[C@](C)(O)[C@@]1(C)O,C43509396_decoy,TRY1,Decoy,0,-7.41944,-5.51,-1.23,-4.8674157993172384
NC(=O)c1cc(N)cnc1Nc1ccc(Br)cc1Br,C49152291_decoy,TRY1,Decoy,0,-8.26788,-4.85,-1.94,-4.380625157189636
CC(C)(C)c1[nH]nc2c1[C@@H](c1ccc(OCC(N)=O)cc1)C(C#N)=C(N)O2,C04168453_decoy,TRY1,Decoy,0,-7.27696,-5.44,-2.94,-5.315825300956985
O=C1Nc2c(O)n[nH]c2NC=C1NC(=O)c1ccc(Br)cc1,C19799239_decoy,TRY1,Decoy,0,-6.9002,-8.07,-0.66,-10.021470728477802
Cc1cc(SCC(=O)NC(C(N)=O)C(N)=O)c(C)cc1Br,C55274920_decoy,TRY1,Decoy,0,-7.28024,-7.12,-3.59,-7.106998995043646
N#Cc1cc2c(N)c(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)sc2nc1N,C58899834_decoy,TRY1,Decoy,0,-7.92128,-7.71,-0.84,-7.518504166675173
CC[NH+](CC)c1ccc([C@H]2C(C(N)=O)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1,C58949856_decoy,TRY1,Decoy,0,-7.45485,-5.08,-0.75,-5.02103502047771
Cc1n[nH]c2c1[C@H](c1c3ccccc3cc3ccccc13)C(C(N)=O)=C(N)O2,C58950962_decoy,TRY1,Decoy,0,-4.55969,-6.09,-0.89,-3.867354121625711
N#Cc1cc2c(N)c(C(=O)Nc3sc4c(c3C#N)CCC4)sc2nc1N,C58951844_decoy,TRY1,Decoy,0,-8.42407,-6.5,-1.49,-5.713252351289399
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccccc2)NC(=O)N1,C59385425_decoy,TRY1,Decoy,0,-8.04761,-5.7,0.01,-5.584321152084548
Cc1ccccc1CSc1nnc(N/N=C/c2ccc(O)cc2O)n1N,C20292318_decoy,TRY1,Decoy,0,-7.42026,-9.91,-2.03,-8.020667750338877
[NH3+][C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(I)cc1C(=O)[O-],C62824770_decoy,TRY1,Decoy,0,-7.51776,-5.39,-1.23,-5.576917911660015
[NH3+]CCNC(=O)Nc1c(Br)cc(Br)cc1C(=O)[O-],C62825581_decoy,TRY1,Decoy,0,-7.83006,-5.33,-0.7,-5.7979550138794
CC(=O)NC1(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)CCCCC1,C63575083_decoy,TRY1,Decoy,0,-8.19024,-8.23,-1.21,-10.43667159962648
CCCC[C@@H](NC(N)=O)C(=O)NNc1c(Cl)cc(Cl)cc1Cl,C65578664_decoy,TRY1,Decoy,0,-9.25676,-6.25,-1.09,-8.241401455015447
Nc1cc(N)nc(SC[C@H](O)COc2c(Cl)cccc2Cl)n1,C66238833_decoy,TRY1,Decoy,0,-8.99697,-6.65,-1.33,-11.125040218992757
Nc1cc(N)nc(SC[C@H](O)COc2ccc(Cl)cc2Cl)n1,C66238861_decoy,TRY1,Decoy,0,-9.37055,-7.16,-1.76,-9.31514639351512
Cc1cc2c(cc1NC(=O)C(C)C)N[C@@]1(O)c3ccccc3C(=O)[C@@]1(O)N2,C01279733_decoy,TRY1,Decoy,0,-7.70349,-7.5,-2.68,-5.266872930568478
CC(C)c1ccc(Nc2nc(NN)nc(Nc3ccc(C(C)C)cc3)n2)cc1,C02345964_decoy,TRY1,Decoy,0,-9.7866,-7.43,-1.84,-7.99712441907772
CC1=C(C(=O)Nc2cccc(Cl)c2)[C@@H](c2ccc(O)cc2O)NC(=O)N1,C05943921_decoy,TRY1,Decoy,0,-6.89576,-7.18,-1.13,-5.405267485637234
O=C(N/N=C/c1ccc(O)c(Br)c1)c1cc(O)c(O)c(O)c1,C06219932_decoy,TRY1,Decoy,0,-10.2217,-6.28,-0.27,-6.508782097642164
Cc1nn(C(=O)c2ccccc2O)c2c1[C@H](c1ccc(O)cc1O)SC(N)=N2,C06483951_decoy,TRY1,Decoy,0,-8.15764,-6.48,-4.09,-5.04654543239704
C[C@@H](OC(=O)c1ccc(Cl)cc1N)C(=O)Nc1sccc1C(N)=O,C07302545_decoy,TRY1,Decoy,0,-8.36763,-7.25,-1.43,-7.48963793031971
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2,C08022962_decoy,TRY1,Decoy,0,-7.2439,-5.2,-1.34,-6.131036876478531
C[C@H](Sc1nc(N)nc(N)n1)C(=O)Nc1ccc(Br)cc1,C09366666_decoy,TRY1,Decoy,0,-9.16599,-8.38,-0.45,-12.205855183440692
C[C@@]1(Oc2c[nH]c3ccccc23)O[C@](C)(C(=O)O)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970291_decoy,TRY1,Decoy,0,-5.85674,-5.3,-1.41,-3.630710408987439
C[C@H](SCc1nc(N)nc(N)n1)C(=O)Nc1ccc(Br)cc1,C11048432_decoy,TRY1,Decoy,0,-8.75042,-7.36,-1.73,-11.446732754859392
OC[C@@H]1O[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@@H](O)[C@@H]1O,C12153279_decoy,TRY1,Decoy,0,-6.80028,-5.58,-2.16,-4.400718932255507
CSc1cccc(NC(=S)NNC(=S)NNc2ccccc2)c1,C12368530_decoy,TRY1,Decoy,0,-7.50614,-6.36,-1.5,-6.276838217230011
OC[C@H]1O[C@@H](Oc2c[nH]c3cc(Cl)c(Br)cc23)[C@H](O)[C@@H](O)[C@@H]1O,C12957083_decoy,TRY1,Decoy,0,-8.09001,-7.07,-2.9,-4.997102239630501
CC(C)[C@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)NC(N)=O,C06108854_decoy,TRY1,Decoy,0,-9.13877,-6.85,-1.63,-5.901634635904343
Nc1nc(N)c2c(Cl)c(CNc3cccc(Br)c3)ccc2n1,C13207352_decoy,TRY1,Decoy,0,-9.38389,-7.87,-1.23,-10.689397892977658
CC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O)C1)C(=O)c1c(O)cccc1C3=O,C13432673_decoy,TRY1,Decoy,0,-8.51972,-6.2,-0.98,-4.540322295262372
COc1cc(/C=N/NC(N)=S)cc(Br)c1OCC(N)=O,C13747509_decoy,TRY1,Decoy,0,-9.39054,-4.11,-1.33,-5.149079118273051
OC[C@H]1O[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@H](O)[C@@H]1O,C15205852_decoy,TRY1,Decoy,0,-7.60329,-5.58,-2.09,-4.584035332403205
OC[C@@H]1O[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@H](O)[C@H](O)[C@H]1O,C15206496_decoy,TRY1,Decoy,0,-7.14308,-6.05,-0.79,-4.236416256975876
Cc1ccccc1Nc1sc(C(=O)c2ccccc2Cl)c(N)c1C(N)=O,C15862831_decoy,TRY1,Decoy,0,-7.45349,-5.26,-2.07,-4.913154368062602
Nc1nc(COC(=O)c2ccc(Cl)cc2N)nc(Nc2ccccc2)n1,C16118432_decoy,TRY1,Decoy,0,-6.39082,-5.99,-1.97,-5.306818637766952
CCOC(=O)[C@@H]1[C@@H](c2ccc(O)c(O)c2)NC(=S)N[C@@]1(O)C(F)(F)F,C13471726_decoy,TRY1,Decoy,0,-8.89771,-6.01,-3.87,-6.147269117190077
NC(=O)C1=C(N)S[C@@H]2C(=O)N(c3ccc4ccccc4c3)C(=O)[C@H]2[C@@H]1c1ccccc1O,C23409237_decoy,TRY1,Decoy,0,-9.11448,-8.94,-1.94,-8.521775526512286
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNc1c(Cl)cc(Cl)cc1Cl,C25381931_decoy,TRY1,Decoy,0,-8.73764,-6.37,-2.06,-7.834301973335629
Cc1cc(C(=O)NNC(=S)NC2CCCC2)cc(S(N)(=O)=O)c1C,C27253518_decoy,TRY1,Decoy,0,-9.4642,-5.85,-2.86,-5.993191703220291
C[C@H](NC(N)=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2,C27313806_decoy,TRY1,Decoy,0,-8.76369,-6.7,-1.21,-6.755941884158033
CC[C@@H]1CCc2sc(C(=O)NNC(=O)[C@H](NC(N)=O)C(C)C)cc2C1,C27327219_decoy,TRY1,Decoy,0,-9.64725,-6.03,-1.67,-7.489908862184722
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2,C27329986_decoy,TRY1,Decoy,0,-8.13789,-6.2,-4.01,-7.137684555947241
Cc1ccc(C(=O)CSC2=C(C(N)=O)C3(CCCC3)C(C#N)=C(N)N2)cc1,C14671743_decoy,TRY1,Decoy,0,-7.50908,-6.26,-3.6,-5.296658978152634
C[C@@H]1CCc2c(sc3nc(S[C@H](C)C(=O)NC(N)=O)nc(N)c23)C1,C36812271_decoy,TRY1,Decoy,0,-7.89961,-7.08,-3.6,-5.271288201898788
CC1=C[C@@H]([C@H]2NN[C@@H](SCC(=O)Nc3c(C)cc(C)cc3C)N2N)N=N1,C38994491_decoy,TRY1,Decoy,0,-7.86145,-5.86,-2.19,-5.723327728291111
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4c(C)cc(C)cc4Cl)N3N)N=N2)cc1,C38994975_decoy,TRY1,Decoy,0,-10.8516,-8.18,-1.88,-7.435620439307058
Cc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4cccc(Cl)c4C)N3N)N=N2)cc1,C39006562_decoy,TRY1,Decoy,0,-9.86994,-8.99,-1.24,-9.4127867211287
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4cccc(Cl)c4C)N3N)N=N2)cc1,C39006564_decoy,TRY1,Decoy,0,-9.51268,-7.72,-2.06,-6.526166540129089
Cc1cccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)c1C,C39016227_decoy,TRY1,Decoy,0,-10.629,-8.83,-1.25,-7.682574343096031
NN1[C@@H](SCC(=O)Nc2ccc(Br)cc2F)NN[C@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C39016696_decoy,TRY1,Decoy,0,-10.8445,-6.23,-0.69,-6.065760612440917
Cc1ccc(Cl)cc1NC(=O)c1sc2nc(N)c(C#N)c(C)c2c1N,C39335696_decoy,TRY1,Decoy,0,-8.32446,-5.67,-0.34,-5.584811528040808
CC(C)c1ccc(Nc2sc3c(-c4ccc(Cl)cc4)c(C#N)c(N)nc3c2C(N)=O)cc1,C39895248_decoy,TRY1,Decoy,0,-9.02358,-5.78,-3.31,-4.8852898433579695
NS(=O)(=O)c1ccc2c(c1)N1[C@H](NN[C@@H]1c1ccc(Cl)cc1Cl)C(=O)N2,C39932770_decoy,TRY1,Decoy,0,-8.49388,-5.78,-2.95,-5.225387018412084
CC1(C)CC(Nc2ncnc(N3CCC(C(=O)[O-])CC3)c2N)CC(C)(C)[NH2+]1,C40760947_decoy,TRY1,Decoy,0,-8.85597,-5.14,-2.71,-4.870494649999283
Cc1ccc(C(=O)NNc2ncnc(Nc3ccc(Cl)cn3)c2N)cc1,C40779415_decoy,TRY1,Decoy,0,-8.98023,-7.77,-1.07,-6.644156696227374
CC(C)CNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)NC2CC2)cc1,C42667444_decoy,TRY1,Decoy,0,-8.55712,-8.01,-1.8,-7.063663975926044
CC(=O)O[C@@H]1[C@@H]2CC[C@@H]3[C@@](C)(O)[C@H]4C[C@H](O)C(C)(C)[C@]4(O)[C@H](O)C[C@]13C[C@@]2(C)O,C43510961_decoy,TRY1,Decoy,0,-8.23659,-5.95,-2.55,-5.51259643209398
C[C@@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)Nc1cccc(S(N)(=O)=O)c1,C45485248_decoy,TRY1,Decoy,0,-9.3698,-7.94,-3.2,-6.510365940580011
Nc1nc(N)c(F)c(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)c1F,C01489220_decoy,TRY1,Decoy,0,-8.22957,-8.07,-1.78,-8.876979848541422
C[C@H](Sc1nc(N)c2c3c(sc2n1)CCCCC3)C(=O)NC(N)=O,C09322593_decoy,TRY1,Decoy,0,-8.49501,-7.79,-0.97,-6.217202595052931
C/C(=C\C(=O)Nc1cccc2c1CCCC2)NNC(=O)c1ccc(N)cc1,C05249898_decoy,TRY1,Decoy,0,-8.4927,-8.87,-0.99,-7.177514569680489
Nc1ccccc1C1=NC(=O)[C@@]2(CC(c3ccc(Br)cc3)=NN2)NN1,C12534111_decoy,TRY1,Decoy,0,-8.2748,-9.21,-1.09,-6.010012583723389
Nc1cc(S(N)(=O)=O)ccc1Nc1cc(Br)ccc1Cl,C61691083_decoy,TRY1,Decoy,0,-7.5756,-5.22,-3.46,-4.342432708094504
O=C(NC[C@@H](O)c1ccc(O)cc1)C(=O)Nc1cccc2c(O)cccc12,C61718356_decoy,TRY1,Decoy,0,-9.62943,-9.5,-1.78,-7.679580850054263
COc1cc2c(c(-c3cc(O)cc4c3[C@H](C)[NH+](C)CC4)c1O)[C@H](C)[NH+](C)CC2,C03847257_decoy,TRY1,Decoy,0,-6.84126,-5.79,-1.69,-4.432609426205594
CCCC1CC[NH+](Cc2cc(O)c(C[NH+]3CCC(CCC)CC3)cc2O)CC1,C15442148_decoy,TRY1,Decoy,0,-8.77779,-5.94,-3.94,-6.033638969056201
C[C@]12C[C@H]([NH+]3CCOCC3)[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H](O)[C@@H]([NH+]3CCCC3)C[C@@H]12,C22011078_decoy,TRY1,Decoy,0,-8.89667,-6.6,-1.55,-5.2025437474014975
CC[NH2+]CCC[C@@H](C)Nc1c2ccc(Cl)cc2[nH+]c2ccc(OC)cc12,C22064240_decoy,TRY1,Decoy,0,-6.69755,-5.94,0.1,-4.817886262479259
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1c1ccccc1Br,C38827396_decoy,TRY1,Decoy,0,-6.87605,-7.89,-0.69,-8.970114578528639
Oc1ccc(Br)cc1/C=N/[NH+]=C1/N=NC2=c3ccccc3=[NH+][C@@H]2N1,C39698001_decoy,TRY1,Decoy,0,-7.52635,-6.72,-0.76,-4.981779503076256
Oc1ccccc1/C=N/[NH+]=C1/N=NC2=c3cc(Br)ccc3=[NH+][C@@H]2N1,C39699714_decoy,TRY1,Decoy,0,-6.83565,-8.08,0.27,-4.979976155083007
Oc1ccc(/C=N/[NH+]=C2/N=NC3=c4cc(Br)ccc4=[NH+][C@H]3N2)cc1,C39699737_decoy,TRY1,Decoy,0,-8.43242,-8.1,-1.02,-6.334759084136024
CC[C@H]([NH3+])[C@@H](c1ccc(C)s1)[NH+](C)Cc1cc(Br)cs1,C43242637_decoy,TRY1,Decoy,0,-9.09692,-4.45,-2.71,-5.854113440142194
CC[C@@H]([NH3+])[C@@H](c1ccc(Cl)s1)[NH+](C)Cc1csc(Br)c1,C43253603_decoy,TRY1,Decoy,0,-8.32836,-3.89,-2.44,-5.129644050117403
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](C)Cc1ccccc1F,C43260289_decoy,TRY1,Decoy,0,-9.03008,-5.0,-0.37,-5.617954319535434
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)Cc1ccc(Cl)s1,C43261825_decoy,TRY1,Decoy,0,-8.32565,-4.6,-2.45,-5.673590919437423
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](Cc1cccs1)C(C)C,C43262139_decoy,TRY1,Decoy,0,-8.589,-3.7,-4.99,-4.828954034796027
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](C)[C@@H](C)c1cccs1,C43262205_decoy,TRY1,Decoy,0,-8.50197,-4.1,-0.66,-5.2070415538313135
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)[C@@H](C)c1cccs1,C43287007_decoy,TRY1,Decoy,0,-8.14512,-5.48,-1.49,-9.41130590848123
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)[C@@H](C)c1cccs1,C43287009_decoy,TRY1,Decoy,0,-8.19207,-4.29,-1.22,-5.25206243415397
CC1(C)CC([NH2+]Cc2cc(Br)c(Br)o2)CC(C)(C)[NH2+]1,C50358899_decoy,TRY1,Decoy,0,-8.59647,-5.01,-2.09,-4.668683758099209
[NH3+]C[C@H](c1cc(Br)c(Br)o1)[NH+]1CCSCC1,C50361691_decoy,TRY1,Decoy,0,-8.42602,-3.81,-1.69,-4.043224966628709
[NH3+]C[C@@H](c1cc(Br)c(Br)o1)[NH+]1CC[C@@H]2CCCC[C@@H]2C1,C50361945_decoy,TRY1,Decoy,0,-8.53607,-4.55,-0.13,-4.74535456168201
[NH3+]C[C@H](c1cc(Br)c(Br)o1)[NH+]1CCC[C@H]2CCCC[C@@H]21,C50361948_decoy,TRY1,Decoy,0,-8.76912,-4.24,-1.33,-4.552714546088273
[NH3+]C[C@@H](c1cc(Br)c(Br)o1)[NH+]1CCCSCC1,C50362087_decoy,TRY1,Decoy,0,-8.5849,-3.96,-1.1,-4.34980672497026
CC(=O)N1CCC2(CC1)N[C@@H](c1[nH]c(-c3ccccc3)c[nH+]1)CC1=c3ccccc3=[NH+][C@H]12,C52603749_decoy,TRY1,Decoy,0,-6.21719,-6.88,-0.31,-4.710124402810595
CC[NH+](CC)CCNc1ccc(Nc2cc[nH+]c3cc4ccccc4cc23)cc1,C38195818_decoy,TRY1,Decoy,0,-7.35989,-6.56,-0.96,-5.272562932600554
Oc1ccc(Cl)cc1/C=[NH+]/[C@H]1CCCC[C@@H]1/[NH+]=C/c1cc(Cl)ccc1O,C05713523_decoy,TRY1,Decoy,0,-10.0149,-5.7,-3.55,-6.829765367286815
CC1(C)CC[NH+]([C@@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C61818911_decoy,TRY1,Decoy,0,-7.60957,-3.93,-2.54,-4.7159572999639385
CC(C)(C)c1cc([C@@H](O)CSC2[NH+]=c3ccccc3=[NH+]2)cc(C(C)(C)C)c1O,C63249134_decoy,TRY1,Decoy,0,-7.68655,-7.83,-1.57,-7.151943839645916
CC1(C)CC(NC(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@H]3[C@H]3c4ccccc4C(=O)N32)CC(C)(C)[NH2+]1,C63375370_decoy,TRY1,Decoy,0,-7.54522,-8.16,-1.73,-6.11215095387746
Cc1ccc2c(c1)=[NH+][C@H](C1=C(N)N(c3ccc(Br)cc3)CC1=O)[NH+]=2,C63515062_decoy,TRY1,Decoy,0,-7.80909,-5.45,-2.44,-4.687786682344737
CC1=C2[C@H](c3c(Cl)cccc3Cl)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C63698985_decoy,TRY1,Decoy,0,-7.98011,-6.81,-2.32,-5.867467083384008
CC1=C2[C@@H](c3c(Cl)cccc3Cl)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C63698988_decoy,TRY1,Decoy,0,-7.88038,-7.63,-1.94,-5.544388564440137
CC1=C2[C@H](c3cccc(Cl)c3Cl)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C63699056_decoy,TRY1,Decoy,0,-7.47181,-7.62,-1.74,-4.947091448672101
CC1=C2[C@H](c3ccc(F)c(Br)c3)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450277_decoy,TRY1,Decoy,0,-7.54886,-8.55,-2.9,-5.045068851731673
CC1=C2[C@H](c3ccc(F)c(Br)c3)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450279_decoy,TRY1,Decoy,0,-7.32239,-6.52,-1.51,-4.82785748212405
CC1=C2[C@@H](c3c(F)cccc3Cl)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450306_decoy,TRY1,Decoy,0,-7.0602,-8.56,-1.83,-5.558792130938479
CC1=C2[C@H](c3cc(Br)ccc3F)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450311_decoy,TRY1,Decoy,0,-7.86014,-5.77,-0.72,-4.455232020552371
CC1=C2[C@@H](NC(=O)C[C@@H]2c2cc(Br)ccc2F)N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450312_decoy,TRY1,Decoy,0,-6.79484,-8.45,-0.95,-4.732900562575413
CC1=C2[C@@H](c3cccc(Br)c3)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450314_decoy,TRY1,Decoy,0,-8.36828,-7.85,-3.31,-5.800774183267251
CC1=C2[C@@H](c3ccccc3Br)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450318_decoy,TRY1,Decoy,0,-6.72302,-6.34,-3.62,-4.206362841455486
CC1=C2[C@H](c3ccc(Br)cc3)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450323_decoy,TRY1,Decoy,0,-5.80188,-7.26,-0.91,-5.740554779086717
CC1=C2[C@@H](NC(=O)C[C@@H]2c2ccc(Br)cc2)N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450324_decoy,TRY1,Decoy,0,-7.33894,-6.96,-1.71,-4.5672839392790925
CC1=C2[C@H](c3ccccc3Cl)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450327_decoy,TRY1,Decoy,0,-6.73593,-7.67,-1.49,-4.951452567887235
CC1=C2[C@H](c3cc(F)cc(F)c3)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450337_decoy,TRY1,Decoy,0,-6.96875,-6.72,-2.63,-5.300480107715022
CC1=C2[C@H](c3ccc(F)cc3Cl)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450357_decoy,TRY1,Decoy,0,-6.97984,-7.02,-0.76,-5.533024390883451
CC1=C2[C@@H](c3cc(Cl)ccc3F)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450362_decoy,TRY1,Decoy,0,-8.19697,-6.81,-0.85,-5.2203607287653
CC1=C2[C@H](c3cc(Cl)ccc3F)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450363_decoy,TRY1,Decoy,0,-7.38658,-6.75,-3.09,-5.857422002634967
CC1=C2[C@@H](NC(=O)C[C@@H]2c2cc(Cl)ccc2F)N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450364_decoy,TRY1,Decoy,0,-6.64793,-8.46,-3.05,-5.346824335513288
CC1=C2[C@H](c3c(F)cccc3F)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450409_decoy,TRY1,Decoy,0,-7.39593,-6.49,-3.62,-4.883929100437557
CC1=C2[C@@H](NC(=O)C[C@@H]2c2c(F)cccc2F)N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450412_decoy,TRY1,Decoy,0,-6.66568,-6.59,-3.71,-4.036992027366376
CC1=C2[C@@H](c3ccc(F)c(F)c3)CC(=O)N[C@@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450414_decoy,TRY1,Decoy,0,-6.85859,-8.67,-2.22,-5.173483465592367
CC1=C2[C@H](c3ccc(F)c(F)c3)CC(=O)N[C@H]2N(C2[NH+]=c3ccccc3=[NH+]2)N1,C64450415_decoy,TRY1,Decoy,0,-6.53758,-6.35,-0.91,-4.69395187670396
Cc1cc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCC(C)C,C02367220_decoy,TRY1,Decoy,0,-8.40244,-8.33,-1.95,-7.691305011178472
COc1cc2cc(CN(Cc3ccc4c(c3)OCO4)S(=O)(=O)c3ccc(Br)cc3)c(=O)[nH]c2cc1OC,C00918859_decoy,TRY1,Decoy,0,-8.89061,-5.81,-1.59,-5.067399513889498
CC(C)CCNC(=O)[C@H](c1cccs1)N(C[C@@H]1CCCO1)C(=O)Cn1nnc(-c2ccc(F)cc2)n1,C06134615_decoy,TRY1,Decoy,0,-8.9355,-7.97,-3.21,-8.68125904969715
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)COC(=O)C[C@H]2Sc3ccccc3NC2=O)cc1,C12633845_decoy,TRY1,Decoy,0,-9.05999,-6.56,-2.44,-6.1648621938426045
Cc1ccc(-c2nnn(CC(=O)N(Cc3ccccc3Cl)[C@H](C(=O)NC(C)(C)C)c3ccc(C)o3)n2)o1,C12716311_decoy,TRY1,Decoy,0,-8.26606,-8.73,-1.78,-7.604071481354392
CCC(C)(C)NC(=O)[C@H](c1cccn1C)N(Cc1ccc2c(c1)OCO2)C(=O)Cn1nnc2ccccc21,C13031844_decoy,TRY1,Decoy,0,-7.15479,-8.03,-1.98,-7.775990270411851
Cc1ccccc1N(C(=O)Cn1nnc(-c2ccc(F)cc2)n1)[C@H](C(=O)NC1CCCC1)c1ccncc1,C06443989_decoy,TRY1,Decoy,0,-8.54181,-8.86,-2.29,-7.435070386546056
O=C(NC1CCCC1)[C@H](c1ccncc1)N(C(=O)Cn1nnc(-c2ccc(F)cc2)n1)c1ccc(F)cc1,C06445042_decoy,TRY1,Decoy,0,-8.04354,-6.44,-1.45,-6.195367336415241
CCOCCCN1C(=O)[C@@H](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])S/C1=N\c1ccc(F)cc1F,C13134182_decoy,TRY1,Decoy,0,-7.58372,-7.03,-4.68,-6.049578354733836
COC(=O)C1=C(C)NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@H]1c1cc(OC)c(OC)cc1OC,C02073030_decoy,TRY1,Decoy,0,-8.99184,-6.87,-2.42,-6.338418000540477
COCCn1nnnc1[C@@H](c1cc2cc(C)ccc2[nH]c1=O)N(Cc1ccccc1)Cc1ccc(OC)cc1,C19972902_decoy,TRY1,Decoy,0,-8.78458,-7.13,-1.82,-7.081986079620484
Cc1cccc2cc([C@@H](c3nnnn3Cc3ccccc3)N(Cc3ccccc3)Cc3cccnc3)c(=O)[nH]c12,C19973102_decoy,TRY1,Decoy,0,-7.48784,-8.43,-1.94,-8.304786578218703
Cc1cccc2cc([C@@H](c3nnnn3Cc3ccccc3)N(Cc3cccs3)C[C@@H]3CCCO3)c(=O)[nH]c12,C19973130_decoy,TRY1,Decoy,0,-9.01473,-7.38,-1.11,-9.241259090129727
COc1ccc(CCN(Cc2cc3c(C)cc(C)cc3[nH]c2=O)Cc2nnnn2C[C@H]2CCCO2)cc1OC,C20081821_decoy,TRY1,Decoy,0,-9.55328,-7.65,-1.66,-7.01094501082297
Cc1ccc2[nH]c(=O)c([C@H](c3nnnn3C[C@@H]3CCCO3)N(Cc3ccccc3)Cc3cccs3)cc2c1,C20082274_decoy,TRY1,Decoy,0,-9.68458,-7.07,-1.8,-7.248544156298672
CCOc1cc2[nH]c(=S)n(CCCC(=O)N3CCN(c4cccc(Cl)c4)CC3)c(=O)c2cc1OCC,C20644646_decoy,TRY1,Decoy,0,-10.4242,-6.73,-3.8,-6.146223341760232
[H]/N=C1C(=C\c2ccc(OCCOCCOc3ccc(C)c(C)c3)c(OC)c2)/C(=O)N=C2SC(CC)=NN2/1,C32109384_decoy,TRY1,Decoy,0,-9.10559,-5.67,-2.99,-5.336158006275381
COC(=O)c1ncn2c1C(=O)N(Cc1ccc(OC(C)C)cc1)[C@](C)(C(=O)NCc1ccccc1OC)C2,C33266014_decoy,TRY1,Decoy,0,-8.12666,-7.88,-3.25,-7.381400908405419
COCCn1c(-c2csc(COc3cc(Cl)cc(Cl)c3)n2)cc(C(=O)NC[C@@H]2CCCO2)c1C,C33597825_decoy,TRY1,Decoy,0,-11.4382,-6.43,-2.98,-6.792351311033873
COCCNC(=O)c1cc(-c2csc(COc3cc(Cl)cc(Cl)c3)n2)n(C[C@@H]2CCCO2)c1C,C34772628_decoy,TRY1,Decoy,0,-10.5458,-6.97,-3.46,-7.563501814132489
COCCCN(C(=O)Nc1cccc(Br)c1)[C@H](C)c1nc2ccccc2c(=O)n1CCOC,C35115009_decoy,TRY1,Decoy,0,-6.8771,-6.2,-2.61,-5.238779898600987
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2ccc3c(c2)OCCO3)[C@H]1c1cccc(Br)c1,C35520164_decoy,TRY1,Decoy,0,-8.0506,-5.91,-1.45,-5.923861273829048
CCOC(=O)C1=C(CN2CCN(C(=O)c3ccc(F)cc3)[C@H](C)C2)N(CC)C(=O)N[C@H]1c1ccsc1,C35664385_decoy,TRY1,Decoy,0,-8.71907,-7.41,-1.9,-7.189252258867551
C[C@H]1CN(c2cc(Cl)nc(SCC(=O)NCCN3CCOCC3)n2)CCN1C(=O)C1CCCCC1,C00734074_decoy,TRY1,Decoy,0,-10.9473,-6.57,-2.21,-6.793509419348061
Cc1nc(-c2ccccc2)nc(N2CCN(C[C@H](O)CN3CCOCC3)CC2)c1Cc1ccc([N+](=O)[O-])cc1,C35782914_decoy,TRY1,Decoy,0,-9.83803,-6.28,-4.49,-6.277700278113287
CCOc1cccc([C@H]2C(C(=O)c3cnn(-c4ccccc4)c3C)=C([O-])C(=O)N2CCC[NH+](CC)CC)c1,C33813502_decoy,TRY1,Decoy,0,-8.20863,-7.07,-4.56,-7.027412097119134
CC(=O)CCC(=O)O[C@@H]1[C@@H](NOC(C)=O)[C@H](Sc2ccccc2)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]12,C39280289_decoy,TRY1,Decoy,0,-6.47435,-6.19,-2.67,-5.219314973235011
COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(=O)CCCN1C(=O)c2ccccc2C1=O,C40890132_decoy,TRY1,Decoy,0,-8.09615,-7.8,-3.08,-6.798612546414571
Cc1ccc(C)c2[nH]c(=O)c([C@@H](c3nnnn3C3CCCCC3)N(Cc3cccnc3)C[C@H]3CCCO3)cc12,C00782454_decoy,TRY1,Decoy,0,-8.87571,-6.62,-2.69,-6.637551741014113
COc1ccc(CN(C[C@H]2CCCO2)[C@H](c2cc3cc(OC)ccc3[nH]c2=O)c2nnnn2C2CCCC2)cc1,C00930297_decoy,TRY1,Decoy,0,-9.40149,-6.74,-2.38,-6.281248328624965
CC(C)[C@@H](c1nnnn1Cc1ccco1)N(Cc1ccccc1Cl)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C01336724_decoy,TRY1,Decoy,0,-9.90581,-6.5,-2.91,-6.358052631253143
Cc1ccc2cc(CN(Cc3ccc4c(c3)OCO4)Cc3nnnn3Cc3ccc(F)cc3)c(=O)[nH]c2c1C,C01372911_decoy,TRY1,Decoy,0,-8.82742,-8.42,-1.78,-6.458702125344188
CC[C@@H](c1nnnn1Cc1ccc(F)cc1)N(Cc1ccc(F)cc1)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C01374947_decoy,TRY1,Decoy,0,-9.38006,-8.06,-1.2,-8.17368075722227
CC[C@H](c1nnnn1Cc1ccco1)N(Cc1ccccc1)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C01374964_decoy,TRY1,Decoy,0,-8.62252,-6.78,-2.68,-6.175751854111289
[H]/N=C1C(=C\c2cc([N+](=O)[O-])ccc2OCCOc2ccccc2CC=C)/C(=O)N=C2SC(C(F)(F)F)=NN2/1,C01875178_decoy,TRY1,Decoy,0,-7.85677,-7.15,-2.41,-7.362647993884551
[H]/N=C1C(=C/c2cc(Br)ccc2OCCOc2ccccc2)/C(=O)N=C2SC(CCC)=NN2/1,C22063633_decoy,TRY1,Decoy,0,-7.52699,-5.91,-2.92,-5.1117122171437845
[H]/N=C1C(=C/c2ccc(OCCSc3ccc(Cl)cc3)c(OC)c2)/C(=O)N=C2SC(C(C)C)=NN2/1,C09235895_decoy,TRY1,Decoy,0,-9.65874,-5.66,-2.18,-5.176946449057246
[H]/N=C1C(=C/c2ccc(OCCOCCOc3ccc(C)cc3)c(OCC)c2)/C(=O)N=C2SC(CC)=NN2/1,C09122104_decoy,TRY1,Decoy,0,-9.66541,-8.45,-1.57,-8.797088867148457
CCOc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C3CCCC3)N(Cc3cccnc3)Cc3ccco3)cc2c1,C57531022_decoy,TRY1,Decoy,0,-8.74847,-6.42,-3.35,-6.135294634493018
CCOc1ccc2[nH]c(=O)c([C@H](c3nnnn3C3CCCC3)N(Cc3cccnc3)Cc3ccco3)cc2c1,C57531027_decoy,TRY1,Decoy,0,-8.94536,-7.0,-1.86,-6.286431373137429
CCc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C3CCCCC3)N(Cc3cccnc3)Cc3ccco3)cc2c1,C57608147_decoy,TRY1,Decoy,0,-7.89789,-6.18,-0.95,-5.872347437524732
Cc1ccc2cc([C@H](c3nnnn3C[C@@H]3CCCO3)N(Cc3ccc(F)cc3)Cc3ccco3)c(=O)[nH]c2c1,C57608367_decoy,TRY1,Decoy,0,-8.65789,-8.3,-2.46,-7.8621734579466365
Cc1cc(C)c2[nH]c(=O)c([C@H](c3nnnn3C3CCCCC3)N(Cc3cccnc3)Cc3ccco3)cc2c1,C57608466_decoy,TRY1,Decoy,0,-8.13589,-7.33,-3.55,-6.391330040311688
CC[C@@H](c1nnnn1C[C@@H]1CCCO1)N(Cc1ccc(OC)cc1)Cc1cc2ccc(OC)cc2[nH]c1=O,C57641174_decoy,TRY1,Decoy,0,-8.3413,-6.97,-3.8,-8.70151296193141
CC[C@@H](c1nnnn1C[C@@H]1CCCO1)N(Cc1ccc(OC)cc1)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C57642272_decoy,TRY1,Decoy,0,-8.22603,-7.78,-2.57,-6.656401974249668
Cc1cc(C)c2[nH]c(=O)c(CN(Cc3ccc4c(c3)OCO4)Cc3nnnn3Cc3ccc(F)cc3)cc2c1,C57643247_decoy,TRY1,Decoy,0,-8.25358,-9.01,-1.94,-6.667735791659044
CCC[C@@H](c1nnnn1C(C)(C)C)N(Cc1ccc(F)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13499384_decoy,TRY1,Decoy,0,-8.95979,-7.8,-1.53,-8.124297547503252
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(Cl)c(C)c3)c(OC)c2)/C(=O)N=C2SC(CC(C)C)=NN2/1,C27549886_decoy,TRY1,Decoy,0,-9.10878,-5.67,-3.16,-4.9093209349862175
CCOc1ccc([C@H]2C(C(=O)[C@@H]3C(C)=NC(C(=O)OC)=C3C)=C([O-])C(=O)N2CCC[NH+](C)C)cc1OC,C20193089_decoy,TRY1,Decoy,0,-9.47452,-4.72,-1.86,-5.8933360500140335
CCN(CC)S(=O)(=O)c1cc(-c2c(C(=O)NCc3ccc(C)o3)nn3c(C)cc(C)nc23)ccc1OC,C65119185_decoy,TRY1,Decoy,0,-7.47244,-6.54,-4.41,-5.860148047981064
CC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(C[C@H]1CCCO1)C(=O)Cn1nnc(-c2ccc(F)cc2)n1,C06074901_decoy,TRY1,Decoy,0,-9.14382,-8.22,-1.42,-7.594100791725852
CCOc1ccc2[nH]c(=O)c(CN(Cc3cccs3)S(=O)(=O)c3ccc4c(c3)OCCO4)cc2c1,C00918572_decoy,TRY1,Decoy,0,-9.37201,-5.76,-2.06,-5.979314115268908
Cc1c(NC(=O)CCCN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c(=O)n(-c2ccccc2)n1C,C08820521_decoy,TRY1,Decoy,0,-9.41188,-9.5,-3.59,-7.661305119653879
CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2c3c(nn2-c2ccc(C)cc2C)C[S@+]([O-])C3)cc1,C08919515_decoy,TRY1,Decoy,0,-8.66097,-5.62,-1.83,-5.446343301279327
O=S(=O)(Cc1ccc(Cl)cc1Cl)c1nnc(CNS(=O)(=O)c2ccc(Cl)s2)o1,C09028233_decoy,TRY1,Decoy,0,-10.9565,-7.5,-3.2,-7.4870584246283105
COc1ccc(Cl)c2sc(NC(=O)c3ccc(S(=O)(=O)N(CCC#N)CCC#N)cc3)nc12,C09447187_decoy,TRY1,Decoy,0,-9.24897,-5.1,-4.96,-5.533393469240599
CCOC(=O)c1sc(NC(=O)CSc2nc(=O)n(Cc3cccnc3)c3c2CCCC3)nc1C,C09326658_decoy,TRY1,Decoy,0,-8.76836,-7.73,-3.34,-7.053200327661559
COc1cc(OC)c(NC(=O)[C@@H]2c3ccccc3C(=O)N(C)[C@@H]2c2ccc(OC)c(OC)c2)cc1Cl,C03661066_decoy,TRY1,Decoy,0,-9.39339,-5.08,-2.13,-6.022776718965164
CC(C)(C)N1C[C@@H](C(=O)N2CCC(C(=O)Nc3nnc(COc4ccc(Cl)cc4)s3)CC2)CC1=O,C11095434_decoy,TRY1,Decoy,0,-10.3165,-6.35,-1.76,-6.3597072430753
COc1ccc(/C=C2\SC(=S)N(CCCC(=O)Nc3c(C)n(C)n(-c4ccccc4)c3=O)C2=O)cc1,C01202741_decoy,TRY1,Decoy,0,-9.34514,-8.65,-1.64,-7.796912398422449
CC(C)c1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)N(CCC#N)CCC#N)cc3)n2)cc1,C11617322_decoy,TRY1,Decoy,0,-9.43113,-6.19,-3.12,-6.146792780845915
Cc1nn(C)cc1[C@H](C(=O)NC1CCCCC1)N(Cc1cccs1)C(=O)[C@@H]1COc2ccccc2O1,C00931418_decoy,TRY1,Decoy,0,-8.11388,-5.47,-2.88,-5.588412446976309
COC(=O)[C@@H]1C[C@H](O)CN1C(=O)CCC(=O)O[C@@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C12659463_decoy,TRY1,Decoy,0,-9.248,-7.49,-2.46,-6.4574111539023615
CCN(c1ccc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3Br)C2=O)cc1)S(C)(=O)=O,C14167452_decoy,TRY1,Decoy,0,-7.68056,-5.39,-2.1,-5.105584800474976
Cc1c(NC(=O)CCCN2C(=O)S/C(=C\C=C\c3ccccc3)C2=O)c(=O)n(-c2ccccc2)n1C,C01469842_decoy,TRY1,Decoy,0,-8.0936,-9.48,-2.3,-9.706701019880592
COc1ccc2cc([C@H](c3nnnn3Cc3ccccc3)N3CCN(Cc4ccccc4)CC3)c(=O)[nH]c2c1,C19940416_decoy,TRY1,Decoy,0,-9.24429,-7.58,-3.82,-7.209942993626688
CCc1ccc2[nH]c(=O)c([C@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(c4ccccc4F)CC3)cc2c1,C19940726_decoy,TRY1,Decoy,0,-9.43986,-7.72,-1.54,-6.961945595140062
COCCn1nnnc1[C@@H](c1cc2cccc(C)c2[nH]c1=O)N(Cc1ccccc1)Cc1cccs1,C20083040_decoy,TRY1,Decoy,0,-7.20068,-6.72,-1.82,-7.919511091619031
COc1cc(/C=C/C(=O)Nc2nnc([C@@H]3CC(=O)N(c4cc(C)cc(C)c4)C3)s2)cc(OC)c1OC,C20580931_decoy,TRY1,Decoy,0,-9.12091,-7.8,-1.52,-7.318582089785832
CCOc1ccc(N2C[C@@H](C(=O)Nc3nnc([C@H]4CC(=O)N(c5ccc(CC)cc5)C4)s3)CC2=O)cc1,C20584862_decoy,TRY1,Decoy,0,-9.83694,-6.76,-0.95,-6.11984020914674
Cc1ccccc1N1C[C@H](c2nnc(NC(=O)c3ccccc3S(=O)(=O)CCC(C)C)s2)CC1=O,C20585038_decoy,TRY1,Decoy,0,-9.28448,-7.32,-2.44,-7.346886449635346
CC[C@@H](NC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1)c1ccc(S(C)(=O)=O)cc1,C22427632_decoy,TRY1,Decoy,0,-8.69635,-6.56,-4.02,-7.056872137407768
COc1ccc(Br)cc1/C=N/N(CCC(=O)NC(C)(C)C)C1=NS(=O)(=O)c2ccccc21,C22845826_decoy,TRY1,Decoy,0,-9.33617,-7.71,-2.88,-7.8158951412060516
O=C(Nc1nc(CN2CCOCC2)cs1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1,C23312376_decoy,TRY1,Decoy,0,-9.33731,-6.92,-2.28,-6.243456903310093
O=C(C[C@@H]1S/C(=N\c2ccc(F)cc2)N(CCCN2CCOCC2)C1=O)Nc1ccc(F)cc1F,C14361388_decoy,TRY1,Decoy,0,-9.44134,-7.59,-1.41,-8.03898701478306
COC(=O)[C@H]1C[C@@H](O)CN1C(=O)CCC(=O)O[C@H]1CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@H]3CC[C@@]12C,C34792906_decoy,TRY1,Decoy,0,-8.53273,-7.52,-3.99,-6.707012047911223
COCCN(CC(=O)N(Cc1ccco1)Cc1cccn1C)C(=O)Nc1ccc(Br)cc1,C35337170_decoy,TRY1,Decoy,0,-7.84858,-4.81,-2.93,-6.2046934839374295
CCOC(=O)C1=C(CN2CCN(C(=O)c3ccc(F)cc3)[C@H](C)C2)N(C)C(=O)N[C@@H]1c1ccsc1,C36001530_decoy,TRY1,Decoy,0,-7.09954,-6.42,-2.09,-5.953481307261177
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc(Cl)cc2)N(Cc2ccco2)C(=O)CCl)cc1,C36503479_decoy,TRY1,Decoy,0,-9.26998,-7.72,-3.24,-8.50032533414315
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc(C(F)(F)F)cc2)N(C)C(=O)c2cccnc2)cc1,C36538479_decoy,TRY1,Decoy,0,-8.02565,-8.52,-1.86,-7.338380864119638
C/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(Cc1ccc(C)o1)C(=O)[C@@H](OC)c1ccccc1,C36556446_decoy,TRY1,Decoy,0,-8.33034,-7.81,-3.13,-8.155067857506022
CC(C)(C)NC(=O)[C@H](c1ccncc1)N(C(=O)Cn1nnc(-c2ccc(F)cc2)n1)c1ccc(F)cc1,C06075175_decoy,TRY1,Decoy,0,-8.42935,-5.62,-3.76,-6.599655494199061
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2cnn(-c3ccccc3)c2C)[C@H]1c1ccccc1OC,C33813495_decoy,TRY1,Decoy,0,-7.13391,-6.75,-1.89,-6.206081009047226
C[C@H](CC[C@@H]1CC=CO1)NC(=O)N1CCN(CC2=NC(=O)C3=C(c4cccs4)CSC3=N2)CC1,C39732811_decoy,TRY1,Decoy,0,-9.35536,-5.74,-1.79,-6.453683606383128
CCn1c(NCc2ccc(OC)cc2)c(/C=C2/SC(=S)N(Cc3ccco3)C2=O)c(C)c(C#N)c1=O,C39851404_decoy,TRY1,Decoy,0,-8.62599,-7.36,-2.65,-6.881104283005567
CCn1c(NCc2ccccc2Cl)c(/C=C2/SC(=S)N(CCCOC)C2=O)c(C)c(C#N)c1=O,C39851444_decoy,TRY1,Decoy,0,-9.30342,-6.47,-3.25,-6.406006308799888
CC(=O)N1CCN(C(=O)c2coc(CN(CCc3c[nH]c4ccccc34)Cc3ccccc3F)n2)CC1,C40401831_decoy,TRY1,Decoy,0,-9.55168,-7.98,-2.39,-7.530802412079677
O=C(COc1cccc(Br)c1)Oc1ccc2cc(C(=O)NC[C@H]3CCCO3)c(=O)oc2c1,C40896091_decoy,TRY1,Decoy,0,-8.71097,-7.23,-2.13,-5.491360402436307
[H]/N=C1C(=C\c2cc(Cl)c(OCc3ccc([N+](=O)[O-])cc3)c(OCC)c2)\C(=O)N=C2SC(C)=CN2\1,C41083691_decoy,TRY1,Decoy,0,-7.69487,-6.0,-3.58,-4.923663666743356
COC(=O)[C@H]1C[C@@H](O)CN1C(=O)CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C43737004_decoy,TRY1,Decoy,0,-9.50221,-7.92,-3.77,-6.990544133993951
[H]/N=C1C(=C/c2cc(Cl)c(OCCOc3ccccc3Cl)c(OCC)c2)/C(=O)N=C2SC(C)=NN2/1,C13940283_decoy,TRY1,Decoy,0,-7.96504,-7.61,-1.7,-5.678078425581533
Cc1ccc2cc([C@H](c3nnnn3C[C@H]3CCCO3)N(Cc3ccccc3)Cc3ccco3)c(=O)[nH]c2c1,C57608251_decoy,TRY1,Decoy,0,-7.00292,-7.35,-2.35,-6.589965316984371
COc1cc(/C=N/NC(=O)CN(c2ccccc2Br)S(C)(=O)=O)cc(OC)c1OC,C58925116_decoy,TRY1,Decoy,0,-9.20479,-4.76,-5.36,-6.314882467964057
[H]/N=C1C(=C/c2ccc(OCCCOc3cc(C)ccc3C)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077781_decoy,TRY1,Decoy,0,-8.85929,-6.49,-1.99,-5.995076030910496
[H]/N=C1C(=C/c2c(C)n(CCOc3ccccc3OC)c3ccccc23)/C(=O)N=C2SC(C(C)C)=NN2/1,C33293617_decoy,TRY1,Decoy,0,-7.90499,-7.73,-2.43,-6.7747904376023085
[H]/N=C1C(=C/c2ccc(OCCCOc3cccc(C)c3)cc2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C41084056_decoy,TRY1,Decoy,0,-9.24112,-6.89,-2.92,-5.320460576797972
[H]/N=C1C(=C\c2ccc(OCCCOc3ccc(CC)cc3)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20207891_decoy,TRY1,Decoy,0,-8.75603,-7.34,-2.04,-5.970954740324639
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(Br)cc3)c(OCC)c2)\C(=O)N=C2C=C(C)ON2\1,C20235934_decoy,TRY1,Decoy,0,-9.79628,-6.3,-2.57,-6.214756092332205
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CC[NH+](C)C)[C@@H]2c2ccc(Br)cc2)C(C)=N1,C09271200_decoy,TRY1,Decoy,0,-8.51448,-4.95,-2.73,-5.470676324064262
CCOc1ccc(OCC)c(NC(=O)[C@@H]2SC(=S)n3c2nc(=O)c2cc(OC)c(OC)cc23)c1,C64460799_decoy,TRY1,Decoy,0,-7.84725,-5.86,-2.42,-5.740242928082044
CCCCSc1ccc2c(cc1=O)[C@H]([NH3+])CCc1cc(OC)c(OC)c(OC)c1-2,C05203263_decoy,TRY1,Decoy,0,-8.83383,-6.16,-0.87,-6.233091302792868
Cc1ccc2[nH]cc(CC[NH2+][C@H]3CC(=O)N(c4ccccc4C(F)(F)F)C3=O)c2c1,C05274571_decoy,TRY1,Decoy,0,-8.15756,-5.66,-2.0,-5.49805887621608
[NH2+]=C(NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCSCC1,C01048914_decoy,TRY1,Decoy,0,-9.29024,-5.85,-0.56,-7.146162881911652
C[NH+](C)[C@@H](CNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)c1ccccc1Cl,C11563511_decoy,TRY1,Decoy,0,-9.7222,-6.97,-2.11,-6.587745018632257
C[NH+](C)[C@H](CNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O)c1cccc(F)c1,C11603833_decoy,TRY1,Decoy,0,-9.41135,-4.58,-1.87,-5.736342591077813
CC(C)CNC(=O)c1cc2cc(C3(O)CC[NH+](Cc4ccsc4)CC3)ccc2o1,C15005069_decoy,TRY1,Decoy,0,-9.3992,-5.26,-2.07,-5.499886057450456
C=CCOc1ccc([C@@H](Nc2cccc(C)[nH+]2)c2ccc3ccc(C)nc3c2O)cc1,C15015848_decoy,TRY1,Decoy,0,-8.17805,-8.13,-1.01,-7.32004614698245
CC(C)(O)C#Cc1ccc(C[NH+]2CCC[C@@](CO)(CCCc3ccccc3)C2)s1,C15065529_decoy,TRY1,Decoy,0,-9.66634,-6.01,-1.97,-5.841115225634102
CC(C)N1CCC([NH+]2CCN(Cc3ccc(C#CC(C)(C)O)cc3)C[C@@H]2CCO)CC1,C20776465_decoy,TRY1,Decoy,0,-9.49209,-5.58,-1.66,-6.03495072923131
CC(C)(C)NC(=O)COc1ccc(Br)cc1C[NH2+]Cc1cccs1,C20873186_decoy,TRY1,Decoy,0,-8.45919,-6.28,-1.51,-8.984791443753146
C[C@H](NC(=S)Nc1ccc(Br)cc1)[C@@H](c1ccccc1)N1CC[NH+](C)CC1,C22031377_decoy,TRY1,Decoy,0,-8.31828,-5.3,-1.55,-5.252863897264935
NS(=O)(=O)c1ccc(OCC[NH+]2CCc3sccc3[C@@H]2c2ccccc2)cc1,C24945976_decoy,TRY1,Decoy,0,-10.498,-6.92,-1.76,-7.31115517803272
CCn1c(C(F)(F)F)nc2c1CCN(C(=O)C[C@H]([NH3+])Cc1cc(F)ccc1F)C2,C28956652_decoy,TRY1,Decoy,0,-8.08713,-6.33,-1.58,-5.417903192070936
C[NH+]1CCN(c2c(Cl)cccc2NC(=S)NC(=O)/C=C/c2ccccc2)CC1,C30827319_decoy,TRY1,Decoy,0,-8.16488,-6.8,-0.81,-5.941047414055195
CC[NH+](CC)CCSc1nc(N)c(C#N)c(-c2ccc(Cl)c(Cl)c2)c1C#N,C35087238_decoy,TRY1,Decoy,0,-8.70123,-5.07,-2.63,-6.0054418545279145
CC[NH+]1CCN([C@@H](c2cccs2)[C@H](C)NC(=S)Nc2cc(C)ccc2C)CC1,C22942003_decoy,TRY1,Decoy,0,-8.0394,-6.19,-1.41,-7.481545617772251
Cc1ccc2cc(C[NH2+]Cc3cccc(C(F)(F)F)c3)c(N3CCC(O)CC3)nc2c1,C14982308_decoy,TRY1,Decoy,0,-8.26837,-7.83,-3.25,-8.331962383329419
CC[C@@H](C)CNC(=O)[C@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39605916_decoy,TRY1,Decoy,0,-9.04666,-5.64,-3.17,-6.408418999918757
CC[C@@H](C)CNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39606799_decoy,TRY1,Decoy,0,-9.3438,-7.6,-2.78,-8.400298482447226
CCCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39623298_decoy,TRY1,Decoy,0,-8.31722,-5.19,-1.01,-5.302140582680154
CCCCCNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39623299_decoy,TRY1,Decoy,0,-8.98382,-5.08,-2.0,-6.038920512350246
O=C(NCCc1ccccc1F)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39638978_decoy,TRY1,Decoy,0,-8.84855,-5.36,-1.71,-6.187048895168824
CCc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(F)cc3F)CC23CC[NH2+]CC3)cc1,C39654263_decoy,TRY1,Decoy,0,-9.30877,-8.7,-2.34,-6.6755289331489935
O=C(NCCc1cccs1)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C39657237_decoy,TRY1,Decoy,0,-8.60755,-7.86,-1.79,-7.877809551815017
O=C(NCCc1cccs1)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39657382_decoy,TRY1,Decoy,0,-8.86258,-5.58,-0.8,-5.188463662499476
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3cccs3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39657467_decoy,TRY1,Decoy,0,-9.61826,-6.22,-0.96,-7.112415272202079
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)c(C)c1,C39667154_decoy,TRY1,Decoy,0,-8.30575,-7.09,-2.67,-7.006023874757517
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)c(C)c1,C39667155_decoy,TRY1,Decoy,0,-10.1679,-8.66,-1.55,-7.0360604714268336
CCC[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39673585_decoy,TRY1,Decoy,0,-8.58874,-4.62,-3.04,-5.216637571030294
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCc2cc(C)ccc2C)C2(CC[NH2+]CC2)C1,C39676876_decoy,TRY1,Decoy,0,-8.47451,-7.63,-1.35,-6.864130743892034
Cc1ccsc1CNC(=O)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39677183_decoy,TRY1,Decoy,0,-9.44877,-7.1,-1.88,-6.289324862212354
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39686978_decoy,TRY1,Decoy,0,-8.885,-7.02,-2.82,-6.692275856387592
Cc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2F)CC12CC[NH2+]CC2,C39691173_decoy,TRY1,Decoy,0,-7.77207,-5.82,-1.89,-5.543725493116955
CC(C)(C)SCCNC(=O)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39696362_decoy,TRY1,Decoy,0,-9.04779,-6.54,-1.55,-5.918659762127782
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCSC(C)(C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39696460_decoy,TRY1,Decoy,0,-8.44403,-5.17,-2.34,-5.580677144121148
CC(C)(C)SCCNC(=O)[C@@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39696490_decoy,TRY1,Decoy,0,-9.4089,-6.67,-1.94,-6.910915860423399
[NH3+][C@@H](CSCc1ccccc1)c1nc(-c2cc(-c3ccc(Cl)cc3Cl)no2)cs1,C43251022_decoy,TRY1,Decoy,0,-11.0701,-5.56,-1.13,-7.291711878505671
C=CCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)N(C)CC=C)[C@@H](O)[C@H]1[C@@H]2C,C43548210_decoy,TRY1,Decoy,0,-9.02138,-6.91,-3.81,-6.169509618947164
C=C1CCC[C@@]2(C)C[C@H]3OC(=O)[C@H](C[NH2+]CCc4c[nH]c5ccc(OC)cc45)[C@H]3C[C@H]12,C43604534_decoy,TRY1,Decoy,0,-8.58784,-5.92,-2.33,-5.402055771627553
Cn1c(SCc2ccc(-c3snc(Cl)c3C[NH3+])cc2)nnc1C(F)(F)F,C44249939_decoy,TRY1,Decoy,0,-10.5033,-7.13,-2.22,-6.442249210934068
O=C(CNC(=O)C12CC3CC(CC(C3)C1)C2)NC[C@H](c1cccs1)[NH+]1CCCC1,C45575093_decoy,TRY1,Decoy,0,-10.3325,-7.61,-4.19,-7.960342566069152
Cc1cccc(NC(=S)N2CCC3(CC2)[NH2+]CC(=O)N3Cc2ccc(F)cc2)c1,C36024444_decoy,TRY1,Decoy,0,-7.99802,-5.95,-1.62,-5.033538626529736
COc1c(Br)cc(C[NH2+][C@]2(CO)CCC[C@H](C)C2)cc1Br,C53116739_decoy,TRY1,Decoy,0,-8.09874,-4.82,-1.89,-5.139698061081121
CCCNC(=O)C[NH+]1CCC(NC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)CC1,C29219666_decoy,TRY1,Decoy,0,-8.95011,-6.73,-1.69,-5.581177197403968
CCc1cccc(C)c1NC(=S)N(Cc1ccncc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59169925_decoy,TRY1,Decoy,0,-7.63132,-5.6,-1.31,-5.494975940258337
CC[NH+](CC)CCc1noc(-c2cc(Br)cc(Br)c2N)n1,C62825217_decoy,TRY1,Decoy,0,-7.29923,-4.84,-0.76,-4.271178800789982
C[C@H]1CC=C(C(=O)NCC(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2cccs2)S1,C63085387_decoy,TRY1,Decoy,0,-9.93169,-7.15,-1.43,-6.446804365236965
CC1(C)Cc2c(ccc3ccccc23)C(N[C@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])=[NH+]1,C63134443_decoy,TRY1,Decoy,0,-7.70428,-8.78,-1.65,-7.037574027184264
Cc1cc(C)cc(NC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(=O)c2cccs2)c1,C63182475_decoy,TRY1,Decoy,0,-8.61443,-6.46,-3.51,-6.727839335394544
O=C(/N=C(/NCCC1=c2ccccc2=[NH+]C1)Nc1ccccc1F)c1ccc(F)cc1,C65329934_decoy,TRY1,Decoy,0,-7.62901,-8.62,-0.89,-7.581967593963396
C[NH2+]CCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl,C08377001_decoy,TRY1,Decoy,0,-8.68022,-5.95,-1.51,-7.901287752430566
O[C@@H](COc1ccccc1C[NH2+]CCc1cnccn1)C[NH+]1CCSCC1,C11815745_decoy,TRY1,Decoy,0,-8.23756,-6.48,-0.93,-7.684174580425891
O[C@H](COc1ccccc1C[NH2+]CCc1cnccn1)C[NH+]1CCSCC1,C11815747_decoy,TRY1,Decoy,0,-9.20189,-5.88,-4.41,-6.995496544435794
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]C2CCSCC2)C[C@@]1(C)CO,C11843862_decoy,TRY1,Decoy,0,-8.65291,-5.03,-3.96,-5.606428471213446
CCn1cc(C[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCCCC2)cn1,C12112080_decoy,TRY1,Decoy,0,-7.51628,-6.71,-1.85,-5.955388939788821
CC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(Br)cc2Cl)o1,C13735320_decoy,TRY1,Decoy,0,-8.66714,-4.27,-1.67,-5.303670292701574
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](CC)Cc1ccncc1,C43262015_decoy,TRY1,Decoy,0,-7.19542,-4.47,-1.94,-4.996892562481137
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](CC)Cc1ccncc1,C43262018_decoy,TRY1,Decoy,0,-7.28905,-4.2,-1.85,-5.084286580454841
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N(CC[NH+](C)C)CC(C)C,C43263125_decoy,TRY1,Decoy,0,-7.22906,-4.0,-1.3,-5.216800858881478
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)N(CC[NH+](C)C)CC(C)C,C43263127_decoy,TRY1,Decoy,0,-7.49895,-3.32,-4.28,-4.46467880163102
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[NH+](C(C)(C)C)CC1,C43286672_decoy,TRY1,Decoy,0,-9.34113,-3.9,-1.25,-5.0905409286708565
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[NH+](CC2CC2)CC1,C43286824_decoy,TRY1,Decoy,0,-9.21956,-4.32,-2.3,-5.557305358683569
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[NH+](CC2CC2)CC1,C43286830_decoy,TRY1,Decoy,0,-7.76181,-4.63,-1.04,-5.205079312382219
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)C1CC[NH+](CC)CC1,C43287651_decoy,TRY1,Decoy,0,-10.1512,-4.29,-2.09,-5.855607810289653
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(CC[NH+](C)C)CC(C)C,C43287750_decoy,TRY1,Decoy,0,-9.20172,-3.36,-1.64,-5.906533884852559
CC[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](C)Cc1csc(C)n1,C44595112_decoy,TRY1,Decoy,0,-7.66197,-3.84,-2.03,-4.479484850422773
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](C)Cc1csc(C)n1,C44595249_decoy,TRY1,Decoy,0,-9.15064,-4.29,-3.81,-5.644793484393581
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)Cc1csc(C)n1,C44595259_decoy,TRY1,Decoy,0,-8.61856,-3.73,-1.67,-4.734066705789043
C[NH+](Cc1ccccc1Br)[C@@H](C[NH3+])c1ccc(Br)o1,C48892357_decoy,TRY1,Decoy,0,-7.83749,-4.18,-1.06,-4.532046826528255
C[NH+](Cc1ccccc1Br)[C@H](C[NH3+])c1ccc(Br)o1,C48892359_decoy,TRY1,Decoy,0,-7.23007,-5.42,-3.23,-5.241969023398022
COc1ccccc1C[NH+](C)[C@H](c1ccc(Br)s1)[C@H](C)[NH3+],C43261470_decoy,TRY1,Decoy,0,-7.1308,-4.61,-2.44,-4.761666763521291
CCC[NH+](C(C)C)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50361759_decoy,TRY1,Decoy,0,-8.52758,-4.02,-3.93,-5.263944241233534
CC(C)C[NH+](CC(C)C)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362013_decoy,TRY1,Decoy,0,-8.81649,-4.22,-3.79,-5.002940278447905
Cc1ccccc1C[NH+](C)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362020_decoy,TRY1,Decoy,0,-7.42349,-5.53,-1.31,-5.1973619648602485
CCC1CC[NH+]([C@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C50362097_decoy,TRY1,Decoy,0,-8.09702,-5.25,0.45,-4.973485931679374
CCC[NH+](CC1CC1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362183_decoy,TRY1,Decoy,0,-9.105,-4.64,-0.64,-5.065113005129557
CC(C)C[NH+](C1CC1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362294_decoy,TRY1,Decoy,0,-8.3763,-3.8,-3.73,-4.34565552749333
CC(C)[NH+](CC1CC1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362316_decoy,TRY1,Decoy,0,-8.60463,-3.76,-0.45,-4.884870656844051
CC(C)[NH+](CC1CC1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362319_decoy,TRY1,Decoy,0,-9.38525,-4.01,-3.28,-5.406275750102459
CCCC[NH+]([C@@H](C)CC)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362322_decoy,TRY1,Decoy,0,-7.86939,-4.77,-1.75,-7.304420780530339
[NH3+]C[C@H](c1cc(Br)c(Br)o1)[NH+]1CCC[C@@H]1C1CCCC1,C50362440_decoy,TRY1,Decoy,0,-8.95334,-4.94,-1.16,-5.045168616567147
CC(C)(C)C1CC[NH+]([C@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C50362561_decoy,TRY1,Decoy,0,-8.78665,-4.55,-0.42,-4.839697659042032
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[NH+]([C@@H](C)CC)CC1,C55063823_decoy,TRY1,Decoy,0,-10.6244,-3.86,-2.43,-6.421424269484993
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[NH+](CC(C)C)CC1,C55077198_decoy,TRY1,Decoy,0,-8.7563,-3.82,-2.18,-4.957700369641751
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[NH+](CC(C)C)CC1,C55077207_decoy,TRY1,Decoy,0,-9.97472,-4.09,-5.33,-5.904707489029768
CCOC(=O)/C(NCCC[NH+](C)C)=[NH+]\Nc1ccc(Br)cc1,C33402627_decoy,TRY1,Decoy,0,-8.30473,-5.1,-4.54,-5.68535497500187
[NH3+]C[C@H](c1ccc(Br)s1)N1CCC(C[NH+]2CCCC2)CC1,C62037984_decoy,TRY1,Decoy,0,-8.56547,-4.47,-1.19,-5.488016342162596
[NH3+]C[C@@H](c1ccc(Br)s1)N1CCC(C[NH+]2CCCC2)CC1,C62037985_decoy,TRY1,Decoy,0,-9.15136,-4.66,-1.6,-5.407905045399288
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[C@H]([NH+](CC)CC)C1,C62977137_decoy,TRY1,Decoy,0,-9.18843,-4.71,-3.46,-6.255693410281445
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[C@H]([NH+](CC)CC)C1,C62977139_decoy,TRY1,Decoy,0,-9.15723,-4.01,-3.12,-5.876502390127092
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[C@H]([NH+](CC)CC)C1,C62977140_decoy,TRY1,Decoy,0,-8.80283,-4.16,-2.1,-5.389911803539792
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[C@H]([NH+](CC)CC)C1,C62977142_decoy,TRY1,Decoy,0,-8.58453,-3.8,-1.52,-5.012980797822717
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[C@H]([NH+]2CCCC2)C1,C62977491_decoy,TRY1,Decoy,0,-8.68176,-4.19,-0.81,-5.025461165267217
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[C@H]([NH+]2CCCC2)C1,C62977494_decoy,TRY1,Decoy,0,-8.45528,-4.52,0.6,-5.072573912028018
C[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[C@H]([NH+]2CCCCC2)C1,C62977712_decoy,TRY1,Decoy,0,-8.85743,-4.53,-0.96,-5.253280656264449
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)N(C)CC1CC[NH+](C)CC1,C63119935_decoy,TRY1,Decoy,0,-10.124,-4.71,-0.84,-6.057199385589156
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N(C)CC1CC[NH+](C)CC1,C63119936_decoy,TRY1,Decoy,0,-9.05292,-5.45,-2.4,-5.266318929182658
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)CC1CC[NH+](C)CC1,C63119942_decoy,TRY1,Decoy,0,-9.26329,-4.29,-0.81,-6.0309713016256605
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccccc2I)CC1,C67122167_decoy,TRY1,Decoy,0,-8.93825,-5.12,-1.75,-4.625240160363206
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCCC[NH+](C)C(C)C)c2C1,C67556950_decoy,TRY1,Decoy,0,-7.96853,-5.56,-2.23,-5.207040740552525
Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccccc1)c1c(ncn(CC[NH+]3CCOCC3)c1=[NH2+])O2,C09583761_decoy,TRY1,Decoy,0,-8.18145,-8.16,-3.34,-10.06983352309193
Cc1csc(C[NH+](C)Cc2ccccc2OC[C@@H](O)C[NH+]2CCSCC2)n1,C11878800_decoy,TRY1,Decoy,0,-6.55731,-6.06,-4.68,-6.454731985198138
Cc1csc(C[NH+](C)Cc2ccccc2OC[C@H](O)C[NH+]2CCSCC2)n1,C11878801_decoy,TRY1,Decoy,0,-7.47007,-5.28,-3.06,-5.058060116268399
Cc1nnc(C[NH+](C)Cc2ccc(OC[C@H](O)C[NH+]3CCc4ccccc4C3)cc2)o1,C12297551_decoy,TRY1,Decoy,0,-7.66524,-6.16,-4.59,-5.581202910324167
COc1ccc(C[NH2+]Cc2cc(C)n(C)n2)cc1OC[C@H](O)C[NH+](C)C(C)C,C12459193_decoy,TRY1,Decoy,0,-7.22199,-5.91,-2.04,-5.63909070113111
COc1cc(C[NH2+]Cc2nccn2C)ccc1OC[C@H](O)C[NH+]1CCSCC1,C12303136_decoy,TRY1,Decoy,0,-8.464,-5.6,-3.05,-6.724527628307128
O[C@@H](COc1cccc(C[NH2+]Cc2cn3ccsc3n2)c1)C[NH+]1CCOCC1,C12444826_decoy,TRY1,Decoy,0,-8.46736,-6.43,-1.68,-7.091097656486856
Cc1nonc1C[NH+](C)Cc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1,C19225167_decoy,TRY1,Decoy,0,-8.35343,-6.25,-3.06,-5.426288338311016
COc1ccc(C[NH2+]CC(C)(C)OC)cc1OC[C@@H](O)CN1CC[NH+](C)CC1,C20540263_decoy,TRY1,Decoy,0,-8.10128,-5.73,-2.0,-5.855731424775035
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH+](C)Cc3cnccn3)c2)CC1,C20779032_decoy,TRY1,Decoy,0,-8.26423,-6.96,-1.04,-8.235371633388043
Cc1nc(N2CCC(Cn3cc(C[NH+]4CCNC(=O)[C@H]4C)nn3)CC2)c(C)c[nH+]1,C23129227_decoy,TRY1,Decoy,0,-8.19808,-7.82,-2.85,-6.064305437012013
Cc1[nH+]ccn1CCN(C)C(=O)C[C@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1,C23153381_decoy,TRY1,Decoy,0,-7.49301,-7.14,-1.28,-6.560561724884341
CN1CCN(C(=O)CC[C@H]2CNC(=O)[C@@H]3[C@@H](CC[NH+]3Cc3ccc(CO)o3)[NH+]2C)CC1,C30879596_decoy,TRY1,Decoy,0,-8.73819,-7.66,-1.15,-8.384543184609377
CNC(=O)c1cc2c(=O)n3cc(C)ccc3nc2[n+](CCCn2cc[nH+]c2)c1N,C06565445_decoy,TRY1,Decoy,0,-6.37434,-5.29,-2.38,-4.2854873892336425
CC(C)[NH+](C)C[C@H](O)CN1CC[NH+](Cc2nc(C(=O)N3CCCC[C@@H]3C)co2)CC1,C35839611_decoy,TRY1,Decoy,0,-8.49364,-5.65,-3.05,-5.347203277695493
CC[NH+](CC)CC[n+]1c(N)n(CCOc2ccc(Cl)cc2)c2ccccc21,C36058314_decoy,TRY1,Decoy,0,-8.01591,-6.65,-0.8,-7.746002939442917
C[C@H](O)C[NH+](CCN(C)C)Cc1c(-c2ccccc2)noc1N1CC[NH+](C)CC1,C36313512_decoy,TRY1,Decoy,0,-6.82205,-4.92,-1.46,-5.408935599655359
C[NH+]1CCN(c2onc(-c3ccccc3)c2C[NH+](C[C@H](O)CN2CCOCC2)C[C@@H]2CCCO2)CC1,C36313518_decoy,TRY1,Decoy,0,-8.02284,-7.08,-1.89,-8.966531912084779
CCOC(=O)N1CC[N+](=c2c(O)c(O)/c2=N\CC[NH+]2CCCC[C@@H]2CC)CC1,C36095695_decoy,TRY1,Decoy,0,-8.50748,-6.67,-3.6,-5.697847113955347
CCOC(=O)[C@@H]1[NH+]=c2ccc(OC)cc2=C1NC(=O)C[NH+](C)CC1OCCO1,C38592685_decoy,TRY1,Decoy,0,-7.65828,-6.13,-2.43,-7.8722773633562015
CC[NH+]1CCN(CC(=O)NC2=c3cc(OC)c(OC)cc3=[NH+][C@H]2C(=O)OC)CC1,C38604952_decoy,TRY1,Decoy,0,-8.44119,-6.49,-0.65,-6.193340513947207
CN1C(NC[C@@H]2C=CC=[NH+]2)=[NH+][C@H]2[C@H]1C(=O)N(Cc1ccccc1Cl)C(=O)N2C,C38701845_decoy,TRY1,Decoy,0,-6.62534,-5.26,-0.78,-4.680576172400042
CCn1cc[nH+]c1CN(C)C(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1cccc(OC)c1OC,C39388023_decoy,TRY1,Decoy,0,-7.47096,-6.56,-3.48,-5.739858976636188
COc1ccc([C@@H]2[NH+]=NC=C2C[NH2+]C[C@H](c2ccncc2)N2CCOCC2)c(F)c1,C39420679_decoy,TRY1,Decoy,0,-8.11855,-7.77,-2.8,-6.8306141154892925
CC[NH+]1CCN(C[C@H](O)COc2cccc(C[NH2+]CCN3CCCC3=O)c2)CC1,C23359592_decoy,TRY1,Decoy,0,-8.43165,-6.12,-3.57,-5.438250336180457
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)C2CCN(C(C)=O)CC2)CC12CC[NH2+]CC2,C39626891_decoy,TRY1,Decoy,0,-8.73812,-4.61,-3.45,-6.304910810607009
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCCn3cc[nH+]c3)C3(CC[NH2+]CC3)C2)nn1C,C39630517_decoy,TRY1,Decoy,0,-8.20404,-6.66,-1.56,-6.871415681342257
COCCC(=O)N1C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39634910_decoy,TRY1,Decoy,0,-8.49703,-4.64,-1.44,-5.5018152147388655
COc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)c3cncn3C)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663959_decoy,TRY1,Decoy,0,-9.15976,-5.67,-1.91,-6.095754157047118
Cc1ccc2c(c1)=[NH+]C(=O)[C@H](C[NH+](CCO)Cc1nnnn1C1CCCC1)C=2,C39697463_decoy,TRY1,Decoy,0,-6.91639,-7.11,-1.55,-6.142010633652932
C[NH+](CC(=O)NCC1([NH+]2CCSCC2)CCCC1)[C@@H]1CCS(=O)(=O)C1,C41423398_decoy,TRY1,Decoy,0,-9.13257,-4.11,-2.98,-5.421124556574581
CC[NH+](CC)CCOc1ccccc1NC(=O)C(=O)NC[C@H](C)[NH+]1CCCC1,C41596708_decoy,TRY1,Decoy,0,-7.21326,-5.81,-2.12,-6.484072732926147
C[C@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)[NH+]1CCC(C[NH+]2CCCCCC2)CC1,C48564003_decoy,TRY1,Decoy,0,-8.23105,-5.36,-1.97,-5.268145664957157
C[NH+]1[C@@H](CCC(=O)N2CCCC2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1csnn1,C35442392_decoy,TRY1,Decoy,0,-7.15946,-6.54,-1.68,-6.28847025484462
Cc1ccc([C@H]2c3ccc4ccccc4c3Oc3nc[n+](CCCn4cc[nH+]c4)c(N)c32)cc1,C09187660_decoy,TRY1,Decoy,0,-7.30762,-7.16,-0.69,-5.710100396911566
CC[NH+](CC)CCC[n+]1cnc2c(c1N)[C@H](c1ccco1)c1ccc3ccccc3c1O2,C49748078_decoy,TRY1,Decoy,0,-7.08347,-5.36,-1.93,-5.044394822903437
CC[NH+]1CCN(C(=O)[C@@H](C)N2CC[NH+](Cc3nc4sc5c(c4c(=O)[nH]3)CCCC5)CC2)CC1,C22912223_decoy,TRY1,Decoy,0,-9.78521,-7.47,-2.48,-6.510655332241499
Oc1c(O)/c(=N\CCCn2cc[nH+]c2)c1=[N+]1CCN(c2ccc(F)cc2)CC1,C61721419_decoy,TRY1,Decoy,0,-8.66132,-6.71,-1.75,-6.242576068948822
CC1CCN(C2=[NH+][C@H]3[C@@H](C(=O)N=C([O-])N3C)N2CCSC2[NH+]=c3ccccc3=[NH+]2)CC1,C63205834_decoy,TRY1,Decoy,0,-8.11417,-5.67,-2.94,-6.103797364884836
C[C@@]12C(=O)N(/N=C/C(=O)NCCC3=c4ccccc4=[NH+]C3)CC(=O)N1CCC1=c3ccccc3=[NH+][C@@H]12,C63271175_decoy,TRY1,Decoy,0,-7.95299,-8.87,-2.13,-6.995044132068699
O=C1C[C@H]([NH2+]CCC2=c3ccccc3=[NH+]C2)C(=O)N1c1ccc2c(c1)OCCO2,C63330614_decoy,TRY1,Decoy,0,-8.27509,-8.67,-1.17,-7.220206413405195
COc1cc(N2C(=O)C[C@H]([NH2+]CCC3=c4ccccc4=[NH+]C3)C2=O)cc(OC)c1OC,C63486337_decoy,TRY1,Decoy,0,-7.16277,-7.7,-3.06,-6.966349982269535
COc1cc2c(cc1OC)=C(O)[C@H](C(=O)NCCCN1CC[NH+](C)CC1)C(=O)[NH+]=2,C22866626_decoy,TRY1,Decoy,0,-8.43269,-5.97,-1.29,-5.70329401154249
O=C(NC1CCCCCC1)C1=C([O-])[C@@H](C(=O)NCC2[NH+]=c3ccccc3=[NH+]2)C=[N+](C2CC2)C1,C64053325_decoy,TRY1,Decoy,0,-8.10924,-9.17,-1.51,-8.323803043416376
CN1C([O-])=NC(=O)[C@@H]2[C@@H]1[NH+]=C(N1CCCC1)N2CCSC1[NH+]=c2ccccc2=[NH+]1,C63205821_decoy,TRY1,Decoy,0,-7.7672,-7.91,-2.97,-11.740936411690834
Cn1ccnc1[C@@H](NS(=O)(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2)c1ccc(F)cc1,C64169772_decoy,TRY1,Decoy,0,-8.67669,-7.78,-2.67,-11.19958860813071
COc1ccc2c(c1)=[NH+][C@@H](C(=O)N1CCC(CC(=O)NCCCN3CC[NH+](C)CC3)CC1)C=2,C64540852_decoy,TRY1,Decoy,0,-9.61668,-7.16,-3.18,-6.435690673458307
COc1cc(C(=O)N[C@@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc(OC)c1OC,C65305763_decoy,TRY1,Decoy,0,-7.11469,-5.89,-4.1,-4.905418842072313
CN(C(=O)OC(C)(C)C)C1(C)CC[NH+](C[C@H](O)CN2CC[NH+](C)CC2)CC1,C66666734_decoy,TRY1,Decoy,0,-6.78769,-6.25,-1.77,-4.646384981411365
CC[NH+]1CCN(C(=O)CC2CCN(C[C@@H](O)C[NH+]3CCC(C)CC3)CC2)CC1,C66666873_decoy,TRY1,Decoy,0,-8.47891,-5.66,-1.45,-5.959522343264314
C[C@H]1CN(C(=[NH2+])NS(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@H](C)O1,C01048894_decoy,TRY1,Decoy,0,-8.35058,-6.36,-2.12,-6.096532875710432
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1c(F)cccc1Cl)NCc1nc2c(s1)CCCC2,C11704011_decoy,TRY1,Decoy,0,-10.1679,-7.48,-1.8,-8.13086813326102
COC(=O)[C@@H]1C[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c23)C[NH+]1Cc1cc(F)ccc1F,C12204756_decoy,TRY1,Decoy,0,-8.04304,-6.12,-2.04,-5.068626012490378
Cc1cc(C)c2cc(CN(Cc3ccccc3)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2c1,C06301475_decoy,TRY1,Decoy,0,-7.63035,-6.43,-2.65,-6.7797719968322125
CC[NH+]1CCC[C@@H]1CN(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)Nc1ccc(F)cc1,C12646246_decoy,TRY1,Decoy,0,-7.8321,-6.85,-0.01,-6.955637124807053
CC[NH+]1CCC[C@H]1CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)Nc1ccc(F)cc1,C12711730_decoy,TRY1,Decoy,0,-8.03903,-7.89,-2.9,-7.400339666817729
CCc1ccc(NC(=S)N(CC[NH+](C)C)Cc2cc3cc(CC)ccc3[nH]c2=O)cc1,C12715339_decoy,TRY1,Decoy,0,-8.06314,-5.09,-2.49,-5.1295941272102805
C[C@@H]1CCC[NH+](Cc2csc(NC(=O)CNC(=O)c3ccc(Cl)cc3Cl)n2)C1,C12759724_decoy,TRY1,Decoy,0,-10.3983,-8.02,-2.06,-8.576862600390822
CSCC[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C12882881_decoy,TRY1,Decoy,0,-9.20092,-6.0,-4.08,-5.384567935612707
CSCC[C@@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C12882889_decoy,TRY1,Decoy,0,-8.71515,-6.81,-1.54,-5.924686286713921
CCc1sc(C(=O)NCC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)cc1C,C12933187_decoy,TRY1,Decoy,0,-8.69273,-7.95,-1.77,-7.722888456890883
C[C@H]1C[C@H](C)C[NH+](Cc2csc(NC(=O)CNC(=O)c3ccc(Cl)cc3Cl)n2)C1,C13016338_decoy,TRY1,Decoy,0,-10.2326,-6.9,-1.02,-6.969652999203909
CC[NH+](CC(=O)Nc1cc(Cl)ccc1C)Cc1nc2sc3c(c2c(=O)[nH]1)CCC3,C16557557_decoy,TRY1,Decoy,0,-9.36435,-4.96,-1.82,-6.02136709224875
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)Cc2ccccc2Br)c(C)c1,C16562721_decoy,TRY1,Decoy,0,-7.77211,-7.44,-2.83,-6.019424559312282
COc1ccc(C[NH+]2CCN(Cc3cc(=O)c4ccccc4[nH]3)C[C@@H]2CCO)c(C)c1C,C20916128_decoy,TRY1,Decoy,0,-8.57281,-6.18,-1.78,-6.195815522553915
Cc1ccc(NC(=O)C(=O)NCCN2CC[NH+](Cc3ccccc3F)CC2)cc1Cl,C22797773_decoy,TRY1,Decoy,0,-9.08403,-6.47,-3.27,-6.01440125502482
NC(=O)[C@H](c1ccc(Cl)cc1)N1CC[NH+](CC(=O)N2CCS[C@H]2c2ccccc2F)CC1,C22928841_decoy,TRY1,Decoy,0,-7.7021,-6.62,-2.0,-6.109607785043319
NC(=O)[C@@H](c1ccc(Cl)cc1)N1CC[NH+](CC(=O)N2CCS[C@H]2c2ccccc2F)CC1,C22928846_decoy,TRY1,Decoy,0,-7.52001,-6.9,-1.81,-5.389529976717182
O=C(CNC(=O)c1ccccc1Br)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C33024198_decoy,TRY1,Decoy,0,-8.68195,-7.71,-1.91,-7.011208483549526
CN1CCc2cc([C@@H](CNC(=O)Nc3ccccc3C(F)(F)F)N3CC[NH+](C)CC3)ccc21,C38672703_decoy,TRY1,Decoy,0,-9.57919,-6.18,-1.87,-6.080176651902535
C[C@@H](O)CN(C[C@@H](C)O)C(=O)c1ccc(-c2ccc3c(c2)CCC2(CC[NH+](C)CC2)O3)cc1,C39227705_decoy,TRY1,Decoy,0,-8.284,-7.85,-1.68,-7.032890643831896
C[C@H](CNC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39596096_decoy,TRY1,Decoy,0,-9.48976,-7.91,-1.25,-7.496530279635086
CC(C)CCNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39601114_decoy,TRY1,Decoy,0,-9.01669,-5.42,-1.88,-5.635384921864537
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3ccc(C)c(C)c3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39609330_decoy,TRY1,Decoy,0,-9.86941,-5.37,-3.42,-6.065844522241782
CC[C@@H](COC)NC(=O)[C@@H]1CN(C(=O)c2c(Cl)ccc(C)c2F)CC12CC[NH2+]CC2,C39638047_decoy,TRY1,Decoy,0,-8.34977,-5.7,-3.62,-5.496859466687317
CC[C@H](COC)NC(=O)[C@@H]1CN(C(=O)c2c(Cl)ccc(C)c2F)CC12CC[NH2+]CC2,C39638048_decoy,TRY1,Decoy,0,-7.46084,-5.08,-1.83,-4.968784531841181
O=C(NCCc1cccs1)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39657394_decoy,TRY1,Decoy,0,-10.7843,-7.53,-2.38,-7.605354352139526
Cc1ccsc1C(=O)N1C[C@H](C(=O)NCCSCc2ccccc2)C2(CC[NH2+]CC2)C1,C39658733_decoy,TRY1,Decoy,0,-8.42202,-5.9,-3.22,-5.767084423436189
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2)Oc1ccccc1Cl,C39666339_decoy,TRY1,Decoy,0,-8.94903,-8.33,-1.03,-6.827909450888723
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3cc(C)oc3C(F)(F)F)CC23CC[NH2+]CC3)c(C)c1,C39667140_decoy,TRY1,Decoy,0,-9.52787,-7.88,-4.36,-6.867003931037698
O=C(NCCc1ccco1)[C@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39670925_decoy,TRY1,Decoy,0,-9.10601,-6.41,-1.84,-6.059519377439706
Cc1ccc(F)cc1C(=O)N1C[C@H](C(=O)NCCOc2ccccc2Cl)C2(CC[NH2+]CC2)C1,C39681339_decoy,TRY1,Decoy,0,-9.3675,-7.5,-3.2,-6.900215154322372
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCOc2ccccc2Cl)C2(CC[NH2+]CC2)C1,C39681400_decoy,TRY1,Decoy,0,-10.1664,-8.0,-1.35,-7.682466479280203
O=C(NCCOc1ccccc1F)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39685049_decoy,TRY1,Decoy,0,-9.7797,-8.03,-0.97,-7.126708803447862
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCOc3ccccc3F)C3(CC[NH2+]CC3)C2)c(C)c1,C39685189_decoy,TRY1,Decoy,0,-8.71655,-5.67,-1.82,-6.305197895404164
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C39686355_decoy,TRY1,Decoy,0,-8.13905,-8.16,-2.5,-7.300781943872672
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39686583_decoy,TRY1,Decoy,0,-8.80434,-8.12,-1.15,-7.20819628462958
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)c2sccc2C)CC12CC[NH2+]CC2,C39686746_decoy,TRY1,Decoy,0,-9.33416,-6.95,-0.78,-6.115376989542662
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2sccc2C)CC12CC[NH2+]CC2,C39686748_decoy,TRY1,Decoy,0,-9.08063,-6.03,-1.4,-6.37727614342691
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39686781_decoy,TRY1,Decoy,0,-9.79848,-8.14,-1.16,-7.67500880656193
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCc2cccc(Cl)c2C)C2(CC[NH2+]CC2)C1,C39695103_decoy,TRY1,Decoy,0,-10.1123,-7.38,-3.91,-8.905046861145534
CC(C)(C)SCCNC(=O)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39696374_decoy,TRY1,Decoy,0,-8.45062,-6.49,-1.92,-5.27183313760376
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCSC(C)(C)C)C3(CC[NH2+]CC3)C2)cc1F,C39696442_decoy,TRY1,Decoy,0,-8.34304,-6.3,-1.03,-5.912052437107919
CC(C)[NH+]1CCC(NC(=O)[C@H](C)SCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC1,C12780742_decoy,TRY1,Decoy,0,-10.5335,-5.21,-2.99,-6.041368571065525
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N(C)Cc3c(F)cccc3Cl)sc2[nH+]1,C14151964_decoy,TRY1,Decoy,0,-7.87283,-8.42,-2.57,-7.274986275242944
CC1CC[NH+](Cc2csc(NC(=O)[C@H](NC(=O)c3ccccc3F)C(C)C)n2)CC1,C22291424_decoy,TRY1,Decoy,0,-9.4522,-7.65,-3.41,-9.242142225480594
CC(=O)N[C@H](CC(=O)N[C@@H]1N=C(C2=c3ccccc3=[NH+][C@@H]2C)CS1)c1ccc(C)cc1,C64008887_decoy,TRY1,Decoy,0,-7.85338,-9.47,-1.98,-7.735590629908905
CCCNC(=O)C1CCN(C(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)[C@@H]2CC=CS2)CC1,C64202771_decoy,TRY1,Decoy,0,-8.37249,-7.42,-3.09,-6.315357483024096
CC1=C(S(=O)(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2ccccc2Cl)[C@@H](C)ON1,C64713479_decoy,TRY1,Decoy,0,-7.29517,-7.77,-1.98,-7.623443205868461
O=C([O-])[C@H]1[C@H](C[NH2+]CCC2=c3ccccc3=[NH+]C2)c2ccccc2N1Cc1ccccc1F,C65321672_decoy,TRY1,Decoy,0,-6.81689,-6.66,-1.64,-5.075695663399369
O=C1c2c(O)cccc2[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2cc(CO)cc(O)c21,C03871474_decoy,TRY1,Decoy,0,-7.78688,-7.68,-1.13,-6.002734074960292
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C04095725_decoy,TRY1,Decoy,0,-8.78139,-6.29,-2.76,-5.504501808695519
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C04349242_decoy,TRY1,Decoy,0,-8.46443,-7.99,-3.11,-6.728745277561609
COc1cc(-c2cc(=O)c3c(O)cc(O)c([C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c3o2)ccc1O,C05046093_decoy,TRY1,Decoy,0,-7.66597,-6.0,-2.57,-4.967264394143379
O=c1c(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc2)coc2cc(O)cc(O)c12,C06143121_decoy,TRY1,Decoy,0,-9.03624,-8.89,-1.9,-6.278013003128424
Nc1ncnc2c1nc(N/N=C/c1ccc3ccccc3n1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636793_decoy,TRY1,Decoy,0,-8.52156,-8.66,-1.92,-8.91860895807683
C[C@@]1(O[C@]2(C)[C@@](C)(CO)O[C@@H](O)[C@@]2(C)O)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915783_decoy,TRY1,Decoy,0,-5.14186,-6.88,-1.59,-5.1384230544266725
Nc1ncnc2c1nc(N/N=C/c1ccnc3ccccc13)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975221_decoy,TRY1,Decoy,0,-7.64533,-7.31,-1.9,-7.322039432441514
Nc1ncnc2c1nc(N/N=C/c1ccnc3ccccc13)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975222_decoy,TRY1,Decoy,0,-8.05536,-6.19,-1.39,-4.850579481914383
Nc1ncnc2c1nc(N/N=C/c1ccnc3ccccc13)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975224_decoy,TRY1,Decoy,0,-7.83202,-7.23,-2.03,-6.82956457262652
C[C@@H]1O[C@](O)(CO)[C@@](C)(O)[C@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)[C@]1(C)O,C12358935_decoy,TRY1,Decoy,0,-5.93432,-5.74,-4.56,-5.369700382789052
C[C@H]1O[C@](O)(CO)[C@@](C)(O)[C@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)[C@]1(C)O,C12358936_decoy,TRY1,Decoy,0,-4.40663,-5.03,-2.63,-3.457339141522384
C[C@@H]1O[C@](O)(CO)[C@](C)(O)[C@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)[C@]1(C)O,C12358937_decoy,TRY1,Decoy,0,-5.01255,-6.09,-2.47,-4.358482124407908
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(C[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C12374687_decoy,TRY1,Decoy,0,-7.78976,-7.73,-3.32,-6.418058959705352
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(C[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C12374688_decoy,TRY1,Decoy,0,-6.63792,-6.88,-2.67,-4.8940087399846215
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(C[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C12374690_decoy,TRY1,Decoy,0,-8.07916,-6.39,-2.24,-5.215377946924654
Nc1ncnc2c1nc(N/N=C/c1ccnc3ccccc13)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C08918577_decoy,TRY1,Decoy,0,-8.25461,-8.66,-1.38,-9.130676823641023
CC1(C)CC(Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC(C)(C)N1O,C05389551_decoy,TRY1,Decoy,0,-7.48473,-8.04,-1.74,-7.300481524956984
CC1(C)CC(Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC(C)(C)N1O,C05389552_decoy,TRY1,Decoy,0,-7.67636,-5.22,-2.43,-4.930978618446628
Nc1ncnc2c1nc(N/N=C/c1ccnc3ccccc13)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08637258_decoy,TRY1,Decoy,0,-8.12955,-8.25,-1.66,-7.008453262730837
O=C1c2c(O)cccc2[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C13783526_decoy,TRY1,Decoy,0,-7.18136,-7.32,-3.14,-5.574406982358035
O=c1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C14684605_decoy,TRY1,Decoy,0,-9.00865,-9.39,-1.79,-7.994160168796943
O=C1c2c(O)cccc2[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C14984476_decoy,TRY1,Decoy,0,-6.6931,-9.84,-2.25,-8.003454228507508
O=C1c2c(O)cccc2[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C14984478_decoy,TRY1,Decoy,0,-8.72307,-8.53,-1.32,-6.652265172437195
Cc1ccc(NC=C2C(=O)NC(=S)NC2=O)cc1NC=C1C(=O)NC(=S)NC1=O,C03066977_decoy,TRY1,Decoy,0,-8.67586,-7.4,-3.67,-6.002576456078631
Nc1nc2c(nc(N/N=C/c3ccc(Cl)cc3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16400369_decoy,TRY1,Decoy,0,-8.65796,-9.6,-1.65,-11.34945819899019
Nc1nc2c(nc(N/N=C/c3ccc(Cl)cc3)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16400375_decoy,TRY1,Decoy,0,-7.56593,-8.46,-3.05,-9.713857623794494
COc1nc(O)c(I)c(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)n1,C16952379_decoy,TRY1,Decoy,0,-7.19498,-4.93,-2.97,-4.172024162506284
O=C(Nc1cn([C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O)NC12CC3CC(CC(C3)C1)C2,C28294789_decoy,TRY1,Decoy,0,-7.62003,-6.65,-2.64,-5.495724681527848
O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C28540146_decoy,TRY1,Decoy,0,-9.59653,-8.82,-2.18,-8.469881374014527
O=C1c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2O[C@@H]1c1ccc(O)c(O)c1,C13424737_decoy,TRY1,Decoy,0,-8.48164,-9.69,-3.18,-7.949245631220868
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c21,C35456722_decoy,TRY1,Decoy,0,-6.83906,-7.48,-1.55,-6.633229370284018
O=c1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C36227892_decoy,TRY1,Decoy,0,-7.46158,-9.16,-2.78,-7.661633590904469
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C02008889_decoy,TRY1,Decoy,0,-8.05359,-8.52,-2.01,-7.420792773278695
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C\N[C@H]3[C@H](O)[C@H](O)[C@H](CO)O[C@@H]3O)C2=O)cc1,C35423034_decoy,TRY1,Decoy,0,-8.21228,-6.09,-1.48,-5.301876300952035
O=C1c2c(O)cccc2[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C40435394_decoy,TRY1,Decoy,0,-7.43657,-7.71,-1.46,-5.706458617439966
O=C1c2ccc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c2O[C@H]1c1ccc(O)c(O)c1,C43465456_decoy,TRY1,Decoy,0,-8.82261,-8.7,-3.36,-6.592612354177647
C[C@@H]1O[C@](O)(CO)[C@](C)(O)[C@@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@](C)(O)[C@]2(C)O)[C@]1(C)O,C43509402_decoy,TRY1,Decoy,0,-4.54942,-6.82,-2.4,-5.173128915752123
C[C@@H]1O[C@](O)(CO)[C@@](C)(O)[C@@](C)(O[C@@H]2O[C@@H](CO)[C@@](C)(O)[C@](C)(O)[C@]2(C)O)[C@]1(C)O,C43509407_decoy,TRY1,Decoy,0,-5.82046,-6.83,-4.32,-4.903631388845175
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc(O)c12,C44020461_decoy,TRY1,Decoy,0,-8.56586,-8.23,-4.27,-7.109627156105081
COc1ccc([C@@H]2C(C#N)=C(N)NC(S[C@@H]3O[C@H](O)[C@H](O)[C@H](O)[C@H]3O)=C2C#N)cc1,C49046527_decoy,TRY1,Decoy,0,-5.84836,-5.53,-2.04,-4.281199930271255
COc1ccc([C@H]2C(C#N)=C(N)NC(S[C@@H]3O[C@H](O)[C@H](O)[C@H](O)[C@H]3O)=C2C#N)cc1,C49046531_decoy,TRY1,Decoy,0,-6.0165,-7.07,-1.87,-4.983883630185043
COc1ccc(-c2c(C#N)c(N)nc(S[C@@H]3O[C@H](O)[C@H](O)[C@H](O)[C@H]3O)c2C#N)cc1,C49068048_decoy,TRY1,Decoy,0,-5.81375,-6.89,-2.76,-4.768465007269599
CC1=C2C[C@@](O)(C(C)(C)O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H](C)[C@@H]2CC1=O,C49181187_decoy,TRY1,Decoy,0,-7.64948,-6.3,-3.59,-5.24940210526659
CC1=C2C[C@@](O)(C(C)(C)O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@H](C)[C@@H]2CC1=O,C49181190_decoy,TRY1,Decoy,0,-7.83981,-5.43,-4.6,-5.074834192084512
CC1=C2C[C@@](O)(C(C)(C)O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H](C)[C@@H]2CC1=O,C49181193_decoy,TRY1,Decoy,0,-6.13277,-5.6,-4.57,-4.673544291606505
COc1ccc([C@@H]2C(C#N)=C(N)NC(S[C@@H]3O[C@H](O)[C@@H](O)[C@H](O)[C@H]3O)=C2C#N)cc1,C49793829_decoy,TRY1,Decoy,0,-7.09357,-5.94,-2.88,-4.726319384190708
O=C1c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2O[C@H]1c1ccc(O)c(O)c1,C13424736_decoy1,TRY1,Decoy,0,-7.65365,-6.89,,-5.967548995119763
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C/N[C@H]3[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]3O)C2=O)cc1,C26787902_decoy,TRY1,Decoy,0,-7.61193,-8.39,-1.53,-6.394602769830695
O=C1c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2O[C@@H]1c1ccc(O)c(O)c1,C13424736_decoy2,TRY1,Decoy,0,-7.88955,-9.56,,-7.720085608302017
C=C1N[N+](c2ccccc2)=C(C)[C@H]1c1cc(C(=O)N/N=C\c2cc(Br)ccc2O)n[nH]1,C01820589_decoy,TRY1,Decoy,0,-8.33761,-6.1,-1.61,-5.021693721379948
O=C1[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C08791168_decoy,TRY1,Decoy,0,-8.63207,-8.02,-1.85,-6.369233397273076
O=C(C[NH+]1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1)NC(=O)Nc1ccc2c(c1)OCCO2,C09076815_decoy,TRY1,Decoy,0,-9.24143,-7.77,-2.41,-6.273175691605814
C[NH+]1CCc2c(sc(NC(=O)[C@H]3CCCN(S(=O)(=O)c4ccc(Cl)s4)C3)c2C(N)=O)C1,C10751907_decoy,TRY1,Decoy,0,-10.1943,-6.2,-1.53,-5.9914566831464455
Cn1c(=O)[nH]c(=O)c2c1nc(N1CC[NH+](CC(N)=O)CC1)n2Cc1ccc(Br)cc1,C09714480_decoy,TRY1,Decoy,0,-8.06121,-6.83,-0.96,-6.690123536152319
COC(=O)C/[NH+]=C/[C@]12CC[C@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C12660293_decoy,TRY1,Decoy,0,-9.47952,-7.92,-2.61,-6.568914893583122
CC1(C)C[C@H](NC(=O)c2ccc(C[NH+]3CCC(O)(c4ccc(Cl)cc4)CC3)[nH]c2=O)CCO1,C15071920_decoy,TRY1,Decoy,0,-10.4499,-7.75,-2.31,-6.192915582793127
COCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@]3(C(=O)Nc4c(C)cc(C)cc43)[C@H]2C1=O,C08971324_decoy,TRY1,Decoy,0,-8.32791,-7.91,-1.86,-7.135587532018606
C[NH+](C)CCNC(=O)[C@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccc(Cl)cc1,C03670443_decoy,TRY1,Decoy,0,-7.61843,-5.97,-1.56,-5.675071258562347
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/NCCC1=c2cc(O)ccc2=[NH+]C1,C38688776_decoy,TRY1,Decoy,0,-9.54716,-8.26,-2.52,-6.553838232850355
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)CC1,C39656007_decoy,TRY1,Decoy,0,-8.84896,-7.78,-2.05,-6.537597196030982
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@H](C(F)(F)F)O1,C39671551_decoy,TRY1,Decoy,0,-9.09506,-7.34,-1.14,-6.143491683463002
Cn1cncc1C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676530_decoy,TRY1,Decoy,0,-9.15657,-7.95,-0.95,-6.543005302780142
Cn1cncc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676531_decoy,TRY1,Decoy,0,-10.6987,-6.53,-2.08,-6.193050211079069
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(-c3ccccc3Cl)noc2C)CC12CC[NH2+]CC2,C39683881_decoy,TRY1,Decoy,0,-8.07692,-7.45,-1.94,-6.103011776288953
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)[C@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)c[nH]c12,C39684197_decoy,TRY1,Decoy,0,-9.06411,-9.23,-1.33,-7.350242002133712
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685687_decoy,TRY1,Decoy,0,-9.86683,-6.32,-2.17,-7.244237970655275
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)ccc1F,C39685805_decoy,TRY1,Decoy,0,-7.90994,-6.46,-2.98,-6.175329787692359
O=C(N/N=C/C1=c2cc(Br)ccc2=[NH+]C1)C(=O)N[C@H]1NN=C(c2ccccc2)S1,C39944218_decoy,TRY1,Decoy,0,-9.50478,-7.25,-1.46,-7.099442543066833
Cc1cc(C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44713573_decoy,TRY1,Decoy,0,-7.92068,-8.81,-1.35,-6.280017526725026
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C44713589_decoy,TRY1,Decoy,0,-9.79278,-9.87,-1.17,-7.736687726789196
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CC12CC[NH2+]CC2,C44713673_decoy,TRY1,Decoy,0,-7.83428,-8.07,-2.44,-5.915560966928929
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CC12CC[NH2+]CC2,C44713675_decoy,TRY1,Decoy,0,-7.67082,-5.44,-4.19,-5.140059293911623
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C44713746_decoy,TRY1,Decoy,0,-8.17735,-6.48,-1.1,-5.33291673813805
COc1c(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)csc1Cl,C44714088_decoy,TRY1,Decoy,0,-10.1005,-6.26,-2.31,-7.382089586556119
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44714090_decoy,TRY1,Decoy,0,-8.26438,-6.82,-2.87,-6.026941242011686
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44714092_decoy,TRY1,Decoy,0,-7.32554,-5.71,-4.54,-5.337595509156338
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44714094_decoy,TRY1,Decoy,0,-8.32687,-5.35,-0.96,-5.390033894400181
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44714096_decoy,TRY1,Decoy,0,-7.76454,-7.9,-2.62,-7.189096244904232
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714110_decoy,TRY1,Decoy,0,-8.42238,-5.97,-1.69,-5.653698561745613
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44714144_decoy,TRY1,Decoy,0,-8.59183,-5.5,-2.63,-6.012231749029589
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C44714222_decoy,TRY1,Decoy,0,-8.81202,-7.28,-1.46,-5.909625844625964
Cc1cccc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)c1,C44714386_decoy,TRY1,Decoy,0,-7.8441,-8.47,-1.74,-6.826055320174719
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C44714417_decoy,TRY1,Decoy,0,-7.30377,-6.41,-2.45,-5.338384288748956
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44714461_decoy,TRY1,Decoy,0,-9.43905,-7.72,-3.1,-7.051904597650026
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)c(F)c1F,C44714538_decoy,TRY1,Decoy,0,-8.27867,-8.39,-4.23,-6.205767868176693
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2,C44714544_decoy,TRY1,Decoy,0,-9.2501,-7.93,-2.44,-7.061057767159264
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2ccncc2)CC12CC[NH2+]CC2,C44714577_decoy,TRY1,Decoy,0,-8.66659,-7.88,-4.23,-7.518737018056867
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C44714681_decoy,TRY1,Decoy,0,-9.10046,-7.5,-3.75,-7.917390355043524
Cc1cc(C(=O)N2C[C@H](C(=O)NCc3nc4ccccc4c(=O)[nH]3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44714693_decoy,TRY1,Decoy,0,-9.18416,-8.65,-2.16,-6.542094120663939
O=C1NC(=O)N(c2ccc(I)cc2)C(=O)/C1=C/NCCN1CC[NH2+]CC1,C19372444_decoy,TRY1,Decoy,0,-9.48999,-6.78,-0.96,-7.467538798833918
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(C)oc4C(F)(F)F)CC34CC[NH2+]CC4)[nH]c2c1,C44737474_decoy,TRY1,Decoy,0,-9.14048,-8.95,-1.71,-8.794881820286552
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(N5CCOCC5)nc4)CC34CC[NH2+]CC4)[nH]c2c1,C39695830_decoy,TRY1,Decoy,0,-8.81637,-7.11,-2.6,-6.105071888564392
O=C(/C=C1/CS[C@H](NS(=O)(=O)c2ccc(Cl)cc2)N1)NCC[C@H]1C=c2ccccc2=[NH+]1,C63282155_decoy,TRY1,Decoy,0,-10.4357,-8.19,-3.21,-8.46736556126098
O=C1[C@H]2[C@@H](c3ccccc3O)[NH2+][C@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]2C(=O)N1c1ccc(F)cc1,C63465133_decoy,TRY1,Decoy,0,-7.49852,-6.94,-2.52,-6.371156870179937
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)c1,C63472951_decoy2,TRY1,Decoy,0,-7.66732,-6.87,,-5.708883655185872
Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)cc1,C63473050_decoy2,TRY1,Decoy,0,-6.42646,-8.06,,-5.363813095337324
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@@H]1CNN2[C@H]1N[C@H](c1ccco1)C[C@@H]2C(F)(F)F,C63537901_decoy,TRY1,Decoy,0,-8.82281,-5.86,-1.03,-5.475159388232677
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@@H]1CNN2[C@H]1N[C@@H](c1ccco1)C[C@@H]2C(F)(F)F,C63537904_decoy,TRY1,Decoy,0,-8.54583,-6.18,-1.99,-5.919566764929652
Cc1ccccc1C(=O)N[C@H]1NC2=C(S1)C(=O)C[C@@H](C(=O)NCCC1=c3ccccc3=[NH+]C1)C2,C64137228_decoy,TRY1,Decoy,0,-8.231,-8.22,-2.8,-6.955290920281594
CN(C)c1ccc(NC(=[NH2+])Nc2nc(C(F)(F)F)cc(=O)[nH]2)cc1,C00448948_decoy,TRY1,Decoy,0,-6.29818,-5.75,-3.78,-4.3796925626357845
CCC(CO)(CO)[NH2+]C[C@H](O)COc1ccc(OC)cc1C(C)(C)C,C14201896_decoy,TRY1,Decoy,0,-6.96895,-6.07,-3.29,-5.36078436082108
N/C(=[NH+]\N=C\c1cccc(OCc2cccc3ccccc23)c1)c1nonc1N,C17078806_decoy,TRY1,Decoy,0,-9.01178,-7.08,-2.26,-6.165447470894195
Cc1n[nH+]c(NCCCCCc2n[nH]c(N)c2C#N)c2ccccc12,C24717133_decoy,TRY1,Decoy,0,-8.21097,-8.17,-1.37,-7.218553897816617
CCn1cnc2c(Nc3ccc(F)cc3)nc(NCCCC[NH3+])nc21,C26533044_decoy,TRY1,Decoy,0,-9.27531,-6.57,-0.95,-9.291983332242852
CCCCc1oc2ccccc2c1C[NH+](C)Cc1nc(N)nc(N)n1,C28726915_decoy,TRY1,Decoy,0,-7.87758,-7.54,-1.52,-7.624256127680985
C[C@H](O)[C@H]([NH3+])c1nc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)co1,C33635712_decoy,TRY1,Decoy,0,-9.02702,-5.17,-1.04,-5.550711789865679
O=C(C[NH2+]C[C@H](O)CO)Nc1nc2c(s1)CCCCCCCCCC2,C22508181_decoy,TRY1,Decoy,0,-7.96502,-4.66,-2.85,-5.151954794351347
O=C(C[NH2+]C[C@@H](O)CO)Nc1nc2c(s1)CCCCCCCCCC2,C22508185_decoy,TRY1,Decoy,0,-8.13337,-4.41,-1.1,-4.800923310911046
CC(C)[NH2+]Cc1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C34659845_decoy,TRY1,Decoy,0,-7.56565,-6.18,-1.8,-6.813739089128207
O=c1[nH]c2ccccc2n1CCCS[C@H]1N[NH2+]NN1c1ccccc1,C39411835_decoy,TRY1,Decoy,0,-7.40651,-5.26,-2.05,-5.4071362350594665
CO[C@H]1C[NH+]([C@@H](CNO)c2ccc(-c3ccccc3O)cc2)CCN1,C39533990_decoy,TRY1,Decoy,0,-6.73055,-6.98,-1.21,-5.390731356541755
Cc1cc(C)cc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)c1,C40682240_decoy,TRY1,Decoy,0,-6.69672,-5.48,-3.59,-4.527865500540563
COc1ccc(Nc2ncnc(Nc3cc[nH+]cc3)c2N)c(OC)c1,C40687553_decoy,TRY1,Decoy,0,-7.10577,-6.78,-0.44,-8.875491400029224
CCc1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40688583_decoy,TRY1,Decoy,0,-6.37195,-7.54,-1.86,-6.610298566306554
Cc1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1Cl,C40703890_decoy,TRY1,Decoy,0,-8.3261,-5.75,-1.15,-5.28768542404197
CC(C)c1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40706338_decoy,TRY1,Decoy,0,-7.61878,-6.24,-2.82,-6.479526118441173
CCCCN(C)c1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40730278_decoy,TRY1,Decoy,0,-7.45931,-4.95,-4.07,-5.031014670778863
Cc1cccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)c1C,C40755268_decoy,TRY1,Decoy,0,-7.51826,-5.19,-1.65,-4.839534346356348
C[C@H](Nc1ncnc(NCC[NH+]2CCCCC2)c1N)c1ccccc1,C40756249_decoy,TRY1,Decoy,0,-7.05932,-6.36,-2.64,-4.999630967425596
C[C@@H](Nc1ncnc(NCC[NH+]2CCCCC2)c1N)c1ccccc1,C40756251_decoy,TRY1,Decoy,0,-6.22802,-5.4,-1.78,-4.3867920048922775
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1ccc(F)cc1F,C40756453_decoy,TRY1,Decoy,0,-7.40134,-6.57,-2.65,-5.959854430708797
COCCCNc1ncnc(Nc2cccc3[nH+]c(C)ccc23)c1N,C40757374_decoy,TRY1,Decoy,0,-7.00657,-6.69,-1.39,-6.564291063688738
COCCNc1nc[nH+]c(NN(c2ccccc2)c2ccccc2)c1N,C40777820_decoy,TRY1,Decoy,0,-6.59835,-6.73,-1.2,-6.700599984833988
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41725648_decoy,TRY1,Decoy,0,-9.31218,-6.36,-1.07,-6.255808043502492
C[NH+](C)C1(CNC(=O)NNC(=S)NC2CCCC2)CCCCC1,C43109701_decoy,TRY1,Decoy,0,-8.93138,-5.09,-1.22,-5.4033723014634205
[NH3+]CCCCCNc1ccc2nc(-c3ccc([N+](=O)[O-])cc3)[nH]c2c1,C45206852_decoy,TRY1,Decoy,0,-7.80266,-5.94,-2.28,-5.585445181454731
NC(=O)c1cc(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1F,C45694184_decoy,TRY1,Decoy,0,-8.93226,-6.66,-0.9,-6.274817400425906
C[C@H]1CCC[NH+](CCCNC(=O)NNC(=S)NC2CCCC2)C1,C46394700_decoy,TRY1,Decoy,0,-8.38832,-6.48,-1.32,-5.692181861040922
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(=S)NC2CCCC2)C1,C46427362_decoy,TRY1,Decoy,0,-8.05396,-6.89,-2.12,-5.746180983391918
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(=S)NC2CCCC2)C1,C46427364_decoy,TRY1,Decoy,0,-8.50206,-6.58,-1.63,-5.935351224668021
C[C@@]([NH3+])(CCCOc1c(Cl)cc([N+](=O)[O-])cc1Cl)C(N)=O,C50440750_decoy,TRY1,Decoy,0,-7.77645,-5.43,-2.03,-4.946731426690083
C[C@]([NH3+])(CCCOc1c(Cl)cc([N+](=O)[O-])cc1Cl)C(N)=O,C50440751_decoy,TRY1,Decoy,0,-8.44836,-5.69,-2.6,-5.783912316271353
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)Nc2ccccc2CC(N)=O)C1,C56645068_decoy,TRY1,Decoy,0,-7.23269,-5.09,-2.34,-5.3199859917886805
C[C@H]1CCC[NH+](C[C@@H](C)NC(=O)NNC(=S)NC2CCCC2)C1,C56785971_decoy,TRY1,Decoy,0,-7.92214,-6.21,-1.43,-5.581948971340559
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CC[C@H](Nc2ccccc2)C1,C60370019_decoy,TRY1,Decoy,0,-7.96543,-7.5,-1.42,-5.539350250024097
CCCCc1nnc(NC(=O)C2(N3CN[NH2+]N3)CCCCC2)s1,C63808526_decoy,TRY1,Decoy,0,-9.62816,-6.85,-0.84,-7.203805433227876
Cc1cc(=O)[nH]c(NCC[NH2+]CC(=O)NC2CCCCCCC2)n1,C65454867_decoy,TRY1,Decoy,0,-7.27455,-7.41,-1.67,-6.610651590677079
CCCC[C@H](NC(N)=O)C(=O)NC[C@H](C(C)C)[NH+]1CCC(C)CC1,C65585159_decoy,TRY1,Decoy,0,-7.67205,-4.77,-1.92,-4.842252035482838
CCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115421_decoy,TRY1,Decoy,0,-6.57801,-4.9,-1.23,-4.814124465820053
CCOc1c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cccc1OC,C66115422_decoy,TRY1,Decoy,0,-6.69775,-4.88,-1.65,-4.813184009848695
CC[C@@H](C)[NH+](C)CCNC(=O)Nc1ccccc1SCC(N)=O,C66176088_decoy,TRY1,Decoy,0,-7.85578,-4.98,-2.22,-5.91702760120075
CC[C@H](C)[NH+](C)CCNC(=O)Nc1ccccc1SCC(N)=O,C66176089_decoy,TRY1,Decoy,0,-7.59632,-4.56,-3.78,-4.859204234066628
COC(=O)c1c(C)[nH]c(C(=O)N[C@H]2CCC[NH+](CC(N)=O)C2)c1C,C66450679_decoy,TRY1,Decoy,0,-7.34444,-4.96,-2.43,-4.454347656657812
Cc1c(NC(=O)C(=O)N[C@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)cccc1C(N)=O,C67438847_decoy,TRY1,Decoy,0,-7.71848,-5.81,-3.06,-4.770036559722026
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C67439055_decoy,TRY1,Decoy,0,-10.2067,-5.61,-1.25,-7.547505340945408
CC(C)[C@@H](NC(N)=O)C(=O)N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C67467651_decoy,TRY1,Decoy,0,-7.39416,-7.23,-2.52,-5.887474428053522
Cc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2CCCCC2)cc1C(N)=O,C67491770_decoy,TRY1,Decoy,0,-7.42099,-6.99,-1.26,-7.154600685416731
NC(=O)c1ccsc1NC(=O)C[NH+]1CCC([C@@H](O)c2ccccc2)CC1,C67511238_decoy,TRY1,Decoy,0,-7.19328,-6.66,-1.62,-5.803473172959159
CC(C)(CNC(=O)NC[C@@H]1CCC[NH+]1CC1CCCCC1)C(N)=O,C67627937_decoy,TRY1,Decoy,0,-8.02729,-6.61,-3.1,-6.808868423807232
C[NH+](C)CCCNc1nc(N)c([N+](=O)[O-])c(NCc2ccco2)n1,C05065947_decoy,TRY1,Decoy,0,-7.37577,-6.76,0.15,-7.18331859080516
Nc1nonc1C(=O)NCC[NH2+]Cc1cccc(Br)c1,C02437193_decoy,TRY1,Decoy,0,-7.10559,-6.05,-1.2,-6.363657793670187
CC(C)[NH+](CC(N)=O)CC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C08532755_decoy,TRY1,Decoy,0,-9.38601,-6.53,-2.6,-7.032858604987236
COc1cc(C[NH2+]C[C@@H](C)O)cc(Br)c1OCC(N)=O,C08535045_decoy,TRY1,Decoy,0,-7.78216,-4.87,-2.31,-6.631911030978989
C=CCNC(=O)NC(=O)C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C15043126_decoy,TRY1,Decoy,0,-6.75493,-6.63,-2.23,-6.63562488887389
[NH3+]CCCCCc1nc2cc3c(cc2n1C[C@H](O)CO)OCCO3,C19753438_decoy,TRY1,Decoy,0,-9.0683,-4.77,-0.85,-6.16052929700757
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)NC(C)C,C20465308_decoy,TRY1,Decoy,0,-6.91302,-5.69,-0.51,-5.408169534565208
CCN(CC)C(=O)CCc1ccc(N2C(N)=NC(N)=[NH+]C2(C)C)cc1,C16954544_decoy,TRY1,Decoy,0,-8.01461,-6.45,-1.83,-6.696576168976006
CCOC(=O)Nc1cc(NC[C@H](O)C[NH+](C)C)c([N+](=O)[O-])c(N)n1,C17059564_decoy,TRY1,Decoy,0,-7.47397,-6.8,-2.24,-8.09353857975938
C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(CCO)CC1,C32850916_decoy,TRY1,Decoy,0,-6.77852,-6.14,-0.96,-4.776191635499881
CC(C)[NH2+]Cc1cc(Br)ccc1OCC(=O)NC(N)=O,C34659901_decoy,TRY1,Decoy,0,-7.7374,-6.77,-1.38,-7.970986012371344
CC[NH2+][C@@H](C)c1cccc(S(=O)(=O)NCCS(N)(=O)=O)c1,C36746136_decoy,TRY1,Decoy,0,-8.19896,-5.29,-2.04,-5.372494842184596
CC[C@@H]([NH2+]C)c1cccc(S(=O)(=O)NCCS(N)(=O)=O)c1,C37683270_decoy,TRY1,Decoy,0,-8.26863,-4.95,-2.57,-5.608028533660902
CCC[NH+]1CCN(c2nc3c(N)ncn(C[C@@H](O)CO)c-3n2)CC1,C01507685_decoy,TRY1,Decoy,0,-7.20369,-4.83,-1.56,-5.165691078578472
CC(C)S(=O)(=O)c1ccc([C@H](CNO)N2CC[NH2+][C@H](O)C2)cc1,C39534516_decoy,TRY1,Decoy,0,-8.6275,-6.02,-2.43,-6.264999305991767
COc1ccc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)c(OC)c1,C40754410_decoy,TRY1,Decoy,0,-7.39088,-6.51,-2.14,-5.479663302616256
C[NH+](C)CCNS(=O)(=O)c1cc(Br)cnc1NN,C41069918_decoy,TRY1,Decoy,0,-7.99471,-4.45,-0.99,-5.662516438925079
COC[C@H](O)C[NH+](C)CC(=O)Nc1c(N)cc(Cl)cc1Cl,C42483039_decoy,TRY1,Decoy,0,-8.26655,-5.26,-4.19,-5.375184987756436
CCC[C@H]([NH3+])c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C43217194_decoy,TRY1,Decoy,0,-8.48573,-7.12,-3.69,-6.8787179932875935
NC(=O)C[C@@H]([NH3+])c1cccn1S(=O)(=O)c1ccccc1[N+](=O)[O-],C44254182_decoy,TRY1,Decoy,0,-6.96224,-5.75,-3.21,-5.390189264147336
CC(C)(C)S(=O)(=O)/C(C#N)=C/c1sccc1[C@@H]([NH3+])CC(N)=O,C44254626_decoy,TRY1,Decoy,0,-7.43079,-5.24,-2.02,-5.578080665059627
CCOc1ccc(Nc2c(C)c(NCC[NH3+])c(C#N)c3ccnn23)cc1,C45253179_decoy,TRY1,Decoy,0,-7.84176,-6.54,-0.83,-8.72247995681264
C[C@H](C(=O)NC(=O)NC[C@@H]1CCCO1)[NH+]1CCC(CC(N)=O)CC1,C48026392_decoy,TRY1,Decoy,0,-8.75689,-6.74,-2.32,-6.224410270575964
Cc1cc(C)c2[nH+]c(NC[C@@H](O)CO)n(Cc3[nH+]c(C)ccc3[O-])c2c1,C28710371_decoy,TRY1,Decoy,0,-7.22059,-5.27,-1.93,-4.307557091679726
COc1cc(/C=N/[NH+]=C(/N)c2nonc2N)cc(OC)c1OC(C)=O,C09428176_decoy,TRY1,Decoy,0,-8.56194,-5.58,-2.16,-7.147683734874519
CCCCCCN1C(=O)NC(=O)/C(=C\N[C@@H]2CCCC[C@@H]2[NH3+])C1=O,C20292138_decoy,TRY1,Decoy,0,-8.83265,-6.06,-2.07,-5.535858128910634
CC(C)[C@H](C[NH+](C)C)NC(=O)c1cc(Br)cnc1NN,C51116536_decoy,TRY1,Decoy,0,-7.38086,-4.61,-2.4,-4.637223205742037
C[C@H]1CCC[C@@](CNC(=O)NNC(=O)C(=O)NC2CC2)([NH+](C)C)C1,C52588338_decoy,TRY1,Decoy,0,-7.67952,-6.7,-3.82,-5.854299340543784
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)C1,C56946347_decoy,TRY1,Decoy,0,-7.4805,-4.96,-2.91,-5.107883021094529
NC(=O)CSc1ccccc1NC(=O)C[NH+]1CCC(CO)CC1,C46091146_decoy,TRY1,Decoy,0,-8.17268,-5.16,-3.42,-6.1136789259864655
COc1cc(NCC[NH2+]CCOc2nonc2N)ccc1[N+](=O)[O-],C59384062_decoy,TRY1,Decoy,0,-6.10037,-6.17,-2.48,-5.9337228239099735
COCC[NH+](C)CCNC(=O)c1cc(Br)cnc1NN,C61401284_decoy,TRY1,Decoy,0,-7.40054,-5.67,-1.83,-5.821065215012433
C[C@H](CNC(=O)c1cc(Br)cnc1NN)C[NH+]1CCCC1,C62070908_decoy,TRY1,Decoy,0,-7.866,-6.48,-0.6,-7.320025927542619
COc1ccc(C2(C[NH2+][C@@H](C)C(=O)NC(N)=O)CCOCC2)cc1,C62242483_decoy,TRY1,Decoy,0,-7.24987,-7.16,-0.24,-5.866733435156988
C[C@H](CC[NH+](C)C)NC(=O)NNC(=O)c1cc(Br)c[nH]1,C62506474_decoy,TRY1,Decoy,0,-8.02017,-4.93,-0.23,-5.587868193159854
CCC[NH2+]Cc1ccc(O[C@H](C)C(=O)NC(N)=O)c(Br)c1,C62701549_decoy,TRY1,Decoy,0,-7.17672,-6.14,-3.69,-5.589942619417252
Cc1nc(C2([NH2+]CC(=O)Nc3sccc3C(N)=O)CCCC2)no1,C63511407_decoy,TRY1,Decoy,0,-8.01785,-5.14,-1.12,-4.998306588643506
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc2cc(Cl)ccc2[nH]1,C64886217_decoy,TRY1,Decoy,0,-8.59202,-6.04,-0.88,-6.160800484726765
O=C(NC[C@H]1NN[C@H]2CCC[NH+]21)c1ccc(CSc2ncn[nH]2)o1,C65394479_decoy,TRY1,Decoy,0,-8.31064,-7.64,-3.0,-6.810528953802015
NC(=O)C[NH+]1CCC(NC(=O)NC[C@@H](O)c2ccc(F)cc2)CC1,C65417359_decoy,TRY1,Decoy,0,-8.61862,-7.35,-1.77,-6.5874156739573175
CC[NH+]1CCN([C@H](C)CNC(=O)Nc2cnn(CC(N)=O)c2)CC1,C65430232_decoy,TRY1,Decoy,0,-7.953,-6.26,-4.93,-5.581018204224133
COCCOc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115461_decoy,TRY1,Decoy,0,-7.25358,-6.63,-0.56,-11.441780367847944
COc1ccc(C2(C[NH2+][C@H](C)C(=O)NC(N)=O)CCOCC2)cc1,C66392858_decoy,TRY1,Decoy,0,-7.10748,-6.56,-1.22,-7.562310029529976
CC(C)c1cccc(C(C)C)c1NC(=O)C[NH+]1C[C@H](O)C[C@@H]1C(N)=O,C67128677_decoy,TRY1,Decoy,0,-7.027,-6.47,-1.79,-5.343169501135865
Cc1ccc(SCCNC(=O)C[NH+]2C[C@@H](O)C[C@@H]2C(N)=O)cc1,C67129069_decoy,TRY1,Decoy,0,-8.86418,-6.49,-2.98,-6.214467534562212
Cc1ccc(NC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1C(N)=O,C67313677_decoy,TRY1,Decoy,0,-8.07895,-6.73,-1.3,-7.521921633499592
C[NH+](CCNC(=O)C(=O)Nc1sccc1C(N)=O)Cc1ccccc1,C67379832_decoy,TRY1,Decoy,0,-7.49715,-6.25,-2.1,-6.6277128689016855
CCC(CC)(CNC(=O)C(=O)Nc1ccc(C)c(C(N)=O)c1)[NH+](C)C,C67524839_decoy,TRY1,Decoy,0,-7.89707,-6.55,-1.38,-6.668702926254569
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNc2ncccn2)CC1,C67549962_decoy,TRY1,Decoy,0,-8.02458,-6.16,-2.76,-5.806246845368097
O=C1N(Cc2cccc(F)c2F)CCC[C@@]1(O)C[NH2+]C(CO)CO,C67558900_decoy,TRY1,Decoy,0,-7.83184,-6.74,-3.55,-6.13807552961521
CCCC[C@@]12CN3C[C@@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323396_decoy,TRY1,Decoy,0,-8.46467,-5.32,-0.82,-6.027682567166154
N/C(=[NH+]\N=C\c1ccc(OCc2ccccc2F)cc1)c1nonc1N,C17073270_decoy,TRY1,Decoy,0,-7.91417,-7.33,-1.06,-6.53149148991097
C/C(=N\NC(=O)c1c(C[NH+]2CCCCC2)nnn1-c1nonc1N)c1cccc(O)c1,C25782070_decoy,TRY1,Decoy,0,-8.5749,-8.52,-1.63,-7.602940274109788
Nc1nonc1C(=O)NCC[NH2+]Cc1cc(Br)cs1,C32617194_decoy,TRY1,Decoy,0,-8.34478,-6.71,0.01,-8.33894069728374
[NH3+]/C(=C/n1cncn1)NNC(=O)COc1ncn(-c2ccccc2)n1,C20365780_decoy,TRY1,Decoy,0,-8.24304,-6.94,-0.83,-6.866418275890997
CC(C)[NH2+]CCCC(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37634659_decoy,TRY1,Decoy,0,-8.80449,-4.98,-0.57,-5.427786745484141
[NH3+]CC(=O)NCC(=O)Nc1cc(Cl)c(OC(F)F)c(Cl)c1,C37767396_decoy,TRY1,Decoy,0,-8.12216,-6.57,-1.63,-7.994413662257213
CCC[NH+]1CCN(c2nc3c(N)ncn(C[C@H](O)CO)c-3n2)CC1,C01507681_decoy,TRY1,Decoy,0,-7.28517,-4.25,-3.42,-4.747402684342685
NC(=[NH2+])N/N=C(\C/C=C/c1ccc([N+](=O)[O-])o1)Cc1ccc([N+](=O)[O-])o1,C38653122_decoy,TRY1,Decoy,0,-8.19356,-7.5,-2.86,-9.45252382118091
CCOc1ccc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)cc1,C40756907_decoy,TRY1,Decoy,0,-6.76122,-6.77,-1.51,-6.050316833303185
Cc1c(NC(=O)C(=O)NCc2ccc(N(C)C)[nH+]c2)cccc1C(N)=O,C41637916_decoy,TRY1,Decoy,0,-6.95764,-6.96,-1.71,-6.386653784263267
CC[NH+](CC)CCOc1ccccc1NC(=O)CCCCNC(N)=O,C42699696_decoy,TRY1,Decoy,0,-7.24025,-6.36,-1.57,-7.895325846861832
CC[C@@]1(C)NC(=O)N(NC(=O)C[NH+]2CCC(CC(N)=O)CC2)C1=O,C48025273_decoy,TRY1,Decoy,0,-7.98736,-6.39,-2.12,-5.710385574714991
C[C@@H](C(=O)NC(=O)NC[C@H]1CCCO1)[NH+]1CCC(CC(N)=O)CC1,C48026394_decoy,TRY1,Decoy,0,-8.41337,-4.9,-3.67,-5.215043764947319
CC[NH2+]Cc1cccc(Br)c1O[C@@H](C)C(=O)NC(N)=O,C48794814_decoy,TRY1,Decoy,0,-6.90021,-4.56,-1.12,-4.860728716933163
CC(C)[NH2+]Cc1cccc(Br)c1O[C@@H](C)C(=O)NC(N)=O,C48795423_decoy,TRY1,Decoy,0,-7.39596,-6.28,-2.35,-6.4615753691177895
CCCCCCN1C(=O)NC(=O)/C(=C\N[C@H]2CCCC[C@@H]2[NH3+])C1=O,C20292141_decoy,TRY1,Decoy,0,-8.05455,-6.22,-1.62,-5.606458645734175
CC(C)[NH+](CCNC(=O)c1cc(Br)cnc1NN)C(C)C,C51089212_decoy,TRY1,Decoy,0,-8.11907,-5.79,-2.19,-5.8735607236941645
CC(C)C[C@H](C[NH+](C)C)NC(=O)c1cc(Br)cnc1NN,C51113615_decoy,TRY1,Decoy,0,-7.73117,-5.48,-1.46,-8.389978013995492
CC[NH2+][C@H](C)c1cc(Br)ccc1OCC(=O)NC(N)=O,C52067331_decoy,TRY1,Decoy,0,-8.24184,-6.09,-2.64,-7.4756657898553724
CC[NH2+][C@@H](C)c1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C52067364_decoy,TRY1,Decoy,0,-8.14441,-5.97,-1.68,-5.683869272626003
CC[NH2+][C@H](C)c1cc(Br)ccc1O[C@@H](C)C(=O)NC(N)=O,C52067365_decoy,TRY1,Decoy,0,-7.57624,-5.98,-5.12,-6.435229000550336
CC[NH2+][C@@H](C)c1cc(Br)ccc1O[C@H](C)C(=O)NC(N)=O,C52067366_decoy,TRY1,Decoy,0,-8.03766,-6.24,-4.02,-7.577793090027882
CC[NH2+][C@H](C)c1cc(Br)ccc1O[C@H](C)C(=O)NC(N)=O,C52067367_decoy,TRY1,Decoy,0,-8.51783,-6.06,-1.17,-8.222874235786666
CCC[NH2+][C@@H](C)c1cc(Br)ccc1OCC(=O)NC(N)=O,C52067648_decoy,TRY1,Decoy,0,-8.64521,-6.53,-1.74,-8.1756135725169
C[C@@H]1CCC[C@](CNC(=O)NNC(=O)C(=O)NC2CC2)([NH+](C)C)C1,C52588341_decoy,TRY1,Decoy,0,-7.92186,-6.17,-2.1,-5.335862614083434
CC(C)[NH+](CC(N)=O)CC(=O)NC(=O)Nc1ccc2c(c1)OCO2,C14927527_decoy,TRY1,Decoy,0,-8.43542,-5.38,-4.71,-5.701628425384037
Cc1n[nH]c(=O)c2c(NC(=O)C[NH+](CC(N)=O)C(C)C)oc(C)c12,C10906176_decoy,TRY1,Decoy,0,-6.67326,-6.19,-1.74,-5.244657632999957
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)NNC(=O)C(=O)NC2CC2)C1,C54805215_decoy,TRY1,Decoy,0,-7.7281,-6.14,-3.32,-5.590426511011868
C=CCNC(=O)NC(=O)C[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55027866_decoy,TRY1,Decoy,0,-8.09016,-7.25,-2.01,-8.109777795578356
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)C1,C56946348_decoy,TRY1,Decoy,0,-7.5037,-6.57,-2.87,-5.636117697115158
C[C@H](CNC(=O)Nc1ccccc1CC(N)=O)[NH+]1CCc2ccccc2C1,C45723225_decoy,TRY1,Decoy,0,-7.03538,-7.4,-3.11,-5.669052283891578
CSCC[C@@H](NC(N)=O)C(=O)N[C@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1,C60015934_decoy,TRY1,Decoy,0,-7.7788,-5.47,-3.28,-5.399820457042189
NNc1ncc(Br)cc1C(=O)NCCC[NH+]1CCCC1,C62071033_decoy,TRY1,Decoy,0,-8.1515,-6.29,-1.21,-7.741091286750678
CCC[C@@H](NC(N)=O)C(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1C,C63605828_decoy,TRY1,Decoy,0,-6.88742,-6.55,-1.3,-5.30701506571435
CCCc1nnc(NC(=O)C2CCC(CN3CN[NH2+]N3)CC2)s1,C63807766_decoy,TRY1,Decoy,0,-9.7072,-7.4,-3.42,-9.92752044535166
C[C@H]1[C@@H](C[NH2+]CCSc2nc[nH]n2)c2ccccc2N1CC(N)=O,C63870049_decoy,TRY1,Decoy,0,-7.05044,-4.88,-2.96,-4.313150038312157
O=C(NNC(=S)NC1CCCC1)NC1CC[NH+](CC(F)F)CC1,C64256045_decoy,TRY1,Decoy,0,-7.91168,-5.34,-1.75,-5.58876504816385
CCC[C@@H](NC(N)=O)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C64302721_decoy,TRY1,Decoy,0,-7.33268,-7.5,-0.73,-6.170207169085964
Cc1ccc2cc(C(=O)NNC(=O)NCCCn3cc[nH+]c3)[nH]c2c1,C64886182_decoy,TRY1,Decoy,0,-7.612,-5.73,-3.51,-4.876450286802944
C[C@@H](NC(=O)NCC(C)(C)[NH+](C)C)c1ccc(S(N)(=O)=O)cc1,C65449613_decoy,TRY1,Decoy,0,-9.2803,-4.86,-2.19,-5.253983070621347
COCCOc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cc1,C66115389_decoy,TRY1,Decoy,0,-7.45418,-4.85,-1.28,-4.769363671612329
CC[C@@H](C)[NH+](C)CCNC(=O)NNC(=O)c1cc(Br)c[nH]1,C66203309_decoy,TRY1,Decoy,0,-7.79882,-4.18,-1.7,-4.951246233309025
CC[NH+](C)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1,C66988598_decoy,TRY1,Decoy,0,-7.65589,-6.29,-1.8,-5.761456020437208
Cc1ccc(NC(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1C(N)=O,C67313679_decoy,TRY1,Decoy,0,-8.02829,-6.81,-1.54,-8.583845629701779
Cc1ccc(NC(=O)C(=O)NC[C@]2([NH+](C)C)CCC[C@H](C)C2)cc1C(N)=O,C67534006_decoy,TRY1,Decoy,0,-8.95156,-6.07,-1.64,-5.63700115395108
Cc1ccc(NC(=O)C(=O)NC[C@@]2([NH+](C)C)CCC[C@H](C)C2)cc1C(N)=O,C67534007_decoy,TRY1,Decoy,0,-7.83863,-5.29,-0.24,-5.485170221688914
Cc1ccc(NC(=O)C(=O)NC[C@]2([NH+](C)C)CCC[C@@H](C)C2)cc1C(N)=O,C67534009_decoy,TRY1,Decoy,0,-7.75459,-5.64,-3.12,-4.969291886165626
Cc1ccc(NC(=O)C(=O)NC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)cc1C(N)=O,C67534012_decoy,TRY1,Decoy,0,-8.27808,-5.5,-2.38,-6.022494738500848
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)C2CCCC2)CC1,C67639090_decoy,TRY1,Decoy,0,-8.80545,-6.78,-1.23,-6.10668025327652
Cc1[nH]c(=O)[nH]c(=O)c1CSc1nnc([C@@H]([NH3+])CC(C)C)o1,C01876725_decoy,TRY1,Decoy,0,-7.86657,-7.26,-3.95,-7.137019715968227
C[NH2+]CCC[NH2+][C@@H](CC(=O)Nc1c(C)cc(C)cc1C)C(=O)[O-],C05258439_decoy,TRY1,Decoy,0,-7.12574,-6.03,-2.55,-5.400396092118251
CC(O)=C1C(=O)C(=O)N(CC[NH2+]CCO)[C@@H]1c1ccc(O)cc1,C08566173_decoy,TRY1,Decoy,0,-7.36921,-5.07,-1.85,-4.995154939371884
COc1ccc(C)cc1NC(=[NH2+])Nc1nc(C)c(CC#N)c(=O)[nH]1,C09264434_decoy,TRY1,Decoy,0,-7.67022,-4.99,-2.49,-4.991187941387881
C[C@H]([NH3+])C(=O)NC[C@H](O)CCOc1ccc2ccc(=O)oc2c1,C15206705_decoy,TRY1,Decoy,0,-7.99856,-5.66,-1.58,-6.037890555765759
CCCc1cc(O)nc(NC(=[NH2+])Nc2ccc3c(c2)OCCO3)n1,C03855656_decoy,TRY1,Decoy,0,-8.87836,-7.19,-4.11,-6.310675305328649
CC[C@]12CN3C[C@](CC)(C[NH+](C1)[C@@H]3[C@H](O)[C@@H](O)[C@H](O)CO)C2=O,C19323119_decoy,TRY1,Decoy,0,-7.82231,-6.07,-0.63,-6.730085759794111
Cc1cc(C)c(NC(=O)C[NH+](C)CCC(=O)NC(N)=O)c(C)c1,C27126672_decoy,TRY1,Decoy,0,-7.09468,-6.26,-1.48,-5.432259597005823
C=CCNC(=S)NCC[NH2+]CCN[C@@H]1CCS(=O)(=O)C1,C22860409_decoy,TRY1,Decoy,0,-8.33512,-4.21,-1.17,-5.799106406296632
CCNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(NC(=O)CC)cc1,C30498897_decoy,TRY1,Decoy,0,-6.58835,-5.74,-2.77,-6.4357910150711
CCNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(NC(=O)CC)cc1,C30498900_decoy,TRY1,Decoy,0,-6.66136,-6.63,-3.72,-5.159279680510776
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC(=O)NC)cc1,C30499727_decoy,TRY1,Decoy,0,-6.55889,-6.65,-1.71,-5.557461084946223
NC(=O)C1CC[NH+](CCC(=O)NC(=O)NCc2ccco2)CC1,C28851929_decoy,TRY1,Decoy,0,-8.16841,-6.34,-2.31,-5.422322861066407
NC(=O)CSc1ccccc1NC(=O)C[NH+]1CCC(O)CC1,C32758499_decoy,TRY1,Decoy,0,-8.79864,-6.59,-1.07,-7.0396644203947005
CCC(CC)[C@@H]([NH3+])c1ccc2c(c1)N(CC(N)=O)C(=O)[C@H](C)O2,C33501591_decoy,TRY1,Decoy,0,-7.29469,-6.41,-2.67,-6.012315650634391
CC[NH2+]Cc1cc(Br)ccc1OCC(=O)NC(N)=O,C34659543_decoy,TRY1,Decoy,0,-7.41391,-4.84,-0.16,-5.36228645904799
CS(=O)(=O)NCCNc1c(C(N)=S)c[nH+]c2ccccc12,C36913983_decoy,TRY1,Decoy,0,-6.9198,-5.04,-0.61,-4.441341838552101
CS(=O)(=O)NCCNS(=O)(=O)c1ccccc1C#CC[NH3+],C37581798_decoy,TRY1,Decoy,0,-9.18466,-4.77,-1.31,-5.619102076061946
Cc1ccccc1Nc1ncnc(NCCCn2cc[nH+]c2)c1N,C40781250_decoy,TRY1,Decoy,0,-6.52125,-4.91,-0.34,-5.406244003735295
Cc1cccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)c1,C40781716_decoy,TRY1,Decoy,0,-7.26273,-6.46,-1.76,-5.888664461028109
CCCCN(C)C(=O)C[NH+]1CCc2c(sc(N)c2C(N)=O)C1,C41583050_decoy,TRY1,Decoy,0,-9.65015,-5.82,-0.49,-6.1353256570314025
CSCC[C@H]([NH3+])c1nc(C(=O)N[C@@H]2CCCCNC2=O)co1,C43217081_decoy,TRY1,Decoy,0,-9.59646,-5.61,-3.14,-6.133114536441453
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)NC[C@H]2CCCO2)co1,C43217353_decoy,TRY1,Decoy,0,-7.98383,-7.66,-1.63,-8.192058766581372
Cc1noc(/C=C/c2sccc2[C@H]([NH3+])CC(N)=O)c1[N+](=O)[O-],C44253728_decoy,TRY1,Decoy,0,-6.50867,-1.37,-1.99,-3.277104383041478
Cc1noc(/C=C/c2sccc2[C@@H]([NH3+])CC(N)=O)c1[N+](=O)[O-],C44253731_decoy,TRY1,Decoy,0,-6.87111,-4.53,-3.46,-4.37011979364116
NC(=O)C[C@@H]([NH3+])c1ccc(SCc2ccco2)c([N+](=O)[O-])c1,C44253968_decoy,TRY1,Decoy,0,-6.43323,-6.71,-1.19,-5.337510183028549
CC[NH+]1CCC[C@@H]1CNC(=S)NNC(=O)c1ccccc1O,C45521934_decoy,TRY1,Decoy,0,-7.09134,-4.28,-1.8,-4.686263722868098
CN(C)c1cc(CNC(=O)Nc2ccccc2CC(N)=O)cc[nH+]1,C45724088_decoy,TRY1,Decoy,0,-7.58659,-6.0,-1.51,-5.676663940184132
C[C@H]1CCCC[NH+]1[C@@H](C)CNC(=O)NNC(=O)C(=O)NC1CC1,C46339658_decoy,TRY1,Decoy,0,-7.99545,-4.65,-2.4,-5.116184302359872
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)NNC(=O)C(=O)NC2CC2)C1,C46425158_decoy,TRY1,Decoy,0,-7.01152,-4.65,-3.2,-5.074964873504118
C[C@@H]([NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)NC(N)=O,C46817754_decoy,TRY1,Decoy,0,-7.03212,-5.78,-1.39,-4.952256351748741
CC(C)[C@@H](NC(N)=O)C(=O)NC[C@@H](C)[NH+]1CCc2ccccc2C1,C47684401_decoy,TRY1,Decoy,0,-6.63388,-5.19,-2.94,-4.734165411744507
CC(C)[C@H](NC(N)=O)C(=O)NC[C@H](C)[NH+]1CCc2ccccc2C1,C47684403_decoy,TRY1,Decoy,0,-8.77361,-6.88,-0.85,-6.650365879009168
CCOC(=O)Nc1ccc(NCc2ccc(F)cc2F)[nH+]c1N,C26821582_decoy,TRY1,Decoy,0,-8.05369,-5.77,-2.64,-4.7516985062528905
C[NH+](C)CCOc1ccc(/C=C\C(=O)NC(C)(C)CO)cc1N,C57897074_decoy,TRY1,Decoy,0,-6.03491,-5.67,-1.83,-4.568097891031946
NC(=O)CSc1ccccc1NC(=O)NCCn1cc[nH+]c1,C58156732_decoy,TRY1,Decoy,0,-7.35619,-6.38,-3.51,-7.497384395078223
C[NH+](C)[C@@H](CNC(=O)Nc1ccccc1CC(N)=O)c1ccco1,C45725469_decoy,TRY1,Decoy,0,-7.79474,-6.65,-1.06,-7.574055321213296
C[NH+]1CCC(NC(=O)Nc2ccccc2OCCC(N)=O)CC1,C47877024_decoy,TRY1,Decoy,0,-7.27458,-6.85,-1.51,-9.49403555602184
NC(=O)NCCCCC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C61497660_decoy,TRY1,Decoy,0,-8.05195,-6.0,-2.55,-6.292597326760162
COCC/[NH+]=C(/N)NCCCNc1ccc(C(F)(F)F)cn1,C58159574_decoy,TRY1,Decoy,0,-6.9054,-5.78,-2.89,-5.788130984766837
CCC(CC)(CNC(=O)[C@H](CCSC)NC(N)=O)[NH+](C)C,C63801967_decoy,TRY1,Decoy,0,-7.70831,-4.66,-2.47,-5.488293141983834
CCCCc1[nH]c(CN2CCC(N3CC(CN)=NN3)CC2)c[nH+]1,C64157937_decoy,TRY1,Decoy,0,-8.99522,-5.74,-0.72,-5.891442265308131
CCCC[C@H](NC(N)=O)C(=O)N[C@@H](C)C[NH+]1C[C@H](C)C[C@@H](C)C1,C65596314_decoy,TRY1,Decoy,0,-7.45613,-6.71,-2.87,-6.002796896033944
CCCOc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cc1,C66115373_decoy,TRY1,Decoy,0,-7.17904,-5.65,-0.98,-5.085469290748639
CCCOc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115445_decoy,TRY1,Decoy,0,-7.26511,-6.67,-2.17,-10.440502126157092
CC[C@@H](C)Oc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115463_decoy,TRY1,Decoy,0,-6.57541,-5.15,-2.6,-4.731190162097825
CC[C@H](C)Oc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115464_decoy,TRY1,Decoy,0,-7.02309,-4.64,-2.61,-4.979135677173038
N/C(NCc1ccc(N2CCNC(=O)C2)cc1)=[NH+]\Cc1ccco1,C66245529_decoy,TRY1,Decoy,0,-8.1124,-6.12,-1.64,-5.793790753322563
C[NH+]1CCN(c2ncccc2CNC(=O)NCCC(N)=O)CC1,C66986666_decoy,TRY1,Decoy,0,-7.1045,-6.55,-0.79,-7.373391552923704
CCC(CC)(CNC(=O)Nc1ccc(C)c(C(N)=O)c1)[NH+](C)C,C67312925_decoy,TRY1,Decoy,0,-7.62536,-6.08,-3.21,-6.339423851619703
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)n(C)c(=O)n(-c2ccc(Cl)cc2)c1=O,C08791743_decoy,TRY1,Decoy,0,-9.17617,-6.02,-1.61,-4.860863678475791
CCOc1cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)cc(I)c1O,C08837926_decoy,TRY1,Decoy,0,-9.10573,-5.39,-1.42,-4.983236488112033
O=C1[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1c1ccccc1,C08876659_decoy,TRY1,Decoy,0,-7.14769,-8.2,-3.91,-6.396699002700735
Cc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@@H](O)c3c(C)[nH]c4ccccc34)CC1)O2,C12293207_decoy,TRY1,Decoy,0,-7.79821,-5.76,-1.51,-4.058059847563694
Oc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@H](O)c3ccc(Cl)c(Cl)c3)CC1)O2,C12293645_decoy,TRY1,Decoy,0,-10.2932,-5.66,-3.36,-5.3479251575112166
Cc1[nH]c2ccc(F)cc2c1[C@@H](O)C[NH+]1CCC2(CC1)C[C@@H](O)c1ccccc1O2,C12329197_decoy,TRY1,Decoy,0,-9.51356,-7.22,-0.91,-5.561322005771372
Cc1[nH]c2ccc(F)cc2c1[C@H](O)C[NH+]1CCC2(CC1)C[C@@H](O)c1ccccc1O2,C12329201_decoy,TRY1,Decoy,0,-7.83042,-7.72,-2.17,-6.3261322493999135
Cc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@H](O)c3c[nH]c4cc(C)ccc34)CC1)O2,C12329717_decoy,TRY1,Decoy,0,-8.12662,-6.62,-1.93,-5.275490209156825
Oc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@@H](O)c3ccc4c(c3)CCCC4)CC1)O2,C12330302_decoy,TRY1,Decoy,0,-9.1044,-6.12,-2.39,-4.767392690735421
O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2c(Cl)cccc21,C12885214_decoy,TRY1,Decoy,0,-8.01505,-6.99,-0.86,-5.3022958927200845
CC[NH+]1CCc2c([nH]c3ccccc23)[C@@H]1c1c(O)[nH]c(=O)n(-c2cc(C)cc(C)c2)c1=O,C12888640_decoy,TRY1,Decoy,0,-7.00828,-5.83,-2.74,-3.910077984166128
O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(F)cc1)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccc(F)cc21,C08995138_decoy,TRY1,Decoy,0,-8.91778,-8.58,-1.06,-5.841895724250293
O=C1[C@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1c1ccc(F)cc1,C08995140_decoy,TRY1,Decoy,0,-8.69019,-9.09,-1.39,-6.970611074128403
COc1ccc(-n2c(O)nc(O)c([C@H]3c4[nH]c5ccccc5c4CC[NH+]3C)c2=O)cc1,C09329599_decoy,TRY1,Decoy,0,-8.33216,-8.35,-1.34,-6.499387881403347
CC[NH+]1CCc2c([nH]c3ccccc23)[C@H]1c1c(O)nc(O)n(-c2cccc(C)c2)c1=O,C08994392_decoy,TRY1,Decoy,0,-6.28237,-6.33,-1.24,-4.886555699564869
CC[NH+]1CCc2c([nH]c3ccccc23)[C@@H]1c1c(O)nc(O)n(-c2ccccc2C)c1=O,C08994699_decoy,TRY1,Decoy,0,-7.81679,-8.53,-2.18,-7.332511567176554
CC[NH+]1CCc2c([nH]c3ccccc23)[C@H]1c1c(O)nc(O)n(-c2cccc(C)c2C)c1=O,C08995785_decoy,TRY1,Decoy,0,-6.23211,-6.0,-1.91,-4.762315529475457
Cc1cc2c(cc1C)[C@H](O)CC1(CC[NH+](C[C@@H](O)c3c(C)[nH]c4ccc(F)cc34)CC1)O2,C19125099_decoy,TRY1,Decoy,0,-9.08097,-7.32,-2.07,-6.348830466343794
Cc1cc2c(cc1Cl)[C@H](O)CC1(CC[NH+](C[C@H](O)c3c(C)[nH]c4ccccc34)CC1)O2,C19125614_decoy,TRY1,Decoy,0,-8.5926,-5.86,-2.02,-4.930135218629735
Cc1ccc2c([C@@H](O)C[NH+]3CCC4(CC3)C[C@@H](O)c3cc(C)c(C)cc3O4)c(C)[nH]c2c1,C19219594_decoy,TRY1,Decoy,0,-8.9642,-6.87,-1.79,-4.966169828379631
O[C@@H]1CC2(CC[NH+](C[C@H](O)c3c[nH]c4ccc(F)cc34)CC2)Oc2ccc(Cl)cc21,C19346069_decoy,TRY1,Decoy,0,-9.32987,-6.34,-0.88,-5.323120221369346
O[C@H]1CC2(CC[NH+](C[C@H](O)c3c[nH]c4ccc(F)cc34)CC2)Oc2ccc(Cl)cc21,C19346073_decoy,TRY1,Decoy,0,-9.12178,-7.92,-2.17,-5.484086685126196
O[C@H](C[NH+]1CCC2(CC1)C[C@H](O)c1cc(Cl)ccc1O2)c1c[nH]c2ccc(F)cc12,C19346075_decoy,TRY1,Decoy,0,-9.86598,-7.67,-2.84,-5.232776845775933
Cc1[nH]c2ccc(F)cc2c1[C@@H](O)C[NH+]1CCC2(CC1)C[C@@H](O)c1cc(Cl)ccc1O2,C19581406_decoy,TRY1,Decoy,0,-9.1428,-8.82,-1.83,-5.680799986643861
Cc1[nH]c2ccc(F)cc2c1[C@H](O)C[NH+]1CCC2(CC1)C[C@@H](O)c1cc(Cl)ccc1O2,C19581409_decoy,TRY1,Decoy,0,-9.27999,-6.9,-1.95,-6.053076975570824
Cc1[nH]c2ccc(F)cc2c1[C@@H](O)C[NH+]1CCC2(CC1)C[C@H](O)c1cc(Cl)ccc1O2,C19581412_decoy,TRY1,Decoy,0,-9.07013,-7.05,-2.21,-5.142511088561826
Nc1c2c(-c3cccc(Cl)c3)nc(N3CC[NH2+]CC3)nc2nn1-c1ccc(F)cc1,C35577893_decoy,TRY1,Decoy,0,-8.64738,-6.23,-0.97,-5.610396054570878
[NH3+][C@H]1CCCC[C@@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C38050169_decoy,TRY1,Decoy,0,-9.37684,-6.4,-2.54,-5.988616638594143
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C38050170_decoy,TRY1,Decoy,0,-10.5961,-6.11,-3.22,-6.112117565492078
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1Br,C38050202_decoy,TRY1,Decoy,0,-9.48091,-4.9,-1.86,-5.269625291387611
[NH3+][C@H]1CCCC[C@H]1NS(=O)(=O)c1cc(Br)sc1Br,C38050284_decoy,TRY1,Decoy,0,-10.0083,-6.24,-1.27,-9.835874141181094
O=C1[NH+]=c2c(Br)cc(Br)cc2=C1NNC(=O)c1nc(=O)[nH]c2ccccc12,C13301111_decoy,TRY1,Decoy,0,-8.10556,-8.54,-2.84,-9.294257862444969
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(O)C(Cc4ccccc4)=C[C@@H]3C[C@@H]2CO1,C39467059_decoy,TRY1,Decoy,0,-6.35424,-7.24,-1.14,-3.975517028426195
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(O)C(Cc4ccccc4)=C[C@H]3C[C@@H]2CO1,C39467061_decoy,TRY1,Decoy,0,-6.90798,-6.29,-1.0,-4.447089958693393
CSC1=C[C@H]2C[NH+]3N[P@@](=O)(c4ccccc4O)OC[C@@H]3C[C@@H]2C=C1c1ccccc1O,C39467105_decoy,TRY1,Decoy,0,-8.64366,-6.21,-1.62,-5.25011661114261
CSC1=C[C@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467229_decoy,TRY1,Decoy,0,-8.54786,-5.05,-4.31,-4.587767147445233
CO[P@]1(=O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39467708_decoy,TRY1,Decoy,0,-7.05499,-5.48,-2.1,-4.414401986591407
CS[P@]1(=O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39468272_decoy,TRY1,Decoy,0,-5.81954,-5.46,-2.51,-4.071858714733686
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3cc(C(C)(C)C)no3)sc2[nH+]1,C46585966_decoy,TRY1,Decoy,0,-8.66359,-6.68,-3.19,-6.581932073242341
Nc1cc(Br)c(S(=O)(=O)N[C@@H]2CC[NH+]3CCC[C@H]23)c(Br)c1,C49563876_decoy,TRY1,Decoy,0,-7.35211,-5.8,-3.38,-4.82773585625218
[NH3+]C1CCC(NS(=O)(=O)c2c(Cl)cc(Br)cc2Cl)CC1,C51693197_decoy,TRY1,Decoy,0,-8.86095,-6.67,-2.17,-5.869461104033386
C[NH2+][C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)c1ccccc1I,C52094485_decoy,TRY1,Decoy,0,-7.51481,-4.28,-1.01,-4.709730143563636
C[NH2+][C@H](c1cccc(Br)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094516_decoy,TRY1,Decoy,0,-6.51099,-5.46,-0.4,-4.302623184379756
C[NH2+][C@@H](c1cccc(I)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094529_decoy,TRY1,Decoy,0,-8.1097,-5.03,-3.01,-4.402297397092616
C[NH2+][C@H](c1ccc(I)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094536_decoy,TRY1,Decoy,0,-7.03313,-5.54,-0.48,-4.17830370274342
[NH3+][C@H]1CCC[C@H]1NS(=O)(=O)c1cc(Br)sc1Br,C63175173_decoy,TRY1,Decoy,0,-10.1583,-5.72,-2.6,-8.332440178624207
[NH3+][C@H]1CCCCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1Br,C63213144_decoy,TRY1,Decoy,0,-8.60049,-5.69,-1.35,-4.655522998745165
[NH3+][C@@H]1CCCCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1Br,C63213149_decoy,TRY1,Decoy,0,-8.17746,-5.97,-3.13,-4.942059213725638
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4cccc5ccccc45)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097934_decoy,TRY1,Decoy,0,-8.24213,-7.55,-3.19,-5.365536461745613
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc5ccccc45)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097936_decoy,TRY1,Decoy,0,-7.8134,-6.58,-1.83,-5.045362398417288
CCC(CO)(CO)[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl,C02622355_decoy,TRY1,Decoy,0,-7.33632,-5.35,-2.81,-5.052652805890541
CCC(CO)(CO)[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl,C02622356_decoy,TRY1,Decoy,0,-8.28631,-5.01,-2.41,-5.440134529199353
COc1ccc([C@@H](C[NH2+]C[C@H](O)CO)c2c[nH]c3ccccc23)cc1,C06787580_decoy,TRY1,Decoy,0,-7.20907,-5.17,-1.46,-4.5030139993924045
COc1ccc([C@H](C[NH2+]C[C@H](O)CO)c2c[nH]c3ccccc23)cc1,C06787581_decoy,TRY1,Decoy,0,-7.26077,-6.14,-0.72,-5.16209120581404
COc1ccc([C@@H](C[NH2+]C[C@@H](O)CO)c2c[nH]c3ccccc23)cc1,C06787582_decoy,TRY1,Decoy,0,-7.14569,-5.65,-1.11,-5.454108926721145
COc1ccc([C@H](C[NH2+]C[C@@H](O)CO)c2c[nH]c3ccccc23)cc1,C06787583_decoy,TRY1,Decoy,0,-7.07865,-5.68,-2.12,-5.426927431886027
C[C@@H]([NH2+]CC(=O)Nc1ccccc1SCC(N)=O)c1cccs1,C08734815_decoy,TRY1,Decoy,0,-7.7959,-6.53,-4.6,-6.878314095952955
OCC(CO)(CO)[NH2+]Cc1cccn1-c1ccc(Cl)cc1Cl,C10003466_decoy,TRY1,Decoy,0,-7.83431,-5.31,-0.8,-5.7593274816061575
OCC(CO)(CO)[NH2+]Cc1cccn1-c1cccc(Cl)c1Cl,C10003569_decoy,TRY1,Decoy,0,-7.68392,-5.4,-2.01,-5.3760073988460375
C[NH+](C)CCCNc1nc(N)c([N+](=O)[O-])c(Nc2ccc(F)cc2)n1,C04306329_decoy,TRY1,Decoy,0,-6.46678,-6.71,0.1,-6.708303084507861
C[NH+](C)CCCNc1nc(N)c([N+](=O)[O-])c(Nc2cccc(F)c2)n1,C04306356_decoy,TRY1,Decoy,0,-6.37915,-6.4,-1.1,-6.967448628734424
C[NH+](C)C[C@@H](/C(Cc1ccccc1)=N/NC(=S)NN)c1ccccc1,C17211443_decoy,TRY1,Decoy,0,-7.52433,-5.87,-1.28,-7.988793888388201
Oc1ccc(C2(C[NH2+]C[C@H](O)COc3ccccc3)CCCC2)cc1O,C22589339_decoy,TRY1,Decoy,0,-7.25753,-5.74,-1.39,-5.154122246052439
Oc1ccc(C2(C[NH2+]C[C@@H](O)COc3ccccc3)CCCC2)cc1O,C22589344_decoy,TRY1,Decoy,0,-7.76478,-7.47,-1.89,-6.040321077358495
CCOc1cc(CC[NH3+])cc(Br)c1OC[C@H](C)C(N)=O,C37719933_decoy,TRY1,Decoy,0,-9.94326,-4.92,-2.02,-5.299423880475945
CCOc1cc(C[C@@H](C)[NH3+])cc(Br)c1O[C@H](C)C(N)=O,C37722405_decoy,TRY1,Decoy,0,-8.84195,-5.09,-0.85,-9.307256126273904
CCOc1cc(C[C@H](C)[NH3+])cc(Br)c1O[C@@H](C)C(N)=O,C37722406_decoy,TRY1,Decoy,0,-8.14625,-4.37,-2.63,-4.7925499743186375
CCOc1cc(C[C@H](C)[NH3+])cc(Br)c1O[C@H](C)C(N)=O,C37722407_decoy,TRY1,Decoy,0,-8.2652,-4.23,-2.16,-5.426959611326628
CCOc1cc(C[C@@H](C)[NH3+])cc(Br)c1OCCC(N)=O,C37722414_decoy,TRY1,Decoy,0,-9.81902,-5.35,-2.54,-8.242584742135977
CCOc1cc(C[C@H](C)[NH3+])cc(Br)c1OC[C@@H](C)C(N)=O,C37722418_decoy,TRY1,Decoy,0,-8.96192,-6.49,-2.38,-8.029050614633647
CCOc1cc(C[C@@H]([NH3+])CC)cc(Br)c1O[C@@H](C)C(N)=O,C37722478_decoy,TRY1,Decoy,0,-8.03512,-4.13,-4.17,-5.07246283845759
CCOc1cc(C[C@@H]([NH3+])CC)cc(Br)c1O[C@H](C)C(N)=O,C37722480_decoy,TRY1,Decoy,0,-8.44391,-4.63,-2.12,-6.680598732282737
CCOc1cc(C[C@H]([NH3+])CC)cc(Br)c1OCCC(N)=O,C37722485_decoy,TRY1,Decoy,0,-9.60379,-5.01,-2.11,-5.672642915407281
CC[C@@H]([NH3+])Cc1cc(Br)c(O[C@H](C)C(N)=O)c(OC)c1,C37725079_decoy,TRY1,Decoy,0,-9.17009,-5.27,-3.87,-9.244593505273086
CC[C@@H]([NH3+])Cc1cc(Br)c(OCCC(N)=O)c(OC)c1,C37725087_decoy,TRY1,Decoy,0,-9.58633,-4.58,-1.71,-5.760021102124933
CC[C@H]([NH3+])Cc1cc(Br)c(OC[C@H](C)C(N)=O)c(OC)c1,C37725090_decoy,TRY1,Decoy,0,-8.51076,-4.98,-3.15,-4.997811653204274
NC(=O)CN(Cc1ccc(Br)cc1)C(=O)CCCCC[NH3+],C37822311_decoy,TRY1,Decoy,0,-8.83324,-6.44,-1.32,-8.611694711887882
CCC[C@@](C)([NH3+])C(=O)N(CC(N)=O)Cc1ccc(Br)cc1,C37822342_decoy,TRY1,Decoy,0,-6.6532,-4.98,-2.81,-5.139507237364864
CCC(CO)(CO)[NH2+]C[C@H](O)COc1ccc(C(C)(C)C)cc1C,C40162339_decoy,TRY1,Decoy,0,-7.37864,-6.05,-2.11,-5.485080665797504
CCC(CO)(CO)[NH2+]C[C@@H](O)COc1ccc(C(C)(C)C)cc1C,C40162340_decoy,TRY1,Decoy,0,-7.11273,-4.8,-3.2,-4.7853864277651725
COc1ccccc1Nc1ncnc(NCC[NH+]2CCCCC2)c1N,C40756291_decoy,TRY1,Decoy,0,-7.08464,-6.66,-1.44,-5.16055063713342
CC[C@H]([NH2+]CCCS(N)(=O)=O)c1cc(Br)ccc1O,C45066724_decoy,TRY1,Decoy,0,-8.16124,-4.71,-1.86,-5.197988174652767
C[C@H]1CCCC[NH+]1[C@@H](C)CNC(=O)NNC(=S)NC1CCCC1,C46339062_decoy,TRY1,Decoy,0,-8.22635,-6.16,-2.85,-5.460588371083176
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)C1CCCCC1,C47549500_decoy,TRY1,Decoy,0,-8.3233,-7.01,-2.19,-6.857091891245858
CNC(=O)NC(=O)C[NH+](CCc1ccccc1C)CC(=O)NC(=O)NC,C47613976_decoy,TRY1,Decoy,0,-6.70399,-7.38,-1.97,-8.130595588327719
Cc1c(C[NH2+][C@H](C)CCCC(C)(C)O)c2ccccc2n1CC(N)=O,C55154330_decoy,TRY1,Decoy,0,-8.42732,-5.8,-4.57,-5.322580809095644
CSCC[C@H]([NH3+])C(=O)Nc1ccccc1Sc1c(C)n[nH]c1C,C55225632_decoy,TRY1,Decoy,0,-10.2659,-4.63,-1.62,-6.027067458242982
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@@H](C)C[NH+]1CCC[C@H](C)C1,C56725362_decoy,TRY1,Decoy,0,-8.31071,-7.15,-4.78,-5.858849627545476
C[C@H](CNC(=O)NNC(=S)NC1CCCC1)C[NH+]1CCCCC1,C57043221_decoy,TRY1,Decoy,0,-9.2095,-6.17,-1.93,-5.876185871071894
Cc1ccc(NCCNC(=O)CCCNC(=O)NC2CCCCC2)n[nH+]1,C57790479_decoy,TRY1,Decoy,0,-8.57052,-5.15,-1.25,-5.133962620840131
CCOc1cc(C[C@@H](C)[NH3+])cc(Br)c1O[C@@H](CC)C(N)=O,C61678315_decoy,TRY1,Decoy,0,-9.22007,-4.93,-1.71,-7.654009403213882
CCOc1cc(C[C@@H](C)[NH3+])cc(Br)c1O[C@H](CC)C(N)=O,C61678316_decoy,TRY1,Decoy,0,-9.71015,-0.31,-1.39,-3.9612822515677655
NC(=O)C[NH+](Cc1csc(-c2ccc(C(N)=O)cc2)n1)C1CCCC1,C53609717_decoy,TRY1,Decoy,0,-9.65301,-7.66,-1.5,-8.806277890019427
CSCC[C@@H](CO)Nc1nc(CC[NH3+])nc2sc(C)c(C)c12,C65421813_decoy,TRY1,Decoy,0,-10.1455,-5.8,-2.47,-9.553526233828144
CC1CC[NH+]([C@@H](C)CNC(=O)NNC(=S)NC2CCCC2)CC1,C65480660_decoy,TRY1,Decoy,0,-8.57919,-5.15,-1.27,-6.162108909264591
C=CC/[NH+]=C(\N)NCCC(=O)Nc1ccc(Br)cc1C,C66246062_decoy,TRY1,Decoy,0,-9.06461,-4.76,-1.84,-5.1942127955881885
C=CC/[NH+]=C(/N)NCCCNC(=O)c1ccc(Br)cc1,C66246163_decoy,TRY1,Decoy,0,-7.93211,-4.98,-2.06,-5.654197852309503
NC(=O)[C@@H]([NH2+]CCNc1ncccc1C(F)(F)F)c1ccc(F)cc1,C66939793_decoy,TRY1,Decoy,0,-7.07277,-6.88,-1.29,-5.889259271428816
NC(=O)[C@H]([NH2+]CCNc1ncccc1C(F)(F)F)c1ccc(F)cc1,C66939794_decoy,TRY1,Decoy,0,-7.69789,-6.58,-2.98,-6.342168677634783
C=CC[NH+](CC=C)[C@@H](CNC(=O)Nc1ccc(C)c(C(N)=O)c1)C(C)C,C67313405_decoy,TRY1,Decoy,0,-7.89171,-6.2,-1.59,-5.799305946815371
CC(=O)c1ccc(S(=O)(=O)N(Cc2ccc3c(c2)OCO3)Cc2cc3ccc(C)cc3[nH]c2=O)cc1,C00913758_decoy,TRY1,Decoy,0,-7.96237,-7.8,-3.57,-6.156197905278454
O=c1[nH]c2cc3c(cc2cc1CN(C[C@H]1CCCO1)S(=O)(=O)c1cccc(C(F)(F)F)c1)OCCO3,C01222181_decoy,TRY1,Decoy,0,-8.41187,-6.39,-3.69,-5.330758885445531
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)ccc1Cl,C03214308_decoy,TRY1,Decoy,0,-9.53444,-6.09,-2.39,-6.004681362266688
CCN(Cc1ccccc1)C(=O)C(=O)NC[C@@H](c1ccc2c(c1)OCO2)S(=O)(=O)c1cccs1,C08969976_decoy,TRY1,Decoy,0,-8.96171,-8.1,-3.83,-9.207943079326084
O=S(=O)(Cc1ccccc1Cl)NC[C@@H](c1cccs1)S(=O)(=O)c1ccc2c(c1)OCCO2,C09105341_decoy,TRY1,Decoy,0,-9.79613,-6.7,-1.64,-6.429597553055588
O=S(=O)(NC[C@@H]1CCCO1)c1ccc(S(=O)(=O)N(Cc2ccccc2F)C[C@H]2CCCO2)cc1,C09203493_decoy,TRY1,Decoy,0,-8.92869,-6.07,-1.89,-5.68421949389349
COc1ccc(-n2c(Cn3c(=O)sc4ccccc43)nnc2SCC(=O)Nc2nccs2)cc1,C09278729_decoy,TRY1,Decoy,0,-9.36679,-7.73,-1.72,-8.325981832597734
CC[C@@H](C)OC(=O)C[C@@H]1C(=O)NCCN1C(=O)COc1ccc(Br)cc1Br,C09781756_decoy,TRY1,Decoy,0,-8.27865,-7.08,-3.01,-6.713116308653581
COc1ccc(N2CCN(c3nc4c(c(=O)[nH]c(=O)n4C)n3CCSc3ccc(F)cc3)CC2)cc1,C10248596_decoy,TRY1,Decoy,0,-10.1281,-5.51,-1.41,-5.774925623966851
CC(C)(C)N1C[C@H](C(=O)N2CCC(C(=O)Nc3nnc(COc4ccc(Cl)cc4)s3)CC2)CC1=O,C11095426_decoy,TRY1,Decoy,0,-11.0573,-8.14,-1.5,-6.716441122556155
Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3c(C)n(C)n(-c4ccccc4)c3=O)C2=O)cc1,C12032444_decoy,TRY1,Decoy,0,-8.79671,-7.3,-1.96,-6.094782498428908
O=C1/C(=C\c2c(NCCCn3ccnc3)nc3ccccn3c2=O)SC(=S)N1Cc1ccccc1,C05357412_decoy,TRY1,Decoy,0,-8.22721,-8.28,-2.22,-8.076466427978128
Cc1cc(C(=O)COC(=O)CNS(=O)(=O)c2cccc(F)c2)c(C)n1-c1ccc(OC(F)F)cc1,C03380163_decoy,TRY1,Decoy,0,-8.6668,-7.39,-2.53,-7.08157475353294
CCn1c(SCC(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)nnc1-c1cc(C(F)(F)F)n(C)n1,C13958374_decoy,TRY1,Decoy,0,-7.08291,-8.01,-2.14,-5.6031794506295975
CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)CNC(=O)c1ccc(Br)o1,C14109087_decoy,TRY1,Decoy,0,-7.42201,-7.27,-1.42,-6.0876441606801714
CC(C)CCOC(=O)C[C@H]1C(=O)NCCN1C(=O)COc1ccc(Br)cc1Br,C14773459_decoy,TRY1,Decoy,0,-8.36697,-6.17,-2.44,-6.877898815457989
COCCCNC(=O)c1csc(CSc2nnc(-c3ccncc3)n2-c2ccccc2Cl)n1,C16464504_decoy,TRY1,Decoy,0,-10.1714,-5.67,-3.29,-7.723828411330622
CCOCCCn1c(SCC(=O)Nn2cnc3sc(C)c(C)c3c2=O)nc2ccccc2c1=O,C16629815_decoy,TRY1,Decoy,0,-8.80493,-7.19,-1.89,-6.733086849240513
COc1ccc(CN2C(=O)[C@@](O)(CC(=O)c3ccc(C)o3)c3cc(Br)ccc32)cc1OC,C17086792_decoy,TRY1,Decoy,0,-8.86391,-7.92,-0.8,-7.146160084342129
CCOC(=O)C[C@H]1C(=O)[C@H](CC(=O)OCC)[C@@H]2N[C@@H]1c1ccccc1OCCOCCOc1ccccc12,C15024185_decoy,TRY1,Decoy,0,-8.6307,-7.18,-2.34,-6.8660202679285405
Cc1cccc2cc([C@H](c3nnnn3C[C@@H]3CCCO3)N(Cc3ccccc3)Cc3ccco3)c(=O)[nH]c12,C20082870_decoy,TRY1,Decoy,0,-8.72087,-7.72,-3.92,-6.928850421719869
CCOc1cc2c(cc1OCC)[C@@H]1[C@H](C(=O)NC[C@@H]3COc4ccccc4O3)c3ccccc3C(=O)N1CC2,C20155451_decoy,TRY1,Decoy,0,-7.51327,-6.73,-2.95,-6.531169801457298
Cc1c(NC(=O)CSc2nnc(COc3ccc(Cl)cc3)n2C)c(=O)n(-c2ccccc2)n1C,C20293787_decoy,TRY1,Decoy,0,-8.88051,-9.27,-1.45,-8.766776589358932
CCOc1ccc(C(=O)Nc2nnc([C@H]3CC(=O)N(c4ccc(C)c(Cl)c4)C3)s2)cc1OCC,C20577979_decoy,TRY1,Decoy,0,-9.05549,-6.99,-3.28,-6.336593399034578
CCOc1ccc(C(=O)Nc2nnc([C@@H]3CC(=O)N(c4ccc(C)c(Cl)c4)C3)s2)cc1OCC,C20577982_decoy,TRY1,Decoy,0,-10.7741,-7.75,-1.57,-7.674010582666948
Cc1ccccc1N1C[C@@H](c2nnc(NC(=O)c3ccccc3S(=O)(=O)CCC(C)C)s2)CC1=O,C20585036_decoy,TRY1,Decoy,0,-9.69519,-8.73,-3.09,-8.513144197293025
Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)O[C@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,C20975287_decoy,TRY1,Decoy,0,-9.36221,-7.36,-2.41,-6.527338255761522
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl,C32970874_decoy,TRY1,Decoy,0,-9.86598,-7.24,-2.59,-6.417487516736753
CCCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N([C@@H]2CCS(=O)(=O)C2)C1=O,C33482265_decoy,TRY1,Decoy,0,-8.83969,-7.21,-1.65,-5.91571680153275
CCOC(=O)C[C@@H]1C(=O)[C@@H](CC(=O)OCC)[C@@H]2N[C@@H]1c1ccccc1OCCOCCOc1ccccc12,C33821906_decoy,TRY1,Decoy,0,-7.81698,-6.23,-3.97,-6.136901689732509
CCOC(=O)C1=C(CN2CCCN(C(=O)c3ccc(F)cc3)CC2)N(C)C(=O)N[C@@H]1c1ccsc1,C35643762_decoy,TRY1,Decoy,0,-6.88742,-6.62,-2.73,-6.864498692098727
CCOC(=O)C1=C(CN2CCN(C(=O)c3ccc(F)cc3)[C@H](C)C2)N(C)C(=O)N[C@H]1c1ccsc1,C36001531_decoy,TRY1,Decoy,0,-8.63804,-5.7,-4.17,-6.087400403002638
Cc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C[C@H]3CCCO3)N(Cc3ccccc3)Cc3ccco3)cc2c1,C33936797_decoy,TRY1,Decoy,0,-7.89153,-8.08,-3.8,-8.17774867667423
Cc1ccc([C@@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(Cc2ccco2)C(=O)c2ccco2)cc1,C36498935_decoy,TRY1,Decoy,0,-8.18454,-8.18,-2.62,-9.023769513904316
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc(Cl)cc2)N(Cc2ccco2)C(=O)CCl)cc1,C36503478_decoy,TRY1,Decoy,0,-9.44627,-7.14,-2.2,-8.703196736999116
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccccc2)N(Cc2ccco2)C(=O)c2ccc(F)cc2)cc1,C36506282_decoy,TRY1,Decoy,0,-8.42134,-8.24,-3.17,-8.142733394884711
CCCN(C(=O)COC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(Cl)cccc1Cl,C36576909_decoy,TRY1,Decoy,0,-7.7785,-6.65,-3.13,-6.146405182896849
CCc1nnc(NC(=O)COc2ccc(/C=C3\SC(=S)N(Cc4ccco4)C3=O)cc2OC)s1,C39793596_decoy,TRY1,Decoy,0,-9.97167,-7.67,-2.91,-7.084984011344895
CCn1c(NCc2ccccc2Cl)c(/C=C2/SC(=S)N(CCOC)C2=O)c(C)c(C#N)c1=O,C39851443_decoy,TRY1,Decoy,0,-8.8012,-6.04,-1.66,-6.416262404212805
CCOCCCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(C)c2NCc2ccccc2Cl)SC1=S,C39851613_decoy,TRY1,Decoy,0,-8.05292,-7.52,-3.21,-6.552774141506888
CCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(C)c2NCCc2ccc(OC)c(OC)c2)SC1=S,C40066568_decoy,TRY1,Decoy,0,-8.76157,-5.37,-2.69,-5.718424449431573
COc1cc(C(=O)N2[C@@H](C(=O)NC3CC3)CS[C@H]2c2ccc(C(F)(F)F)cc2)cc(OC)c1OC,C00965906_decoy,TRY1,Decoy,0,-8.0772,-6.51,-4.58,-7.611765769525359
[H]/N=C1C(=C/c2cn(CCOc3ccc(CC=C)cc3OC)c3ccccc23)/C(=O)N=C2SC(CC)=NN2/1,C09635667_decoy,TRY1,Decoy,0,-8.15713,-8.29,-4.06,-6.860778159340636
CC(C)(C)OC(=O)NCC(=O)/N=C1\S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(OC(F)(F)F)cc1,C32507589_decoy,TRY1,Decoy,0,-7.71299,-5.27,-2.16,-5.478645102980057
[H]/N=C1C(=C/c2ccc(OCCCOc3ccc(Cl)cc3)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077773_decoy,TRY1,Decoy,0,-9.75106,-6.56,-3.75,-5.385672889714426
[H]/N=C1C(=C\c2ccc(O[C@@H](C)c3ccccc3)c(OC)c2)/C(=O)N=C2SC(COc3ccccc3)=NN2/1,C08984549_decoy,TRY1,Decoy,0,-8.51319,-7.06,-1.18,-6.01782459877522
COc1cc([C@H]2C3=C(c4cc(Cl)c(C)cc4O)N=N[C@@H]3C(=O)N2Cc2cccnc2)cc(OC)c1OC,C09123965_decoy,TRY1,Decoy,0,-9.05078,-6.46,-1.86,-6.934077432447775
[H]/N=C1C(=C/c2cc(Cl)c(OCCOc3ccccc3Cl)c(OC)c2)/C(=O)N=C2SC(CC)=NN2/1,C27549813_decoy,TRY1,Decoy,0,-8.55473,-6.44,-3.05,-6.070306377418134
[H]/N=C1C(=C\c2ccc(OCCOc3ccccc3Cl)cc2)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206682_decoy,TRY1,Decoy,0,-9.0159,-7.51,-2.23,-6.228811265326407
[H]/N=C1C(=C\c2ccc(OCCCOc3cccc(C)c3)cc2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C20208422_decoy,TRY1,Decoy,0,-9.87317,-7.54,-2.74,-6.195412818026013
COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)C[C@@H](c2ccco2)C3)cc1OC(=O)N1CCOCC1,C00717446_decoy,TRY1,Decoy,0,-7.61968,-6.26,-3.24,-5.302973278132152
COc1nsnc1NS(=O)(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1,C02138886_decoy,TRY1,Decoy,0,-9.76459,-6.03,-2.54,-6.381653217724888
COCCCN1C(=O)/C(=C/c2c(N3CCC(C(N)=O)CC3)nc3ccccn3c2=O)SC1=S,C02374802_decoy,TRY1,Decoy,0,-9.69007,-7.39,-2.98,-6.974348168463217
CN(C)c1ccc([C@@H](CNS(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2O)S(=O)(=O)c2ccc(F)cc2)cc1,C09080497_decoy,TRY1,Decoy,0,-9.43722,-7.69,-2.26,-9.611359234402958
Cc1ccc(S(=O)(=O)[C@H](CNS(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2O)c2cccs2)cc1C,C09103743_decoy,TRY1,Decoy,0,-9.56946,-7.81,-3.11,-9.056297274660237
CC(C)c1ccc(S(=O)(=O)[C@@H](CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)c2cccs2)cc1,C09105113_decoy,TRY1,Decoy,0,-9.40274,-7.48,-2.49,-7.831704845274204
O=C(NCc1ccco1)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1,C09489986_decoy,TRY1,Decoy,0,-8.4719,-8.41,-1.89,-7.640953034876605
O=C(NCc1ccccc1Cl)C(=O)NC[C@H]1OCCCN1S(=O)(=O)c1cc(F)ccc1F,C09577368_decoy,TRY1,Decoy,0,-8.69596,-7.72,-2.25,-6.247614883959745
Cn1c(N)c(C(=O)COC(=O)c2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)c(=O)n(C)c1=O,C03291853_decoy,TRY1,Decoy,0,-8.75728,-9.27,-4.13,-8.802046614975653
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl,C12568909_decoy,TRY1,Decoy,0,-8.41938,-7.06,-3.25,-5.57978163709815
O=c1[nH]c2cc3c(cc2cc1CN(CCCO)S(=O)(=O)c1cccc(C(F)(F)F)c1)OCCO3,C06445398_decoy,TRY1,Decoy,0,-8.95479,-8.34,-1.77,-7.009325401651288
CCOc1ccc(N2C(=O)/C(=C/c3cn(CC(=O)NCCOC)c4ccccc34)C(=O)NC2=S)cc1,C06089857_decoy,TRY1,Decoy,0,-8.69751,-6.86,-1.16,-6.171619136341339
Cc1cc(NC(=O)CCC(=O)N(c2cccc(F)c2)[C@H](C(=O)NC2CCCC2)c2cccnc2)no1,C13505794_decoy,TRY1,Decoy,0,-8.61069,-7.32,-3.94,-7.921883271916707
O=C(NNC(=O)c1ccccc1Br)c1cc(S(=O)(=O)N2CCOCC2)ccc1F,C15346691_decoy,TRY1,Decoy,0,-9.19323,-6.47,-1.89,-6.110684838549094
CC[C@@H]1Sc2ccc(S(=O)(=O)CCC(=O)Nc3cc(OC)c(OC)c(OC)c3)cc2NC1=O,C15678498_decoy,TRY1,Decoy,0,-8.99001,-7.19,-1.83,-6.250221360968857
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccc(Br)cc1,C16024596_decoy,TRY1,Decoy,0,-9.06608,-7.08,-2.82,-5.975721863789909
COc1cc(/C=C2\SC(=O)N(CCNC(=O)c3ccc4n[nH]nc4c3)C2=O)ccc1OC(F)F,C16496888_decoy,TRY1,Decoy,0,-8.14155,-8.52,-4.57,-7.043049162729491
COc1ccc([C@@H](c2c(O)n3c(nc2=O)SCC3)c2c(O)nc3n(c2=O)CCS3)cc1OC,C16946199_decoy,TRY1,Decoy,0,-8.43741,-7.35,-1.47,-7.278308163561742
CCN(CC)c1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)[C@H]1CC(=O)Nc2ccccc21,C22310183_decoy,TRY1,Decoy,0,-8.13271,-5.92,-2.15,-5.218914682775065
CCC(=O)N(c1nnc(SCC(=O)NN2C(=O)N[C@@](CC)(c3ccccc3)C2=O)s1)C1CC1,C24172962_decoy,TRY1,Decoy,0,-7.04778,-7.7,-2.23,-6.5841455808127085
O=C1CN(c2ccc(NC(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)cn2)CCN1,C27268222_decoy,TRY1,Decoy,0,-10.2991,-5.72,-1.64,-5.6763595796923925
Cc1c(CN(C)C[C@@H](O)c2ncccn2)sc2c(=O)c(C(=O)NCc3ccc(F)cc3)cn(C)c12,C28822565_decoy,TRY1,Decoy,0,-8.87817,-7.39,-2.16,-6.321899785617429
Cc1ccc(-c2n[nH]c(=S)n2CCC(=O)NCCN2C(=O)S/C(=C\c3cccnc3)C2=O)cc1,C30630620_decoy,TRY1,Decoy,0,-9.50779,-8.01,-2.22,-7.325151859911415
CS[C@H](C)C(=O)Nc1nnc(S[C@@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)s1,C32636197_decoy,TRY1,Decoy,0,-7.87551,-7.93,-2.48,-7.529473467792951
Cc1ccc(NC(=O)c2nnc(C(=O)N3CCC[C@@H](C(=O)NCCN4CCOCC4)C3)s2)cc1,C33263278_decoy,TRY1,Decoy,0,-9.09672,-7.81,-4.21,-6.504914597407183
CC(C)[C@@]1(C)CC[C@H](C(=O)Nc2ccc(NC(=O)[C@]34CC[C@](C)(C(=O)C3=O)C4(C)C)cc2)C(=O)C1=O,C35982077_decoy,TRY1,Decoy,0,-8.39976,-5.55,-3.56,-5.218384921779781
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)NNC(=O)c3ccc(F)cc3)nc(C(C)C)nc21,C36807508_decoy,TRY1,Decoy,0,-9.24283,-7.09,-2.86,-6.367348741471837
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(SCC(=O)NC[C@@H]4CCCO4)s3)CC2=O)cc1C,C09517975_decoy,TRY1,Decoy,0,-10.7761,-7.73,-2.46,-7.092286542566941
COc1cc(NC(=O)C2CCN(C(=O)c3sc4nc[nH]c(=O)c4c3C)CC2)cc(OC)c1OC,C08600253_decoy,TRY1,Decoy,0,-8.26454,-7.07,-3.61,-5.66043919516334
Cc1cc(NC(=O)CCC(=O)N(c2cccc(F)c2)[C@H](C(=O)NC2CCCC2)c2ccncc2)no1,C04092309_decoy,TRY1,Decoy,0,-8.07431,-7.59,-3.02,-6.413597750079739
Cc1cc(C)c2oc3c(c(=O)c2c1)[C@@H](c1ccc(OCC(N)=O)cc1)N([C@@H]1CCS(=O)(=O)C1)C3=O,C38648952_decoy,TRY1,Decoy,0,-8.7774,-7.62,-2.47,-6.261338379836691
Cc1cc(C)c2oc3c(c(=O)c2c1)[C@H](c1ccc(OCC(N)=O)cc1)N([C@H]1CCS(=O)(=O)C1)C3=O,C38648955_decoy,TRY1,Decoy,0,-8.1122,-6.93,-1.65,-6.151930693583336
COc1ccc(CCN2C(=O)/C(=C\[C@H]3[NH+]=c4ccccc4=C3CCNC(C)=O)C(=O)N=C2[O-])cc1OC,C38557206_decoy,TRY1,Decoy,0,-9.31207,-5.94,-2.92,-6.145433029756113
CC(C)S(=O)(=O)C1=C[C@H]2C[C@@H]3CO[P@](=O)(S(=O)(=O)Oc4ccccc4)NN3C[C@@H]2C=C1O,C39469799_decoy,TRY1,Decoy,0,-7.47705,-6.13,-2.17,-4.679229673428353
CC(C)S(=O)(=O)[P@@]1(=O)NN2C[C@@H]3C=C(S(=O)(=O)Oc4ccccc4)C(O)=C[C@@H]3C[C@@H]2CO1,C39469896_decoy,TRY1,Decoy,0,-8.09993,-7.55,-4.06,-5.894004446877193
O=CC[C@H](NC=O)c1ccc(O)c(S(=O)(=O)Oc2ccccc2)c1S(=O)(=O)c1ccccc1,C39498364_decoy,TRY1,Decoy,0,-6.42951,-4.83,-3.51,-5.386568062231516
CC(C)S(=O)(=O)C1=C2Nc3ccccc3C[NH+]2[C@@H](C(=O)N(Cc2ccccc2)S(=O)(=O)C(C)C)C1,C39542943_decoy,TRY1,Decoy,0,-7.64983,-8.14,-2.27,-6.613806224153392
CCON(C(=O)[C@H]1CC(S(=O)(=O)Oc2ccccc2)=C2Nc3ccccc3C[NH+]21)S(=O)(=O)C(C)C,C39546046_decoy,TRY1,Decoy,0,-8.3872,-4.96,-2.1,-5.027414779248811
CC[C@H](CO)Nc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N([C@H]2CCS(=O)(=O)C2)C1=O,C40008012_decoy,TRY1,Decoy,0,-10.1856,-7.31,-1.58,-6.801825171171505
Nn1c(SCC(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1Br,C17724755_decoy,TRY1,Decoy,0,-8.35133,-7.35,-4.25,-7.245117487418813
COc1cc([C@@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2[C@H]2CCS(=O)(=O)C2)cc(OC)c1OC,C40547622_decoy,TRY1,Decoy,0,-7.27902,-7.8,-1.56,-9.339089071326494
Cc1c([C@H]2[NH2+][C@](CC(C)C)(C(=O)[O-])[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]23)c(=O)n(-c2ccccc2)n1C,C43211771_decoy,TRY1,Decoy,0,-5.85843,-6.43,-2.76,-5.009017111027874
CC(C)OCCCn1c(S[C@@H](C)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)nc2ccccc2c1=O,C09621177_decoy,TRY1,Decoy,0,-9.53348,-6.34,-1.43,-5.966088911856322
CC(C)OCCCn1c(S[C@H](C)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)nc2ccccc2c1=O,C09621180_decoy,TRY1,Decoy,0,-7.21253,-8.32,-3.65,-7.192729283459629
CS(=O)(=O)N1CCCc2ccc(NC(=O)C(=O)NC[C@H](c3cccs3)N3CCOCC3)cc21,C49487863_decoy,TRY1,Decoy,0,-10.7345,-6.99,-2.03,-6.361208332670474
[H]/N=c1/c(=C/c2ccc(-c3ccc(C(=O)OC)cc3)o2)c(=O)nc2s/c(=C/C(=O)N3CCCC3)[nH]n1-2,C20332927_decoy,TRY1,Decoy,0,-8.75139,-6.5,-3.26,-5.712804684000044
[H]/N=c1/c(=C/c2ccc(O[C@H](C)c3ccccc3)cc2)c(=O)nc2s/c(=C/C(=O)N3CCOCC3)[nH]n1-2,C20357481_decoy,TRY1,Decoy,0,-7.79665,-8.82,-3.97,-5.51079093153426
CC1(C)CC(=O)C2(NO[C@@H]3C(=O)N(CCNc4ncc(C(F)(F)F)cc4Cl)C(=O)[C@H]32)C(=O)C1,C18245906_decoy,TRY1,Decoy,0,-7.232,-8.13,-1.85,-5.490596157746583
COCCNC(=O)[C@]1(C)Cn2cnc(C(=O)Nc3ccc(Br)c(C)c3)c2C(=O)N1C1CC1,C64954598_decoy,TRY1,Decoy,0,-8.80182,-6.42,-2.32,-7.224316846090671
CC(=O)c1ccc(NC(=O)Cn2cnc3nc(N4CCC(C(=O)NC5CC5)CC4)sc3c2=O)cc1,C67225607_decoy,TRY1,Decoy,0,-10.7993,-6.96,-3.25,-7.043607044755387
COc1ccc(NC(=O)O[C@@H]2CC[C@]3(C)[C@@H](CC[C@@H](O)[C@H]3CC(=O)NCc3ccco3)[C@]2(C)CO)cc1,C04236655_decoy,TRY1,Decoy,0,-9.50426,-8.07,-2.38,-7.429565369909166
COc1cc(NS(=O)(=O)c2ccc(Nc3nc(-c4ccc(O)c(O)c4)cs3)cc2)nc(OC)n1,C09553698_decoy,TRY1,Decoy,0,-9.14689,-8.42,-1.78,-7.184232314016071
COc1cccc(/C=N/NC(=O)[C@@H](NC(=O)c2ccc(Cl)cc2Cl)C(C)C)c1OCC(N)=O,C10041776_decoy,TRY1,Decoy,0,-9.23048,-6.99,-2.6,-9.147652573126631
COCCN(C(=O)CNc1ccc(Br)cc1F)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C11724971_decoy,TRY1,Decoy,0,-8.72336,-6.73,-1.49,-7.564679208525093
CC(=O)N[C@H]1[C@@H](O/N=C2/C(=O)N(CCOc3ccccc3C)c3ccc(C)cc32)O[C@H](CO)[C@H](O)[C@H]1O,C12636379_decoy,TRY1,Decoy,0,-6.65548,-7.98,-2.15,-5.460912575547422
CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1,C16320850_decoy,TRY1,Decoy,0,-9.07263,-6.93,-2.65,-6.636262620858979
COc1ccc(OCc2nnc(SCc3nc(N)nc(N)n3)n2-c2ccc(C)c(Cl)c2)cc1,C17671059_decoy,TRY1,Decoy,0,-9.93124,-8.46,-1.56,-10.321484650770053
COc1cc(/C=N/Nc2nnc(SCCC(=O)NCc3ccco3)n2N)cc(OC)c1OC,C20920180_decoy,TRY1,Decoy,0,-8.70933,-6.78,-3.43,-6.11137607119564
COc1cc(/C=N/Nc2nnc(SCC(=O)Nc3cc(C)cc(C)c3)n2N)cc(OC)c1OC,C20920323_decoy,TRY1,Decoy,0,-9.19455,-6.5,-1.62,-6.855586122786531
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)Nc3ccc(Br)cc3)n2N)cn1,C20921239_decoy,TRY1,Decoy,0,-9.1598,-7.47,-4.06,-6.86301326517489
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)Nc3cc(Cl)ccc3Cl)n2N)cn1,C20921299_decoy,TRY1,Decoy,0,-9.49988,-7.62,-4.47,-7.7346889250982835
COc1ccc(/C(C)=N/Nc2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)cc1,C20923675_decoy,TRY1,Decoy,0,-9.38219,-8.24,-1.22,-7.237383848815251
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CSc2nnc(COc3ccccc3F)n2N)C1=O,C24140539_decoy,TRY1,Decoy,0,-7.67942,-9.15,-2.36,-7.203137375606456
CC(C)[C@H](NC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2,C24275757_decoy,TRY1,Decoy,0,-6.94015,-7.38,-2.87,-5.654846546669964
CCCCn1c(N)c(N(CCC)CC(=O)NCC2(N3CCOCC3)CCCCC2)c(=O)[nH]c1=O,C25074256_decoy,TRY1,Decoy,0,-8.39813,-7.23,-1.42,-11.789975630760049
CNC(=O)c1cccnc1SC[C@@H]1C[C@H](SC2=C(C(=O)[O-])N3C(=O)[C@H]([C@@H](C)O)[C@H]3[C@H]2C)C[NH2+]1,C26477898_decoy,TRY1,Decoy,0,-8.73366,-7.39,-2.5,-6.267918136043903
CC[C@@H](C)n1c(COc2ccc(C)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594338_decoy,TRY1,Decoy,0,-7.43284,-7.84,-1.09,-7.766168595460747
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccc([N+](=O)[O-])c1,C36504788_decoy,TRY1,Decoy,0,-6.62798,-5.54,-4.81,-5.47449362923039
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccc([N+](=O)[O-])cc1,C36506460_decoy,TRY1,Decoy,0,-6.93915,-5.68,-2.01,-5.8899799815441565
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1cccc([N+](=O)[O-])c1,C36601344_decoy,TRY1,Decoy,0,-7.46261,-6.2,-3.39,-6.948660287396876
COCC(=O)N(Cc1ccc(C)o1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36602009_decoy,TRY1,Decoy,0,-6.57057,-5.58,-1.09,-5.449775968912332
CCCOc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccc(OCC(N)=O)c(OC)c4)[C@H]32)cc1,C08568183_decoy,TRY1,Decoy,0,-7.10384,-5.34,-2.31,-5.197736103128167
COc1ccc(N2C(SCC(=O)Nc3ccc(C)cc3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362287_decoy,TRY1,Decoy,0,-8.41058,-8.31,-3.08,-7.361825572427724
COc1ccc(N2C(SCC(=O)Nc3cccc(C)c3C)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362289_decoy,TRY1,Decoy,0,-7.84051,-7.28,-1.68,-6.693736028395266
CCOc1ccc(N2C(SCC(=O)NC3CCCCC3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362560_decoy,TRY1,Decoy,0,-8.26911,-7.38,-3.4,-6.948293563724599
COc1ccccc1NC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1,C39362795_decoy,TRY1,Decoy,0,-8.25067,-8.14,-1.47,-7.163417663820479
O=C(Cc1ccc([N+](=O)[O-])cc1)NNc1ncnc(NNC(=O)c2ccccc2Cl)c1[N+](=O)[O-],C40658282_decoy,TRY1,Decoy,0,-7.92634,-7.19,-1.81,-7.07363776282021
O=C(NNc1ncnc(NNC(=O)C(c2ccccc2)c2ccccc2)c1[N+](=O)[O-])c1ccco1,C40659150_decoy,TRY1,Decoy,0,-7.9386,-8.33,-3.04,-7.681962706917164
C=CCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)NCc2ccc3c(c2)OCO3)[C@]1(C)CO,C43553767_decoy,TRY1,Decoy,0,-8.87415,-7.66,-3.55,-7.842086830514032
COc1ccc(NC(=O)O[C@@H]2CC[C@@]3(C)[C@@H](CC[C@@H](O)[C@H]3CC(=O)NCc3ccco3)[C@]2(C)CO)cc1,C43553843_decoy,TRY1,Decoy,0,-8.39072,-8.29,-2.38,-6.912137105773807
CCO/C([O-])=C1\C(COCC[NH2+]C(C)(C)C(N)=O)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C27655991_decoy,TRY1,Decoy,0,-9.42663,-5.4,-2.69,-6.362581459297344
COc1cccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccc(C)cc2)c1O,C01900565_decoy,TRY1,Decoy,0,-9.64859,-7.96,-2.26,-8.002662655915964
C[NH+](C)[C@H](CNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1,C39987642_decoy,TRY1,Decoy,0,-7.45672,-8.23,-1.77,-7.016555052837514
COc1cc(/C=N/Nc2nc(SCc3nc4ccc([N+](=O)[O-])cc4[nH]3)n[nH]2)cc([N+](=O)[O-])c1O,C21084199_decoy,TRY1,Decoy,0,-8.66636,-6.6,-4.28,-5.890615231288295
CC[NH+](CC)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(OC)c(OC)c3)n2)cc1,C58995493_decoy,TRY1,Decoy,0,-9.99266,-7.66,-2.52,-9.742560547939648
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)NCCc1ccccc1Cl,C58997516_decoy,TRY1,Decoy,0,-8.47045,-6.28,-2.97,-5.6688123428347845
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(CC=C)c3O)n2)s1,C59004845_decoy,TRY1,Decoy,0,-9.80721,-7.55,-4.05,-7.776901666662408
CC(=O)Nc1cccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(Cl)cc3Cl)n2)c1,C59014452_decoy,TRY1,Decoy,0,-10.3359,-8.93,-2.41,-11.71769704120678
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n[nH]2)c(O)c1,C59039079_decoy,TRY1,Decoy,0,-8.12289,-7.72,-2.44,-8.212384391504637
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc4c(c3)OCO4)n[nH]2)c(O)c1,C59039120_decoy,TRY1,Decoy,0,-10.1188,-6.96,-3.27,-8.210101243836299
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc4c(c3)OCCO4)n[nH]2)c(O)c1,C59039132_decoy,TRY1,Decoy,0,-10.4891,-7.03,-1.55,-6.896667503949991
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n[nH]2)c(O)c1,C59039180_decoy,TRY1,Decoy,0,-8.68614,-6.52,-4.87,-6.269736402112303
COc1cc(/C=N/Nc2nc(SCC(=O)NC3C4CC5CC(C4)CC3C5)n[nH]2)c([N+](=O)[O-])cc1O,C59039966_decoy,TRY1,Decoy,0,-9.09575,-8.2,-3.75,-8.07993730033377
COc1cc(CNC(=O)CSc2n[nH]c(N/N=C/c3cc(OC)c(O)cc3[N+](=O)[O-])n2)cc(OC)c1,C59039994_decoy,TRY1,Decoy,0,-8.59705,-8.36,-3.3,-10.090123907049984
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)cc3F)n[nH]2)c([N+](=O)[O-])cc1O,C59040029_decoy,TRY1,Decoy,0,-9.16901,-9.23,-2.25,-10.70322647771768
Nn1c(N/N=C/c2ccc([N+](=O)[O-])cc2)nnc1SCC(=O)Nc1cccc(Cl)c1Cl,C20292045_decoy,TRY1,Decoy,0,-9.28276,-9.71,-2.77,-9.393235275202224
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(NC(C)=O)cc3)n[nH]2)cc1,C59813703_decoy,TRY1,Decoy,0,-7.46225,-6.3,-2.39,-6.055833068788215
CC[C@@H](C)c1ccc(NC(=O)CCSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1,C59888274_decoy,TRY1,Decoy,0,-9.7521,-5.73,-4.29,-5.550850055697569
COc1cccc(/C=N/NC(=O)C2=NC(C)=C(C(=O)N/N=C/c3cccc(OC)c3O)[C@@H]2C)c1O,C63129339_decoy,TRY1,Decoy,0,-10.7399,-8.36,-2.28,-7.207595956637786
CCCOc1ccc(C2=NN=C3OC(N)=C(C#N)[C@H](c4ccc(OCC(N)=O)c(OC)c4)[C@@H]32)cc1,C08568181_decoy,TRY1,Decoy,0,-8.14047,-6.54,-1.23,-6.578892015603863
Nc1nc(N)c2cc(CC[NH+]3CCOCC3)c(-c3ccc(F)cc3)nc2n1,C04002753_decoy,TRY1,Decoy,0,-8.14178,-1.37,0.07,-3.683687568971821
COc1cc([C@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2CC[NH3+])ccc1O,C05489797_decoy,TRY1,Decoy,0,-8.74022,-7.4,-3.59,-9.208325080127697
[NH3+][C@H](c1ccccc1)[C@@H](NS(=O)(=O)c1ccc(O)cc1)c1ccccc1,C03850990_decoy,TRY1,Decoy,0,-6.45061,-7.93,-1.99,-7.347871416952149
[NH3+][C@@H](c1ccccc1)[C@@H](NS(=O)(=O)c1ccc(O)cc1)c1ccccc1,C03850988_decoy,TRY1,Decoy,0,-7.78976,-6.99,-0.89,-6.279421352007527
[NH3+][C@H](c1ccccc1)[C@H](NS(=O)(=O)c1ccc(O)cc1)c1ccccc1,C03850986_decoy,TRY1,Decoy,0,-6.89847,-7.15,-1.51,-7.587968821370006
[NH3+][C@@H](c1ccccc1)[C@H](NS(=O)(=O)c1ccc(O)cc1)c1ccccc1,C03850984_decoy,TRY1,Decoy,0,-6.48898,-6.32,-5.04,-5.486868489534186
CCCCn1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccc(C)cc32)c1=O,C09332357_decoy,TRY1,Decoy,0,-7.75961,-6.79,-2.27,-5.922805695695292
CC[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2c(O)[nH]c(=O)n(-c3ccc(OC)cc3)c2=O)[NH2+]1,C12892349_decoy,TRY1,Decoy,0,-8.4223,-6.86,0.14,-5.777369344092813
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2c(Cl)cc(C)cc23)c1,C13609431_decoy,TRY1,Decoy,0,-7.61044,-6.62,-2.29,-5.788923704755307
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)nc(O)n(-c2ccccc2C)c1=O,C09329748_decoy,TRY1,Decoy,0,-8.19308,-7.15,-0.78,-4.971095464636964
CCc1ccc(-n2c(O)nc(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)cc1,C09108658_decoy,TRY1,Decoy,0,-8.34201,-8.63,-3.09,-6.502287665027066
COc1cccc([C@@H]2CC(c3ccccc3O)=NC3(CC[NH2+]CC3)N2)c1O,C15830196_decoy,TRY1,Decoy,0,-7.30716,-6.15,-0.93,-4.479737139382576
COc1cccc([C@H]2CC(c3ccccc3O)=NC3(CC[NH2+]CC3)N2)c1O,C15830198_decoy,TRY1,Decoy,0,-8.28597,-7.02,-1.4,-5.67274425991716
CCCC[C@@H]1C[C@@](C)(c2csc(NCCCNC(N)=S)[nH+]2)OC1=O,C27828729_decoy,TRY1,Decoy,0,-9.09923,-4.38,-2.44,-5.198971841712603
N#Cc1c(C2CC[NH2+]CC2)cc(-c2c(O)cccc2OCc2ccccc2)nc1N,C28367932_decoy,TRY1,Decoy,0,-8.71795,-5.62,-5.87,-5.010258676849862
[NH3+]Cc1ccc(-c2nc(-c3ccc(Cl)c(O)c3)c(-c3ccncc3)[nH]2)cc1,C28563646_decoy,TRY1,Decoy,0,-9.49081,-8.13,-0.46,-7.960015027074856
CN(C)S(=O)(=O)c1ccc(CCCCc2ccc(N3C(N)=NC(N)=[NH+]C3(C)C)cc2Cl)c(Cl)c1,C17127912_decoy,TRY1,Decoy,0,-9.10845,-5.67,-2.51,-9.662855808508167
C[C@H](NC(=O)c1coc([C@@H]([NH3+])[C@@H](C)O)n1)c1ccc(Br)cc1,C33635733_decoy,TRY1,Decoy,0,-8.90037,-5.41,-4.12,-5.927874328566586
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H]([C@@H](C)O)[NH2+][C@]12C(=O)Nc1ccccc12,C35877469_decoy,TRY1,Decoy,0,-7.93843,-7.62,-1.13,-6.394230840914449
O=C(NCCc1ccc(O)cc1)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228124_decoy,TRY1,Decoy,0,-9.37199,-10.34,-1.21,-8.553296952924454
CC(C)OCc1ccc(C(=O)NNC(=O)c2c[nH+]c3ccccc3c2N)o1,C40345914_decoy,TRY1,Decoy,0,-8.29122,-6.48,-0.56,-7.031600778023319
C[NH+]1CCN(Nc2ncnc(Nc3ccccc3C(F)(F)F)c2N)CC1,C40701758_decoy,TRY1,Decoy,0,-7.88027,-6.84,-1.83,-5.322801961766693
C[NH+]1CCN(Nc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2N)CC1,C40704061_decoy,TRY1,Decoy,0,-9.33754,-5.23,-1.48,-5.734637090061445
C[NH+]1CCN(Nc2ncnc(Nc3cc(Cl)ccc3Cl)c2N)CC1,C40756865_decoy,TRY1,Decoy,0,-8.38156,-5.39,-3.18,-5.004340928076898
C[NH+]1CCN(Nc2ncnc(Nc3ccc(Cl)cc3Cl)c2N)CC1,C40756919_decoy,TRY1,Decoy,0,-8.29756,-5.87,-1.59,-5.603620285785321
C[NH+]1CCN(Nc2ncnc(Nc3ccc(C(F)(F)F)cc3)c2N)CC1,C40757023_decoy,TRY1,Decoy,0,-7.18433,-7.24,-2.44,-5.079470155968001
Cc1ccc(CNc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40783828_decoy,TRY1,Decoy,0,-7.80073,-8.62,-2.21,-6.703642267104657
Cc1c(C(=O)Oc2ccc(Cl)cc2Cl)oc2c1/C(=N/NC(N)=[NH2+])CCC2,C40824991_decoy,TRY1,Decoy,0,-10.6569,-7.34,-1.35,-9.38213608220127
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)Nc2ccc3c(c2)OCO3)co1,C43217042_decoy,TRY1,Decoy,0,-9.12543,-8.75,-2.04,-8.130650273436803
C[C@H](NC(=O)c1coc([C@@H]([NH3+])[C@H](C)O)n1)c1ccc(Br)cc1,C43218185_decoy,TRY1,Decoy,0,-8.95613,-4.85,-3.07,-4.606764149480021
C[NH+]1CCC(NC(=O)c2ccc(Br)cc2O)(C(N)=S)CC1,C44483957_decoy,TRY1,Decoy,0,-7.75014,-5.01,-0.54,-4.630609603000818
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)NC1CC[NH+](C2CC2)CC1,C45410327_decoy,TRY1,Decoy,0,-8.32214,-6.48,-1.17,-6.788173066630259
CC(C)[C@H](CNC(=O)NNC(=S)NC1CCCC1)[NH+]1CCCCCC1,C45534492_decoy,TRY1,Decoy,0,-10.0167,-5.6,-1.47,-5.99322282788776
NC(=O)Cc1ccccc1NC(=O)NCC1([NH+]2CCCCC2)CCCCC1,C45725517_decoy,TRY1,Decoy,0,-8.1925,-5.84,-1.18,-6.026182034176173
CC1CC[NH+](Cc2csc(NC(=O)CSc3n[nH]c(N)n3)n2)CC1,C53335687_decoy,TRY1,Decoy,0,-9.27561,-7.48,-1.12,-8.174007211825252
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccncc1,C40687581_decoy,TRY1,Decoy,0,-7.34617,-7.84,-0.6,-7.202694144797424
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)NNC(=S)NC2CCCC2)C1,C54726722_decoy,TRY1,Decoy,0,-7.91115,-6.79,-2.19,-6.419654345827316
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)NNC(=S)NC2CCCC2)C1,C54726725_decoy,TRY1,Decoy,0,-8.27906,-5.97,-1.65,-5.3979994051078135
CC1(C)CC(NC(=O)NC[C@H](O)COc2ccc(F)cc2)CC(C)(C)[NH2+]1,C56541138_decoy,TRY1,Decoy,0,-8.06742,-7.71,-2.55,-7.913383227149202
CC1(C)CC(NC(=O)NC[C@@H](O)COc2ccc(F)cc2)CC(C)(C)[NH2+]1,C56541140_decoy,TRY1,Decoy,0,-8.07846,-8.0,-2.4,-6.375771019018029
C[NH+](C)[C@@H](CNC(=O)NNC(=S)NC1CCCC1)c1ccc(F)cc1,C56949996_decoy,TRY1,Decoy,0,-8.4707,-6.83,-2.31,-6.570490259289992
NC(=O)c1c(/[NH+]=c2\oc3ccccc3cc2C(N)=O)sc2c1CCCC2,C04177577_decoy,TRY1,Decoy,0,-9.75659,-5.39,-1.56,-5.725958597312185
Cc1ccc(NC(=O)c2cc3ccc(O)cc3o/c2=[NH+]\c2ccc(S(N)(=O)=O)cc2)cc1,C59170410_decoy,TRY1,Decoy,0,-9.21715,-8.63,-0.55,-8.223067926691998
CC[NH2+][C@@H](C)c1ccc(Sc2nc(N)cc(=O)[nH]2)c(Br)c1,C61700329_decoy,TRY1,Decoy,0,-8.79221,-5.34,-1.24,-6.637931459029658
CC[NH2+][C@H](C)c1ccc(Sc2nc(N)cc(=O)[nH]2)c(Br)c1,C61700330_decoy,TRY1,Decoy,0,-8.52958,-6.12,-1.72,-7.702302000287417
CCc1[nH]c([C@@H]2CC(=O)Nc3cc(N4CCCC4)c(C(N)=O)cc32)c(C)[nH+]1,C65463147_decoy,TRY1,Decoy,0,-7.43254,-5.96,-1.52,-5.411280424256725
CCc1[nH]c([C@H]2CC(=O)Nc3cc(N4CCCC4)c(C(N)=O)cc32)c(C)[nH+]1,C65463149_decoy,TRY1,Decoy,0,-7.43807,-4.94,-1.95,-3.6605939554824833
CC(=O)Nc1cc(NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(F)cc1F,C66980195_decoy,TRY1,Decoy,0,-7.43778,-6.33,-2.24,-5.485816976798846
Cc1cccc(NC(=O)c2cc3ccc(O)cc3o/c2=[NH+]\c2ccc(C(N)=O)cc2)n1,C67297877_decoy,TRY1,Decoy,0,-8.31158,-8.68,-1.64,-6.938235473407467
Nc1nc(N)nc(C[NH+]2CCN(Cc3cccc(Cl)c3Cl)CC2)n1,C67403556_decoy,TRY1,Decoy,0,-7.39705,-7.72,-2.62,-6.647976751212217
CC1(C)CC(NC(=S)Nc2ccc(S(N)(=O)=O)cc2)CC(C)(C)[NH2+]1,C03641017_decoy,TRY1,Decoy,0,-9.32308,-5.17,-1.91,-4.943710227116728
NC(=O)C[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C04085132_decoy,TRY1,Decoy,0,-8.89848,-7.41,-1.05,-6.991740804676646
CN(C)c1ccc(/C=N/NC(=[NH2+])c2nonc2N)cc1Br,C05393758_decoy,TRY1,Decoy,0,-8.65721,-6.9,-1.03,-8.598887847547942
COC(=O)c1c(NC(=O)c2cc3ccc4ccccc4c3oc2=[NH2+])sc(C(N)=O)c1C,C17099489_decoy,TRY1,Decoy,0,-9.06947,-5.28,-1.7,-5.785912547538126
CN(C(=O)CCc1ccc(N2C(N)=NC(N)=[NH+]C2(C)C)cc1)c1ccccc1,C16954279_decoy,TRY1,Decoy,0,-9.88902,-7.43,-2.61,-7.949884845097519
CCCOc1cccc(O)c1-c1cc(C2CC[NH2+]CC2)c(C#N)c(N)n1,C28367369_decoy,TRY1,Decoy,0,-8.41502,-7.56,-0.84,-7.628480174710301
CNC(=O)C1CC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C29162343_decoy,TRY1,Decoy,0,-8.66789,-6.76,-1.39,-6.129857670035826
CS(=O)(=O)NCCNc1c(N)c[nH+]c2ccc(Br)cc12,C36813171_decoy,TRY1,Decoy,0,-7.24161,-5.62,-2.6,-4.8573337538622186
C[C@]([NH3+])(C(=O)N(CC(N)=O)Cc1ccc(Br)cc1)C1CC1,C37822346_decoy,TRY1,Decoy,0,-6.98524,-5.37,-1.62,-6.024169452946078
COc1ccc([C@@H]2[NH+]=C(N)N=C(N)N2c2ccccc2OC)cc1OC,C03076374_decoy,TRY1,Decoy,0,-6.85457,-5.46,-3.09,-5.063089806512321
CSNC[C@H](c1ccc(-c2ccccc2O)cc1)N1CC[NH2+][C@H](O)C1,C39534040_decoy,TRY1,Decoy,0,-9.2519,-5.52,-1.79,-6.221171671570661
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C39661688_decoy,TRY1,Decoy,0,-9.54569,-6.87,-1.47,-6.344245807931529
Cn1cccc1C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661809_decoy,TRY1,Decoy,0,-7.18306,-6.93,-1.17,-5.476246370471364
CSCC[C@H]([NH3+])C(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C40463628_decoy,TRY1,Decoy,0,-7.40394,-5.05,-3.53,-4.658092346941587
Cc1ccc2c(Nc3ncnc(NC[C@@H]4CCCO4)c3N)cccc2[nH+]1,C40687237_decoy,TRY1,Decoy,0,-8.34459,-6.69,-1.91,-8.986863606029564
C[NH+]1CCN(c2ncnc(NNC(=O)COc3ccc(Cl)cc3Cl)c2N)CC1,C40726374_decoy,TRY1,Decoy,0,-8.24006,-6.48,-2.99,-6.228791764995119
CC[NH+]1CCN(c2ncnc(NNC(=O)c3ccccc3C)c2N)CC1,C40726709_decoy,TRY1,Decoy,0,-6.77927,-5.06,-0.47,-5.515647911312258
CC[NH+]1CCN(c2ncnc(NNC(=O)c3ccccc3OC)c2N)CC1,C40726724_decoy,TRY1,Decoy,0,-7.05888,-5.5,-1.89,-5.452451217977278
C[NH+]1CCN(Nc2ncnc(NCc3ccccc3Cl)c2N)CC1,C40757047_decoy,TRY1,Decoy,0,-6.86911,-5.71,-1.48,-5.300833140909713
Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40784467_decoy,TRY1,Decoy,0,-8.81269,-6.12,-0.14,-5.215276056227486
CN(c1ncnc(NNC(=O)c2ccccc2Br)c1N)C1CC[NH+](C)CC1,C40785021_decoy,TRY1,Decoy,0,-9.12021,-8.1,-1.39,-7.488780724429698
C[NH+]1CC[C@@H](CNS(=O)(=O)c2cc(Br)cnc2NN)C1,C41070144_decoy,TRY1,Decoy,0,-8.50514,-5.88,-3.68,-5.741415231301319
C[C@@H]1[C@@H](C)CCC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C41863577_decoy,TRY1,Decoy,0,-10.1773,-5.46,-3.97,-5.921822272143492
Cc1cc(C)cc(NC(=O)c2coc([C@@H]([NH3+])Cc3ccc(O)cc3)n2)c1,C33861151_decoy,TRY1,Decoy,0,-8.0141,-8.38,-2.49,-6.266595633806534
NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1coc(C2CC[NH2+]CC2)n1,C43216323_decoy,TRY1,Decoy,0,-8.95446,-7.73,-1.3,-6.545233907714434
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)Nc2cccc(Br)c2)co1,C43216946_decoy,TRY1,Decoy,0,-8.41822,-7.62,-2.31,-6.793973767495673
Cc1ccc(S(=O)(=O)NC(=S)N/[NH+]=C(\N)c2ccccn2)cc1,C44550558_decoy,TRY1,Decoy,0,-8.01852,-7.07,-1.97,-6.078106652193949
Cc1ccc(S(=O)(=O)NC(=S)N/[NH+]=C(\N)c2cnccn2)cc1,C44550562_decoy,TRY1,Decoy,0,-8.95742,-5.33,-1.09,-5.190903599398841
CCCNC(=O)CCNc1c(N)c[nH+]c2ccc(Br)cc12,C45071928_decoy,TRY1,Decoy,0,-8.00057,-6.72,-1.52,-8.100812930047981
COc1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1NC(C)=O,C48605081_decoy,TRY1,Decoy,0,-7.94036,-7.37,-3.76,-6.3791712236264
CC[NH+]1CCC(CNC(=O)c2cc(Br)cnc2NN)CC1,C51118436_decoy,TRY1,Decoy,0,-8.0084,-5.58,-1.38,-7.278131783165588
C[C@@H](CNC(=O)c1cc(Br)cnc1NN)[NH+]1CCCCC1,C51120541_decoy,TRY1,Decoy,0,-7.84214,-6.03,-1.01,-6.382404874045045
CCC[NH+]1CCC(NC(=O)c2cc(Br)cnc2NN)CC1,C51124621_decoy,TRY1,Decoy,0,-8.32671,-6.51,-1.65,-6.265685980759611
Cc1ncc(CO)c2cc(C(N)=S)/c(=[NH+]/c3ccc(NC(=O)c4ccco4)cc3)oc12,C20132096_decoy,TRY1,Decoy,0,-6.7892,-6.09,-1.16,-5.2173992364235575
NC(=O)C[NH+](CC(=O)NN1C(=O)NC2(CCCCC2)C1=O)C1CCCC1,C47274241_decoy,TRY1,Decoy,0,-8.62604,-5.67,-1.62,-5.939853522180076
C[C@H]([NH2+]CC1(c2ccc3c(c2)OCO3)CCCCC1)C(=O)NC(N)=O,C62242732_decoy,TRY1,Decoy,0,-7.33921,-7.02,-1.6,-5.734777253278444
CCC[NH2+][C@H](c1cn[nH]c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62777443_decoy,TRY1,Decoy,0,-7.16178,-6.49,-0.83,-6.9789475101594975
Nc1nnc(CCNC(=O)[C@@]23C[NH2+]C[C@@H]2CN(C2CCCC2)C3)s1,C65382811_decoy,TRY1,Decoy,0,-8.66408,-7.04,-1.87,-7.333773139455228
NC(=O)C1([NH+]2CCCCC2)CCN(c2cc(NC3CC3)nc(N)n2)CC1,C65385294_decoy,TRY1,Decoy,0,-7.16988,-5.28,-1.27,-5.279887096118918
O=C(NCc1ccccc1N1CCC(CO)CC1)[C@@]12CNC[C@@H]1C[NH2+]C2,C65468095_decoy,TRY1,Decoy,0,-8.95228,-7.82,-1.87,-7.55239832374308
Cc1ccccc1NC(=O)NNC(=O)NC[C@@H](C)[NH+]1CCC(C)CC1,C65479514_decoy,TRY1,Decoy,0,-8.44098,-7.44,-1.95,-7.088569252807426
C[C@H](N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)NC(N)=O,C66390668_decoy,TRY1,Decoy,0,-7.34939,-7.23,-1.38,-5.191830070798484
C[C@H](N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)NC(N)=O,C66390669_decoy,TRY1,Decoy,0,-7.70131,-7.67,-3.41,-7.291424840093237
C[C@H](N[C@H](C)C(=O)NC(N)=O)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66390670_decoy,TRY1,Decoy,0,-7.66873,-7.35,-0.69,-5.462441299180267
C[C@@H](N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)NC(N)=O,C66390671_decoy,TRY1,Decoy,0,-7.75568,-6.39,-1.53,-5.471950002694891
C[C@@H]([NH2+]CC1(c2ccc3c(c2)OCO3)CCCCC1)C(=O)NC(N)=O,C66392935_decoy,TRY1,Decoy,0,-8.46594,-7.56,-1.54,-6.255678254157132
Cc1ccc(NC(=O)NCC[NH+]2CCc3sccc3C2)cc1C(N)=O,C67315356_decoy,TRY1,Decoy,0,-9.02666,-7.64,-1.88,-6.675840639135345
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)CC1,C67426822_decoy,TRY1,Decoy,0,-8.07257,-6.47,-1.75,-5.581183478825532
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)CC1,C67426823_decoy,TRY1,Decoy,0,-8.54848,-5.52,-3.31,-5.946366140703174
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc3c(c2)CCC(=O)N3)CC1,C67539553_decoy,TRY1,Decoy,0,-9.26456,-7.86,-1.23,-13.349555632588668
NNc1nc(N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)c2cnn(-c3ccccc3)c2n1,C04395335_decoy,TRY1,Decoy,0,-7.93685,-8.39,-1.27,-7.899899173229845
CSc1ccc([C@H]2[NH+]=C(NCCc3c[nH]c4ccccc34)Nc3nc(C)cc(=O)n32)cc1,C09287553_decoy,TRY1,Decoy,0,-8.11073,-8.18,-2.1,-8.390601559622661
C[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1ccc(-c2ccc(Cl)cc2)o1,C09375905_decoy,TRY1,Decoy,0,-9.05657,-7.91,-2.05,-7.8334285225132465
CC(C)c1ccc([C@@H]([NH2+]CC(=O)NN2C(=O)NC3(CCCCC3)C2=O)c2cccs2)cc1,C09454957_decoy,TRY1,Decoy,0,-9.36004,-6.8,-2.52,-7.271634982338472
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccccc1C(F)(F)F)NCc1cccc2[nH]ccc12,C12029582_decoy,TRY1,Decoy,0,-6.85334,-7.35,-2.49,-6.139896051698859
O=C(C[NH+]1CCC(NC(=O)NC23CC4CC(CC(C4)C2)C3)CC1)Nc1ccccc1[N+](=O)[O-],C12644376_decoy,TRY1,Decoy,0,-7.37912,-6.52,-2.06,-5.365109819630912
COCCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C12900585_decoy,TRY1,Decoy,0,-7.26094,-7.75,-1.94,-6.053995667059904
CCC[NH+](CC(=O)Nc1ccc(F)c(F)c1F)CC1=C(C(=O)OCC)[C@@H](C)NC(=O)N1,C13037721_decoy,TRY1,Decoy,0,-7.74651,-6.85,-2.48,-5.923123514544764
C[C@@H]([NH2+]C[C@H](c1cccs1)c1c[nH]c2ccccc12)C(=O)N1CC(=O)Nc2ccccc21,C13128580_decoy,TRY1,Decoy,0,-7.17804,-9.17,-2.77,-7.463021779321692
CCCCN(C(=O)C[NH+](CCC)Cc1ccccc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C16585450_decoy,TRY1,Decoy,0,-6.94798,-5.79,-1.34,-5.117079775410666
Nc1nc(C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)nc(Nc2ccccc2Cl)n1,C19944539_decoy,TRY1,Decoy,0,-8.08545,-7.73,-0.47,-6.856217270692736
Nc1nc(C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)nc(Nc2ccc(Cl)cc2)n1,C19944553_decoy,TRY1,Decoy,0,-8.58082,-8.49,-1.54,-7.964292369342345
Nc1nc(C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)nc(Nc2cccc(Cl)c2)n1,C19944558_decoy,TRY1,Decoy,0,-8.45566,-5.48,-2.87,-5.572000551781753
CCC[NH+](CC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O)Cc1ccccc1,C21918841_decoy,TRY1,Decoy,0,-7.42729,-6.82,-1.96,-5.955893378304643
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1,C22010447_decoy,TRY1,Decoy,0,-7.91675,-6.15,-1.98,-5.097810851117226
CC(C)[C@@H]([NH3+])C(=O)N[C@H]1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)C2(C)C,C27322491_decoy,TRY1,Decoy,0,-10.034,-8.67,-1.38,-10.41213105828811
CCCCN(C(=O)C[NH+](C)[C@@H](C)c1ccc(F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C27557871_decoy,TRY1,Decoy,0,-7.40686,-6.75,-3.98,-5.549387758758348
OCC[NH+](CCO)C[C@@H](O)Cn1c(C(c2ccccc2)c2ccccc2)nc2ccccc21,C27695789_decoy,TRY1,Decoy,0,-8.43292,-6.71,-2.99,-7.516187164069323
Cc1n[nH]c(=O)c2c(NC(=O)C[NH+](C)CC(=O)Nc3ccc(Cl)c(Cl)c3)oc(C)c12,C28623473_decoy,TRY1,Decoy,0,-9.03487,-7.02,-2.74,-6.386953362472664
Nc1c2c(-c3ccccc3Cl)nc(NCc3cccnc3)nc2[nH+]n1Cc1ccccc1,C35576895_decoy,TRY1,Decoy,0,-7.92609,-8.24,-1.51,-7.26204503298555
Cc1n[nH]c2cc(F)c(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3-c3ccoc3)cc12,C35820220_decoy,TRY1,Decoy,0,-10.2367,-8.95,-2.27,-11.79890592984608
COc1ccc(-c2nc(NCC[NH+]3CCCC3)nc3nn(-c4ccc(F)cc4)c(N)c23)cc1,C35929296_decoy,TRY1,Decoy,0,-9.00354,-7.95,-1.32,-8.247388466497426
CC(C)c1ccc(-n2[nH+]c3nc(NCCN4CCOCC4)nc(-c4ccccc4)c3c2N)cc1,C35929628_decoy,TRY1,Decoy,0,-9.60687,-6.53,-2.13,-6.354601648422874
Nc1c2c(-c3ccc(F)cc3)nc(NCC[NH+]3CCCCC3)nc2nn1-c1ccc(F)cc1,C35930096_decoy,TRY1,Decoy,0,-8.92218,-6.56,-1.63,-6.469967262822452
O=C(NNC(=O)C1CC[NH+](Cc2ccc(F)cc2Cl)CC1)Nc1ccc([N+](=O)[O-])cc1,C13132850_decoy,TRY1,Decoy,0,-8.03431,-8.16,-1.88,-6.546192183168643
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)c(C)c1,C19891139_decoy,TRY1,Decoy,0,-8.42433,-8.21,-3.81,-6.7148740074616935
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)cc1C,C19899228_decoy,TRY1,Decoy,0,-8.17788,-8.26,-1.66,-7.69324163276236
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631791_decoy,TRY1,Decoy,0,-8.24334,-7.19,-3.86,-7.26011397818672
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@@H]1NN[C@@H](c2cccs2)[NH+]1[C@H](C(=O)[O-])C(C)C,C39665308_decoy,TRY1,Decoy,0,-7.10189,-7.58,-3.39,-7.034701732572014
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2cccc(N(C)C)c2)CC12CC[NH2+]CC2,C39674035_decoy,TRY1,Decoy,0,-9.7092,-7.61,-2.66,-6.774436705943415
C[C@@H]([NH2+]C[C@H](c1c[nH]c2ccccc12)[C@@H]1CC=CS1)C(=O)N1CC(=O)Nc2ccccc21,C39727289_decoy,TRY1,Decoy,0,-7.67799,-8.59,-1.39,-6.669721459280848
C[C@H](C(=O)NC1CC1)[NH+]1CCN([C@@H](C)C(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)CC1,C40024826_decoy,TRY1,Decoy,0,-7.83952,-6.17,-2.74,-5.773273632899692
NC(=O)C12CC3C[C@H](C1)C(NC(=O)C1([NH+]4CCN(c5ccc(C(F)(F)F)cn5)CC4)CCC1)[C@@H](C3)C2,C34663384_decoy,TRY1,Decoy,0,-8.3562,-7.03,-2.89,-6.605434592213511
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1ccc(Br)cn1,C40779928_decoy,TRY1,Decoy,0,-7.95892,-7.3,-1.56,-6.583744024843622
COc1cc(OC)c(Nc2ncnc(N3CCN(c4cccc[nH+]4)CC3)c2N)cc1Cl,C40798541_decoy,TRY1,Decoy,0,-8.74752,-5.92,-1.14,-5.218282223488697
O=C(NNc1cccc(Cl)n1)[C@@H]1CCC[NH+](Cc2cccnc2Nc2ccc(F)cc2)C1,C39204899_decoy,TRY1,Decoy,0,-8.95151,-8.14,-1.5,-8.122539261231195
O=C(NNc1cccc(Cl)n1)[C@H]1CCC[NH+](Cc2cccnc2Nc2ccc(F)cc2)C1,C39204900_decoy,TRY1,Decoy,0,-8.61067,-8.55,-1.5,-8.350602140128643
C=CCOc1c(Br)cc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)cc1OCC,C12520455_decoy,TRY1,Decoy,0,-8.92158,-7.62,-3.21,-8.078251934263504
C[C@@H](NC(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1)c1ccccc1Br,C26283892_decoy,TRY1,Decoy,0,-7.76632,-7.68,-0.92,-5.846818140631195
CSc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258628_decoy,TRY1,Decoy,0,-8.73499,-7.78,-2.45,-6.226728421074201
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@H]1CNN2[C@@H]1N[C@H](c1ccco1)C[C@@H]2C(F)(F)F,C63070829_decoy,TRY1,Decoy,0,-7.62021,-7.64,-3.96,-5.553010373791636
NS(=O)(=O)c1cccc(NC(=O)CCC2=c3cc(F)ccc3=[NH+][C@H]2c2ccc(F)cc2)c1,C63153332_decoy,TRY1,Decoy,0,-10.3676,-9.11,-1.16,-9.94251201838301
O=C(NCCC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccc([C@H]2Nc3ccccc3S2)cc1,C63281364_decoy,TRY1,Decoy,0,-8.33357,-8.7,-0.99,-6.72781672822899
O=C(NCCC1=c2ccccc2=[NH+]C1)C1=C2N[C@H](NC(=O)c3ccc(F)cc3)S[C@H]2CC1,C63690787_decoy,TRY1,Decoy,0,-8.32208,-6.36,-1.36,-5.931958502488103
Cc1ccc(C(=O)N[C@@H]2NC3=C(C(=O)NCCC4=c5ccccc5=[NH+]C4)CC[C@@H]3S2)cc1,C63690795_decoy,TRY1,Decoy,0,-10.0124,-9.13,-2.44,-7.14222198917073
Cc1ccccc1N1C(C2=c3ccccc3=[NH+]C2)=NN[C@@H]1SCC(=O)NC(=O)NC(C)C,C63791140_decoy,TRY1,Decoy,0,-7.32342,-8.5,-1.85,-8.067752437754663
CN1c2ccc(NC(=O)C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)cc2N[C@@H]1C(F)(F)F,C63818220_decoy,TRY1,Decoy,0,-8.52292,-7.93,-2.41,-6.398722794494298
CCCC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(OC)ccc4=[NH+]C3)C2)S1,C63941334_decoy,TRY1,Decoy,0,-8.27332,-7.16,-2.69,-5.797352955771315
CCCCCCN1C(C2=c3ccccc3=[NH+]C2)=NN[C@H]1S[C@H](C)C(=O)NC(=O)NCC,C64055446_decoy,TRY1,Decoy,0,-7.60105,-6.36,-1.27,-5.982646709208602
Cc1ccc(C(=O)NCCC2=c3ccccc3=[NH+]C2)cc1NC(=O)[C@H]1NSc2ccccc21,C64540104_decoy,TRY1,Decoy,0,-9.54386,-7.23,-2.19,-7.031710469171992
COc1ccccc1N1CC[NH+](Cc2nc(N)nc(Nc3ccc4c(c3)OCCO4)n2)CC1,C03765422_decoy,TRY1,Decoy,0,-8.18935,-6.28,-1.92,-5.69900092325913
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1sc2nc3c(cc2c1N)C[NH+](C)CC3,C08451273_decoy,TRY1,Decoy,0,-8.14923,-5.97,-3.18,-5.270051189135045
COc1cc2c(cc1OC)[C@@H](c1c(O)[nH]c(=S)n(CCC3=CCCCC3)c1=O)[NH2+]CC2,C02140229_decoy,TRY1,Decoy,0,-8.50196,-6.99,-1.78,-6.058013768136427
NC(=O)c1c(NC(=O)C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)sc2c1CCCC2,C09127042_decoy,TRY1,Decoy,0,-10.3975,-7.33,-0.53,-6.593908913461435
COc1cccc(N2CC[NH+](Cc3nc(N)nc(Nc4ccc5c(c4)OCCO5)n3)CC2)c1,C09130788_decoy,TRY1,Decoy,0,-9.48141,-5.55,-1.74,-5.9542773142074
COc1ccc(N2CC[NH+](Cc3nc(N)nc(Nc4ccc5c(c4)OCCO5)n3)CC2)cc1,C09434017_decoy,TRY1,Decoy,0,-9.83531,-5.87,-2.67,-5.488970518836102
Cc1n[nH]c(C)c1C[NH+](C)Cc1ccc(C(=O)NC2c3ccccc3-c3ccccc32)c(=O)[nH]1,C12124832_decoy,TRY1,Decoy,0,-7.78771,-8.09,-1.95,-6.295285394619952
CCCc1n[nH]c2c1[C@@H](c1ccc(OCC[NH+]3CCOCC3)c(OCC)c1)C(C#N)=C(N)O2,C06492424_decoy,TRY1,Decoy,0,-7.7832,-6.09,-1.57,-5.818055122738102
COc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)cc1,C19944543_decoy,TRY1,Decoy,0,-8.26812,-8.2,-0.31,-6.613449754400588
CSCC[C@H](NC(=O)c1cc(C)cc(C)c1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C20573590_decoy,TRY1,Decoy,0,-9.00701,-6.85,-1.85,-6.511683539508615
C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C21324745_decoy,TRY1,Decoy,0,-9.26201,-6.12,-2.94,-5.736670037891837
CCCCN(C(=O)C[NH+]1CCC[C@@H]1c1cccs1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C21473158_decoy,TRY1,Decoy,0,-8.93599,-6.7,-1.14,-8.285289078963585
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](CC(=O)N2CCCCCC2)CC1,C22792023_decoy,TRY1,Decoy,0,-9.60106,-7.68,-1.39,-7.82115333386557
C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(S(=O)(=O)c2ccccc2F)CC1,C24716573_decoy,TRY1,Decoy,0,-6.84808,-8.14,-3.65,-7.650976746172247
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(S(=O)(=O)c2ccccc2F)CC1,C24716576_decoy,TRY1,Decoy,0,-8.15931,-6.74,-1.63,-5.723099728537433
OC[C@H]1O[C@@H](n2cnc3c(N4CC[NH+](C/C=C/c5ccccc5)CC4)ncnc32)[C@H](O)[C@@H]1O,C39264951_decoy,TRY1,Decoy,0,-7.75142,-6.0,-1.19,-5.2102199744061535
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)NCCCO)C4(CC[NH2+]CC4)C3)cccc12,C39605518_decoy,TRY1,Decoy,0,-7.41912,-6.94,-1.8,-5.405019903741112
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1C,C39631816_decoy,TRY1,Decoy,0,-8.18013,-6.69,-3.91,-7.155105372089719
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)c1F,C39655430_decoy,TRY1,Decoy,0,-7.74768,-7.88,-2.56,-7.262874816780902
CSCCC(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1,C39684163_decoy,TRY1,Decoy,0,-9.12491,-7.25,-5.89,-7.045422535405666
O=C(N/N=C/[C@@H]1C=c2ccccc2=[NH+]C1=O)C(=O)Nc1ccccc1C(=O)NC1CCCCC1,C39941796_decoy,TRY1,Decoy,0,-9.7536,-9.11,-2.26,-8.56426072214764
Cc1cccc(NC(=O)c2ccccc2NC(=O)C(=O)N/N=C/[C@H]2C=c3ccccc3=[NH+]C2=O)c1,C39948087_decoy,TRY1,Decoy,0,-8.62103,-7.52,-1.5,-6.353280974823019
C[C@@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)N1CC[NH+]([C@@H](C)C(=O)NC2CC2)CC1,C40024825_decoy,TRY1,Decoy,0,-8.59691,-7.38,-3.28,-6.0151320491248645
C[NH2+]CC1(c2ccc(N3CCc4c(C(N)=O)nn(-c5ccc(OC)cc5)c4C3=O)cc2)CC1,C40394971_decoy,TRY1,Decoy,0,-9.0199,-7.71,-1.76,-7.212580971608595
Cc1ccc(C(=O)Nc2nccnc2C(=O)NC2CC[NH+](Cc3ccccc3O)CC2)cc1,C40425304_decoy,TRY1,Decoy,0,-7.89288,-8.27,-4.75,-6.538056523836751
COc1ccc(CNc2ncnc(N3CC[NH+](Cc4ccc5c(c4)OCO5)CC3)c2N)cc1,C40753995_decoy,TRY1,Decoy,0,-8.59883,-6.16,-2.27,-5.257012473514694
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(N(C)C3CC[NH+](C)CC3)c2N)cc1,C40759573_decoy,TRY1,Decoy,0,-9.10762,-5.07,-2.63,-5.7701688591242855
COc1cc(-c2nc(C[NH+]3CCC(C(=O)NCC(N)=O)CC3)c(C)o2)cc(OC)c1OC,C40984132_decoy,TRY1,Decoy,0,-9.36833,-6.26,-1.54,-5.947184637255336
CC1(C)C[C@H]([NH2+]C2CCOCC2)[C@]2(CCC(=O)NCc3cccnc3)CC[C@](C)(O)C[C@@H]12,C43548034_decoy,TRY1,Decoy,0,-9.81978,-7.98,-1.25,-9.076424614531694
CNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)NCCN3CCOCC3)[C@H](O)[C@H]1[C@@H]2C,C43548350_decoy,TRY1,Decoy,0,-10.8672,-5.81,-2.82,-6.259167272224502
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(OC)c1,C44713727_decoy,TRY1,Decoy,0,-8.08092,-5.86,-1.59,-5.437844837909185
CC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714471_decoy,TRY1,Decoy,0,-8.54134,-6.38,-2.16,-6.013878303065209
CC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714473_decoy,TRY1,Decoy,0,-8.96982,-7.19,-1.38,-7.862820635177476
NC(=O)c1c(NC(=O)CN2CC[NH+](Cc3c(F)cccc3Cl)CC2)sc2c1CCC2,C23333252_decoy,TRY1,Decoy,0,-10.9219,-7.79,-2.09,-6.933480565526649
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C14921711_decoy,TRY1,Decoy,0,-7.64853,-6.48,-1.34,-5.867547315059769
O=C(Cc1ccc(F)cc1)NC(=O)Nc1ccc(Oc2ccnc3c2=C(CO)C[NH+]=3)c(F)c1,C52551739_decoy,TRY1,Decoy,0,-8.83056,-7.36,-2.43,-7.576426276312762
COc1cc(OC)cc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c1,C44737029_decoy,TRY1,Decoy,0,-9.33915,-8.24,-0.79,-7.953321941141501
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)[C@@H](C)Oc4ccccc4)CC34CC[NH2+]CC4)[nH]c2c1,C44737241_decoy,TRY1,Decoy,0,-9.74689,-6.21,-2.3,-6.262277455687936
COc1ccc(OC)c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c1,C39695827_decoy,TRY1,Decoy,0,-9.30251,-8.86,-2.54,-8.621401513556695
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)Nc1ccc(C[NH+]2CCC[C@@H](C(N)=O)C2)cc1,C60341424_decoy,TRY1,Decoy,0,-8.45508,-8.69,-1.61,-7.443443614065628
O=C(CNC(=O)c1ccc(Br)cc1)NNC1=c2cc([N+](=O)[O-])ccc2=[NH+]C1=O,C15880049_decoy,TRY1,Decoy,0,-7.73526,-7.54,-3.01,-5.8320700406537815
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1CNN2[C@@H]1N[C@H](c1ccco1)C[C@@H]2C(F)(F)F,C63070827_decoy,TRY1,Decoy,0,-8.7945,-8.7,-2.66,-12.087670760885956
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1C[C@@H]2N[C@H](c3ccco3)C[C@H](C(F)(F)F)N2N1,C63205508_decoy,TRY1,Decoy,0,-9.32995,-8.59,-2.7,-11.089105151775394
CS(=O)(=O)N[C@H]1Nc2ccc(C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)cc2S1,C63281265_decoy,TRY1,Decoy,0,-10.1682,-7.92,-1.48,-7.015583279097969
COc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3NN[C@@H](C(C)(C)C)S3)CC1=O)C[NH+]=2,C63557745_decoy,TRY1,Decoy,0,-8.41151,-7.17,-3.55,-6.497781217760399
COc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3NN[C@H](C(C)(C)C)S3)CC1=O)C[NH+]=2,C63557747_decoy,TRY1,Decoy,0,-7.95718,-7.05,-3.15,-5.6472543741628405
COc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@@H]3NN[C@@H](CC(C)C)S3)CC1=O)C[NH+]=2,C63557870_decoy,TRY1,Decoy,0,-8.34651,-7.76,-1.04,-6.100054680773325
CCCC[C@@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(OC)ccc4=[NH+]C3)C2)S1,C63941331_decoy,TRY1,Decoy,0,-9.30691,-7.64,-3.56,-6.908418937474232
CN(CC(=O)NCC[NH+](C)C)c1nn2c(NC(C)(C)C)c(-c3ccc(O)cc3)nc2s1,C64704496_decoy,TRY1,Decoy,0,-9.09266,-6.98,-2.31,-8.39347172701995
Cc1ccc(S(=O)(=O)N[C@H](C(C)C)[C@H]2[NH+]=C(c3ccc4c(c3)[nH]c(=O)c(=O)n4C)NO2)cc1,C64890538_decoy,TRY1,Decoy,0,-8.8935,-7.78,-2.35,-8.659355482914835
CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccccc2)c(N)c1,C01591448_decoy,TRY1,Decoy,0,-7.24246,-7.92,-1.4,-6.853453396170413
Nc1nc(N)c2nc(-c3ccc(O)cc3)c(-c3ccc(O)cc3)nc2n1,C01694541_decoy,TRY1,Decoy,0,-8.04184,-7.11,-1.02,-4.850147918206652
O=[N+]([O-])c1ccc(N/N=C(\CO)[C@H](O)[C@H](O)[C@H](O)CO)cc1,C05004559_decoy,TRY1,Decoy,0,-7.25131,-6.65,-3.49,-6.970878817813018
Nc1ccc([C@H](c2ccccc2)c2nc(N)nc(N)n2)c(Cl)c1,C06927644_decoy,TRY1,Decoy,0,-7.21404,-7.77,-1.81,-8.688099165442805
C[C@@]1(Oc2ccc(N)cc2)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915674_decoy,TRY1,Decoy,0,-6.85878,-6.85,-2.96,-7.335777309297832
Nc1cccc2c1C(=O)c1c(N)ccc(-c3ccc(N)c4c3C(=O)c3ccccc3C4=O)c1C2=O,C08871964_decoy,TRY1,Decoy,0,-9.02051,-7.84,-0.57,-4.844688605313159
Nc1nc(N)c2nc(-c3ccc(Cl)c(Cl)c3)c(N)nc2n1,C13283545_decoy,TRY1,Decoy,0,-8.09575,-8.61,-0.44,-7.841570969485857
CN/C(=N/C#N)NCCSCc1nc(N=C(N)N)cs1,C15449364_decoy,TRY1,Decoy,0,-8.3398,-6.18,-2.07,-6.460778870406015
Cc1ccc(Nc2nnc([C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)s2)cc1,C15775167_decoy,TRY1,Decoy,0,-8.65587,-6.11,-1.49,-5.983884354631684
COc1c(O)cc(/C=N/NC(N)=S)cc1/C=N/NC(N)=S,C16194637_decoy,TRY1,Decoy,0,-7.84258,-5.45,-0.3,-6.368483178482016
NC(=O)C1=C(O)C[C@H]2C[C@@H]3Cc4cccc(O)c4C(=O)C3=C(O)[C@]2(O)C1=O,C08651866_decoy,TRY1,Decoy,0,-7.43146,-6.23,-1.35,-4.07907376558311
O=[N+]([O-])c1ccc(N/N=C(/CO)[C@H](O)[C@H](O)[C@H](O)CO)cc1,C17428194_decoy,TRY1,Decoy,0,-6.58683,-5.32,-2.84,-5.175407614338133
O=C1c2ccccc2O[C@H]2C=C(O)C([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)=C(O)[C@@H]12,C28966907_decoy,TRY1,Decoy,0,-7.78388,-6.13,-2.05,-4.646550957989699
O=c1ccoc2cc(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)c12,C31160927_decoy,TRY1,Decoy,0,-6.91078,-5.75,-1.1,-4.207529949453255
CCc1cc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)ccc1N,C33608994_decoy,TRY1,Decoy,0,-8.29219,-5.38,-3.07,-5.311125980177539
CCc1cc(Cc2cc(Cc3ccc(N)cc3)ccc2N)ccc1N,C33608996_decoy,TRY1,Decoy,0,-8.49713,-4.93,-3.21,-4.545059562318105
CCc1cc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)cc(C)c1N,C33610798_decoy,TRY1,Decoy,0,-6.39527,-8.41,-2.54,-6.517436259634057
CCc1cc(Cc2cc(Cc3ccc(N)cc3)ccc2N)cc(C)c1N,C33610799_decoy,TRY1,Decoy,0,-7.55407,-7.84,-3.3,-6.805674654170276
CCc1cc(Cc2cc(Cc3ccc(N)cc3)ccc2N)cc(CC)c1N,C33611076_decoy,TRY1,Decoy,0,-7.57201,-8.14,-2.0,-7.263959234565954
CC(C)c1cc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)cc(C(C)C)c1N,C33611083_decoy,TRY1,Decoy,0,-8.13565,-8.72,-2.07,-7.157074160679517
CCCCOc1ccc(OCCCC)c(=C(N)NO)c1=C(N)N=O,C16082773_decoy,TRY1,Decoy,0,-7.31256,-5.52,-3.53,-9.882165065152565
O=C1c2ccccc2O[C@H]2C=C(O)C([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)=C(O)[C@H]12,C36728545_decoy,TRY1,Decoy,0,-7.10599,-6.63,-2.95,-4.722077624790652
O=C1c2ccccc2O[C@@H]2C=C(O)C([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)=C(O)[C@H]12,C36728547_decoy,TRY1,Decoy,0,-8.38069,-6.34,-1.3,-4.630720613559902
Nc1n[nH]cc1S(=O)(=O)Nc1ccc(S(N)(=O)=O)cc1,C37557938_decoy,TRY1,Decoy,0,-6.18825,-7.07,-0.62,-8.235252835398159
NC(=O)CS[C@H]1NN[C@@H]([C@@H]2C=C(c3ccccc3)N=N2)N1N,C39016133_decoy,TRY1,Decoy,0,-7.5475,-5.04,-0.78,-4.393957896813009
NC(=O)CS[C@H]1NN[C@H]([C@H]2C=C(c3ccccc3)N=N2)N1N,C39016134_decoy,TRY1,Decoy,0,-6.6453,-7.52,-0.59,-6.199205904608789
O=C(N/N=C\c1ccc(O)c(O)c1)N/N=C/c1ccc(O)c(O)c1,C39321581_decoy,TRY1,Decoy,0,-8.50902,-7.98,-1.38,-9.399824187071008
Nc1nc(CSc2n[nH]c(N)n2)nc(Nc2ccccc2)n1,C12549381_decoy,TRY1,Decoy,0,-6.20958,-7.98,-1.43,-6.864182210154306
NC(=S)N/N=C1/C[C@@H]2[C@@H]3C/C(=N/NC(N)=S)[C@H]4[C@@H]3C[C@@H]2[C@@H]14,C39944310_decoy,TRY1,Decoy,0,-7.26488,-5.16,-1.0,-4.999346689686319
NNc1ncnc(Nc2cc(C(F)(F)F)ccc2Cl)c1N,C40682661_decoy,TRY1,Decoy,0,-7.75209,-7.45,-0.99,-11.474228652972208
O=C(N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C01679697_decoy,TRY1,Decoy,0,-9.28331,-8.21,-1.05,-10.007436668264443
Nc1ccc(CSc2nc(N)cc(N)n2)c(Br)c1,C41023563_decoy,TRY1,Decoy,0,-8.48864,-6.38,-1.11,-6.947176606641023
O=C1c2ccccc2O[C@@H]2C=C(O)C([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)=C(O)[C@H]12,C43465506_decoy,TRY1,Decoy,0,-8.4779,-6.11,-2.31,-5.203786848336398
O=C1c2ccccc2O[C@@H]2C=C(O)C([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)=C(O)[C@@H]12,C43465507_decoy,TRY1,Decoy,0,-6.86372,-6.3,-1.95,-4.110803359354612
[NH3+][C@H](CC(=O)[O-])C(c1ccc(C(F)(F)F)cc1)[C@@H]([NH3+])CC(=O)[O-],C44219320_decoy,TRY1,Decoy,0,-7.74397,-6.06,-2.29,-5.829593915303708
CC(C)(NS(=O)(=O)c1c(NN)nc2sccn12)C(N)=O,C45110462_decoy,TRY1,Decoy,0,-7.38069,-5.64,-1.81,-5.409227922564575
CC(C)(NC(=O)c1cc(Br)cnc1NN)C(N)=O,C51124524_decoy,TRY1,Decoy,0,-7.02637,-4.94,-0.54,-5.023866554452741
NC(N)=Nc1nc(CSCC/C=N/S(=O)(=O)[N-][NH3+])cs1,C32911619_decoy,TRY1,Decoy,0,-8.25758,-6.65,-1.45,-8.142125442966814
CCCc1cc(-c2n[nH]cc2-c2ccc(C(=O)NN)o2)c(O)cc1O,C04555680_decoy,TRY1,Decoy,0,-8.5876,-7.0,-3.17,-8.226848153390328
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=S)NCCC(C)C,C58073503_decoy,TRY1,Decoy,0,-7.85977,-5.77,-1.3,-6.092279387094972
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=S)NCCCOC,C58189495_decoy,TRY1,Decoy,0,-7.36715,-5.95,-1.95,-6.364487139421989
CC1=C(C(N)=O)[C@H](c2ccc(N(C)C)cc2)C(C(N)=O)=C(N)O1,C58949509_decoy,TRY1,Decoy,0,-6.31273,-5.1,-1.92,-4.931524717059436
CC[NH+](CC)c1ccc([C@@H]2C(C(N)=O)=C(C)OC(N)=C2C(N)=O)cc1,C58949515_decoy,TRY1,Decoy,0,-6.13687,-5.83,-1.44,-5.286058356956402
CC1=C(C(N)=O)[C@H](c2ccc(C(C)C)cc2)C(C(N)=O)=C(N)O1,C58949582_decoy,TRY1,Decoy,0,-6.60942,-5.92,-1.85,-4.933257128141732
CN(CNc1ccccc1O)[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C59378878_decoy,TRY1,Decoy,0,-6.44369,-5.45,-1.23,-5.6958536818472
Nc1ccc2oc([C@H](O)[C@@H](O)c3nc4cc(N)ccc4o3)nc2c1,C59942385_decoy,TRY1,Decoy,0,-7.34926,-8.55,-0.86,-12.619894326803973
N#Cc1c(N)nc2c(c1N)=C(N)SC1=NC(=O)C[C@@H](c3ccccc3)C=21,C13122797_decoy1,TRY1,Decoy,0,-5.86682,-6.34,,-3.1314118246637728
O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@H]1O,C04096945_decoy,TRY1,Decoy,0,-9.29174,-5.89,-1.05,-4.987628135352403
NC1=NC(=O)NC(=O)[C@@H]1C(c1ccccc1)[C@H]1C(=O)NC(=O)N=C1N,C63197168_decoy,TRY1,Decoy,0,-6.46959,-4.87,-1.85,-4.291398406790218
CCC([C@@H]1C([O-])=NC(=S)[NH+]=C1N)[C@@H]1C([O-])=NC(=S)[NH+]=C1N,C63598724_decoy,TRY1,Decoy,0,-6.61709,-4.68,-1.41,-3.3138013015322536
CC[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Cl)ccc2O)N3)C1,C04556310_decoy,TRY1,Decoy,0,-8.96855,-7.12,-0.65,-8.122943789274412
CCOc1ccc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](CC)C4)N2)c(O)c1,C04556425_decoy,TRY1,Decoy,0,-10.082,-6.54,-1.12,-6.034797490538806
Cc1cc[nH+]c(N[C@@H](c2ccc(O)cc2)c2ccc3ccc(C)nc3c2O)c1,C04755055_decoy,TRY1,Decoy,0,-9.2348,-7.94,-1.54,-8.526878317075914
NC(=O)c1c(NC(=O)C[NH+]2CC[C@@H]3CCCC[C@H]3C2)sc2c1CCC2,C08268283_decoy,TRY1,Decoy,0,-9.10354,-7.11,-2.4,-6.106124907054382
O=C(C[NH2+]CCc1ccc(O)cc1)N=c1c2c([nH]c3ccccc13)CCC2,C05814146_decoy,TRY1,Decoy,0,-7.62925,-6.39,-2.19,-4.966720476146284
Nc1nc(C[NH+]2CCN(c3ccccc3)CC2)[nH]/c(=N/c2ccc(Cl)cc2)n1,C09089639_decoy,TRY1,Decoy,0,-9.09188,-6.94,-1.06,-5.373258781980465
C[NH+]1CCc2c([nH]c3ccccc23)[C@@H]1c1c(O)nc(O)n(-c2ccc(F)cc2)c1=O,C09358978_decoy,TRY1,Decoy,0,-6.45899,-7.09,-1.37,-5.568604639951755
C[NH+]1CCc2c([nH]c3ccccc23)[C@H]1c1c(O)nc(O)n(-c2ccc(F)cc2)c1=O,C09358985_decoy,TRY1,Decoy,0,-7.59891,-7.19,-1.19,-5.125325279001524
[NH3+][C@@H](c1ccc(I)cc1)c1ccc2c(c1)CC(=O)N2,C20480445_decoy,TRY1,Decoy,0,-7.0135,-7.63,-1.33,-8.530410610514581
O=C(CNC(=O)c1sc2ccccc2c1Cl)Nc1[nH+]cccc1O,C22264476_decoy,TRY1,Decoy,0,-8.00892,-7.72,-1.7,-5.779029015882288
CC(=O)[NH+]=c1ccc2c(COc3ccc(Cl)cc3C(N)=O)cc(O)oc-2c1,C27566101_decoy,TRY1,Decoy,0,-7.9014,-7.11,-1.13,-5.763377785437469
CC(C)NC(=O)Nc1ccc(CN/C=C2/C=c3ccccc3=[NH+]C2=O)cc1,C31643607_decoy,TRY1,Decoy,0,-7.60756,-5.91,-1.33,-4.832868198767562
Cc1ccc(NC(=O)[C@@H]2SC(N)=[NH+][C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1,C08301867_decoy,TRY1,Decoy,0,-7.8299,-5.45,-1.93,-5.314004458727132
[NH3+][C@@H](c1cc(Br)ccc1F)c1cc2c(cc1Cl)NC(=O)C2,C35359540_decoy,TRY1,Decoy,0,-8.21777,-7.68,-1.69,-9.82993597218308
C[NH2+][C@H](c1ccc2[nH]c(=O)[nH]c2c1)c1cc(Br)ccc1Cl,C35488378_decoy,TRY1,Decoy,0,-7.29804,-6.63,-0.97,-5.207415032868625
COc1cccc([C@H]2[NH2+][C@@H](c3cccc(OC)c3O)[C@H](C)C(=O)[C@H]2C)c1O,C36047546_decoy,TRY1,Decoy,0,-7.48584,-7.07,-3.2,-5.433281376890683
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1cc(Br)ccc1Cl,C37287931_decoy,TRY1,Decoy,0,-7.49311,-7.06,-2.86,-4.729540016031343
Cc1cccc(-c2nc(NCC[NH+](C)C)nc3nn(C(C)(C)C)c(N)c23)c1,C37360668_decoy,TRY1,Decoy,0,-7.74309,-5.54,-0.77,-5.206355918758777
CC(C)c1ccc(-c2nc(NCC[NH+]3CCCC3)nc3nn(C)c(N)c23)cc1,C37361529_decoy,TRY1,Decoy,0,-9.56594,-6.75,-0.4,-8.834715166456267
[NH3+]C1(C(=O)Nc2ccc(Br)cc2C(F)(F)F)CCCCC1,C37518820_decoy,TRY1,Decoy,0,-7.93058,-6.59,-1.15,-5.53856469520616
Nc1cc(=O)[nH]c(S[C@@H]2C(=O)[NH+]=c3ccccc3=C2c2ccccc2)n1,C39147074_decoy,TRY1,Decoy,0,-6.73352,-7.75,-0.26,-6.545496378944805
Cc1ccc(NC(=O)[C@H](C)SC2=N[C@@H]3[NH+]=c4ccccc4=C3N=N2)cc1N,C39697694_decoy,TRY1,Decoy,0,-7.71231,-5.94,-1.43,-5.13134432384271
C=C(C)C(=O)Nc1ccc(O)c([C@@H]2N=c3cc(NC(=O)C(=C)C)ccc3=[NH+]2)c1,C39697786_decoy,TRY1,Decoy,0,-6.96054,-6.49,-1.15,-6.166877379201313
Cc1ccc(C)c(NC(=O)c2sc3[nH+]c(C)c4c(c3c2N)CCCC4)c1,C40568339_decoy,TRY1,Decoy,0,-8.42884,-6.66,-0.87,-5.363410603570138
C[NH+]1CCN(c2ncnc(Nc3ccc(OC(F)(F)F)cc3)c2N)CC1,C40726429_decoy,TRY1,Decoy,0,-7.52335,-6.42,-1.6,-4.825308857549172
CC[NH+]1CCN(c2ncnc(Nc3nc4c(C)cccc4s3)c2N)CC1,C40726687_decoy,TRY1,Decoy,0,-7.61122,-6.46,-1.24,-5.168718923065248
Cc1ccc2c(Nc3ncnc(Oc4cccc5cccnc45)c3N)cccc2[nH+]1,C40752245_decoy,TRY1,Decoy,0,-8.08299,-7.16,-0.78,-10.034941963601128
Cc1ccc(Nc2ncnc(N3CCN(c4cccc[nH+]4)CC3)c2N)c(C)c1,C40755529_decoy,TRY1,Decoy,0,-7.55333,-5.98,-1.48,-4.497383227332589
Nc1c(N2CCCc3ccccc32)nc[nH+]c1Nc1ccc(F)c(Cl)c1,C40780285_decoy,TRY1,Decoy,0,-8.36203,-6.34,-1.31,-5.571611962959854
Nc1c(Nc2ccccc2Cl)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40781345_decoy,TRY1,Decoy,0,-7.47625,-7.56,-0.76,-5.261417344586974
Nc1c(NC2CCCCCC2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40799279_decoy,TRY1,Decoy,0,-7.67927,-6.71,-1.37,-5.245649872550056
CC(=O)Nc1cccc(Nc2nc(NCc3ccco3)c3ccccc3[nH+]2)c1,C41151219_decoy,TRY1,Decoy,0,-8.51026,-8.45,-1.2,-9.389200579854084
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1,C42908569_decoy,TRY1,Decoy,0,-7.68152,-5.53,-1.99,-5.044315239154647
C[C@@H]([NH3+])[C@H](Sc1nc2ccccc2[nH]1)c1ccccc1Br,C43095836_decoy,TRY1,Decoy,0,-6.77263,-4.8,-1.84,-4.257849034920729
C[C@@H]([NH3+])[C@@H](Sc1nc2ccccc2[nH]1)c1ccccc1Br,C43095839_decoy,TRY1,Decoy,0,-7.40878,-5.7,-1.77,-4.423606861412874
C[C@@H](N)[C@H](c1ccc(Br)s1)[NH+](CCO)C1CCCCC1,C43262823_decoy,TRY1,Decoy,0,-9.50881,-5.25,-1.27,-7.077055885769876
[NH3+]C[C@@H](Oc1ccc2c(c1)CCC(=O)N2)c1ccc(Br)s1,C43263721_decoy,TRY1,Decoy,0,-9.22033,-7.69,-2.08,-6.5201966542674255
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CCCC[C@@H]1CCO,C43284742_decoy,TRY1,Decoy,0,-9.05671,-5.19,-0.97,-2.1087113287900072
Cn1c(SCc2ccc(Cl)cc2)c(C[C@H]([NH3+])CO)c2ccccc21,C44465155_decoy,TRY1,Decoy,0,-9.53448,-5.01,-1.3,-5.611910385737645
CCOc1ccc(Nc2cc(N[C@@H]3CCC[NH2+]C3)c(C#N)c3ccnn23)cc1,C45254990_decoy,TRY1,Decoy,0,-7.97943,-6.89,-2.69,-7.59823219630242
CCCNC(=O)C[NH+](C)Cc1nc(N)c2c3c(sc2n1)CCCCC3,C45605846_decoy,TRY1,Decoy,0,-8.15462,-5.46,-1.78,-5.4571022775150055
Cc1ccc(C(=O)NC2CCN(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)CC2)o1,C51267719_decoy,TRY1,Decoy,0,-7.28559,-7.31,-0.16,-5.715789639056371
Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)c3nc4ccccc4c(=O)[nH]3)sc2[nH+]1,C29033519_decoy,TRY1,Decoy,0,-8.29567,-5.95,-1.41,-6.218924810996892
O=C(NNC(=O)[C@H]1C=c2cc(OC(F)(F)F)ccc2=[NH+]1)Nc1ccccc1,C63598851_decoy,TRY1,Decoy,0,-6.55663,-7.03,-1.67,-5.39850503120774
Cc1cc(C)c2c(=O)cc(CS[C@H]3NN[C@H](c4ccco4)[NH+]3C)[nH]c2c1,C63686407_decoy,TRY1,Decoy,0,-6.97828,-6.31,-0.87,-4.595621028153587
Cc1ccc(C)c2c(=O)cc(CS[C@H]3NN[C@H](c4ccco4)[NH+]3C)[nH]c12,C63686431_decoy,TRY1,Decoy,0,-7.57481,-5.92,-2.38,-5.574471048891276
C[C@H](NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)c1nc(-c2ccc(F)cc2)no1,C64645701_decoy,TRY1,Decoy,0,-8.29242,-5.64,-1.25,-6.224686056504554
COc1ccc([C@H]2NN(c3ccccc3)C=C2[C@@H]2NCCc3[nH]c[nH+]c32)cc1,C65526782_decoy,TRY1,Decoy,0,-8.34943,-7.25,-1.52,-5.615969379080666
Clc1ccccc1CN1c2ccccc2N[C@H]1[C@H]1NCCc2[nH]c[nH+]c21,C65534618_decoy,TRY1,Decoy,0,-8.914,-7.17,0.11,-5.320244089772302
N/C(NCC1(c2cccc(Br)c2)CCC1)=[NH+]\C[C@H]1CCCO1,C66244566_decoy,TRY1,Decoy,0,-8.56098,-4.79,-1.77,-5.1577199001390825
COc1ccc(C[C@@H](C)[NH2+]C[C@@H](O)c2ccc(O)c(O)c2)cc1,C01673166_decoy,TRY1,Decoy,0,-7.485,-6.01,-1.28,-5.460041280789103
COc1cccc(C[C@@H](C)[NH2+]C[C@@H](O)c2ccc(O)c(O)c2)c1,C01577494_decoy,TRY1,Decoy,0,-7.02872,-7.67,-1.49,-9.17942362355052
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CC[NH2+]C[C@@H]1OC,C05019451_decoy,TRY1,Decoy,0,-7.43992,-6.71,-1.65,-7.5488289208526
CN(C(=O)c1cc(N)cc(N)c1)C1CC(C)(C)[NH+](C)C(C)(C)C1,C00082978_decoy,TRY1,Decoy,0,-7.95341,-7.0,-2.48,-5.472854294531045
CC(C)CC[NH2+]CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C12799998_decoy,TRY1,Decoy,0,-8.91918,-4.64,-2.68,-5.338899282854618
NC(=O)c1sc2[nH+]c(N3CCCC3)c3c(c2c1N)CCCC3,C15670971_decoy,TRY1,Decoy,0,-8.46361,-6.25,-1.82,-4.756299324548958
[NH2+]=C(Nc1ccc(Cl)cc1)Nc1nc(=O)c2c([nH]1)CCCC2,C20064252_decoy,TRY1,Decoy,0,-8.12787,-6.27,-1.19,-4.941944604684534
Nc1cc(Cl)cc(Cl)c1NC(=O)CC[NH+]1CCC(O)CC1,C20553563_decoy,TRY1,Decoy,0,-7.80144,-5.11,-0.84,-4.327588319428445
Cc1[nH+][nH]c2c1[C@@H](c1ccc(Cl)cc1)c1c([nH]c(=O)[nH]c1=O)N2,C31807677_decoy,TRY1,Decoy,0,-6.36676,-5.34,-2.47,-3.2295951423080904
Cc1[nH+][nH]c2c1[C@@H](c1cccc(Cl)c1)c1c([nH]c(=O)[nH]c1=O)N2,C31809328_decoy,TRY1,Decoy,0,-6.84791,-6.17,-2.15,-3.772245222881193
Nc1c(C(=O)NNC(=O)/C=C/c2ccco2)c[nH+]c2ccccc12,C32605513_decoy,TRY1,Decoy,0,-8.46262,-5.6,-0.55,-5.745455547680374
CC(C)c1ccc2c(c1)[C@]1([NH+]=C(N)N=C3Nc4ccccc4N31)C(=O)N2,C06650283_decoy,TRY1,Decoy,0,-6.57786,-5.74,-2.79,-3.908696459484368
O=C(Nc1cc2[nH]c(=O)[nH]c2cc1Br)[C@@H]1CCC[NH2+]C1,C37034024_decoy,TRY1,Decoy,0,-7.37884,-6.34,-0.58,-4.774055155757074
O=C(Nc1cc2[nH]c(=O)[nH]c2cc1Br)[C@H]1CSC[NH2+]1,C37034044_decoy,TRY1,Decoy,0,-8.44631,-4.5,-0.14,-4.53279036622416
CC[C@H]([NH2+]CCCC(N)=O)c1cc(Br)ccc1O,C37659040_decoy,TRY1,Decoy,0,-7.5923,-4.75,-1.84,-5.244550309026647
CC[C@@H]([NH2+]CCCC(N)=O)c1cc(Br)ccc1O,C37659042_decoy,TRY1,Decoy,0,-8.02393,-5.89,-2.88,-7.305080355799858
CN(Cc1ccc(Br)cc1)C(=O)[C@@H]([NH3+])CC(N)=O,C37798622_decoy,TRY1,Decoy,0,-7.25194,-6.04,-1.73,-6.828911670741911
CCCc1nc2c(o1)NC([NH3+])=C(C#N)[C@@]21C(=O)Nc2c(C)cccc21,C39323861_decoy,TRY1,Decoy,0,-6.18611,-5.78,-2.27,-4.007933489046239
Cc1cc(C)c(Cc2c(C)nc(NCCCC[NH3+])[nH]c2=O)c(C)c1,C16886310_decoy,TRY1,Decoy,0,-7.64607,-5.89,-3.0,-7.47201825026513
CC(C)c1ccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)cc1,C40706124_decoy,TRY1,Decoy,0,-7.7432,-6.76,-1.66,-5.825690928479407
Nc1c(Nc2ccc(Cl)cn2)nc[nH+]c1Nc1cccnc1,C40759661_decoy,TRY1,Decoy,0,-7.44584,-6.97,-0.6,-6.463117886660645
Cc1cccc2sc(Nc3nc[nH+]c(NN(C)C)c3N)nc12,C40759988_decoy,TRY1,Decoy,0,-9.15562,-6.86,-1.52,-7.211845500275504
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cc(Cl)ccc1Cl,C40777709_decoy,TRY1,Decoy,0,-8.06692,-7.06,-2.27,-5.8925792241176
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(Cl)cc1Cl,C40777798_decoy,TRY1,Decoy,0,-8.83621,-7.11,-1.87,-7.310062691865663
CC(C)[NH+](CCCO)[C@H](C)C(=O)Nc1cc(Cl)ccc1N,C42482942_decoy,TRY1,Decoy,0,-6.61438,-4.19,-3.24,-5.012739549200385
CC(C)N(CC(N)=O)[C@H](C[NH3+])c1ccc(Br)cc1,C42955127_decoy,TRY1,Decoy,0,-7.98431,-4.43,-2.04,-4.8377082972329735
NC[C@H](c1cc(Br)cs1)[NH+]1CCC[C@@H]1C(N)=O,C43285093_decoy,TRY1,Decoy,0,-7.9322,-4.15,-1.17,-4.745552207262532
NC(=O)C[C@@H]([NH3+])c1c(Br)sc2ccc(Cl)cc12,C44254665_decoy,TRY1,Decoy,0,-10.1789,-5.13,-0.76,-5.21139494244972
COc1cc(C[C@H]([NH3+])CO)cc(I)c1O,C44463775_decoy,TRY1,Decoy,0,-9.3741,-5.72,-1.53,-9.05155286173274
C[C@@H](C(=O)Nc1c(N)cc(Cl)cc1Cl)[NH+]1CCC[C@@H]1CO,C48859749_decoy,TRY1,Decoy,0,-7.74326,-4.48,-1.78,-4.7982512640058514
CCC[NH+](CCO)CC(=O)Nc1c(N)cc(Cl)cc1Cl,C48917623_decoy,TRY1,Decoy,0,-8.55888,-5.09,-5.48,-5.180210439797694
NC(=O)c1sc2[nH+]c3c(c(-c4ccc(Cl)c(Cl)c4)c2c1N)CCCCCC3,C49069294_decoy,TRY1,Decoy,0,-7.86089,-7.79,0.01,-8.221382913401271
CC[NH2+][C@H](C)c1cc(Cl)ccc1O[C@H](C)C(=O)NC(N)=O,C50210145_decoy,TRY1,Decoy,0,-7.88057,-6.92,-2.51,-8.844660619689746
Cc1ccc(N2C(=O)NC(=O)/C(=C\N[C@H]3CCCC[C@H]3[NH3+])C2=O)cc1C,C20327670_decoy,TRY1,Decoy,0,-9.67372,-5.73,-3.48,-5.418568370789465
C[NH+]1CC[C@H](CNC(=O)c2cc(Br)cnc2NN)C1,C51091299_decoy,TRY1,Decoy,0,-8.12034,-4.37,-4.08,-4.602318917806224
CC[C@@]([NH2+]CCC[NH3+])(C(=O)[O-])c1ccc(Br)cc1,C51355639_decoy,TRY1,Decoy,0,-8.23688,-5.01,-1.25,-5.816537003696659
[NH3+][C@@H](Cc1ccccc1F)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094369_decoy,TRY1,Decoy,0,-7.30878,-6.72,-0.68,-7.628236648841602
O=c1[nH]c2cc(Br)c([C@H](O)C3CC[NH2+]CC3)cc2[nH]1,C52094771_decoy,TRY1,Decoy,0,-7.33026,-5.35,-0.13,-4.015745360716203
CC1(C)[NH+]=C(N)N=C(N)N1c1cc(Cl)c(Cl)cc1Cl,C16981838_decoy,TRY1,Decoy,0,-8.67819,-5.34,-1.82,-4.230806099248915
COc1cc([C@@H](O)[C@@H]([NH3+])CC(C)C)cc(Br)c1O,C54929563_decoy,TRY1,Decoy,0,-8.23307,-4.99,-3.8,-4.9785262440916505
Cc1c(NC(=O)[C@H]2C[C@@H](O)C[NH2+]2)cccc1C(=O)NC(C)(C)C,C55211162_decoy,TRY1,Decoy,0,-7.2612,-5.09,-2.05,-4.731710542133592
CCCOc1ccc(-c2nc3ccccc3n2CCC[NH3+])cc1N,C57801181_decoy,TRY1,Decoy,0,-6.90517,-4.91,-1.46,-5.116236266237548
Cc1cc(C)c2c(c1)[C@@]1(NC(N)=Nc3[nH+]c4ccccc4n31)C(=O)N2,C57877132_decoy,TRY1,Decoy,0,-5.68597,-5.98,-1.51,-2.8775424030140164
CC[C@@H]([NH3+])Cc1cc(Cl)cc(Cl)c1O[C@H](CC)C(N)=O,C61678446_decoy,TRY1,Decoy,0,-8.78834,-5.55,-2.58,-5.389015902593822
COc1ccc(OC)c(/N=C2/NC3(CCCCC3)NC(N)=[NH+]2)c1,C02814354_decoy,TRY1,Decoy,0,-8.12985,-5.34,-2.0,-4.308428041792594
COc1cc(N)ccc1NC(=O)[C@@H](C(C)C)[NH+]1CCCNCC1,C62462868_decoy,TRY1,Decoy,0,-7.48311,-6.46,-1.66,-9.455997499664846
NS(=O)(=O)CCC[NH2+]Cc1ccc(O)c(Br)c1,C62702806_decoy,TRY1,Decoy,0,-8.76705,-5.56,-0.73,-6.66413806759997
COc1ccccc1[C@@H]1N[C@@H](C(=O)NN)CC2=c3ccccc3=[NH+][C@@H]21,C63349888_decoy,TRY1,Decoy,0,-6.75392,-7.64,-0.12,-12.087880042584429
Cc1cc(F)cc2c1NC(=O)[C@]21NC(N)=Nc2[nH+]c3ccccc3n21,C63775014_decoy,TRY1,Decoy,0,-5.65909,-6.47,-2.28,-2.5338711356600934
[NH3+]CCc1nc(NCCCc2ccccc2O)c2ccccc2n1,C65398897_decoy,TRY1,Decoy,0,-8.72586,-6.53,-0.69,-7.883427672571893
CC1=C(C(N)=O)[C@@H](c2cccc(Cl)c2Cl)NC(=S)N1,C00071663_decoy,TRY1,Decoy,0,-8.25127,-4.65,-1.71,-3.8099475073364006
N#CC1=C(N)Oc2cc(O)ccc2[C@H]1c1cccc(O)c1,C00284724_decoy,TRY1,Decoy,0,-7.16868,-6.73,-2.32,-3.816426509473166
Cc1ccc2ccccc2c1NSc1nc(N)cc(=O)[nH]1,C04674202_decoy,TRY1,Decoy,0,-7.50586,-7.15,-0.68,-7.995936928177648
C[C@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(N)=O,C06108843_decoy,TRY1,Decoy,0,-8.88403,-7.77,-1.27,-7.482770867180908
C[C@@H]1CCc2sc3nc(SCC(N)=O)nc(N)c3c2C1,C16846580_decoy,TRY1,Decoy,0,-9.62717,-6.07,-3.07,-5.849859245199122
NC1=N[C@H](c2ccc(O)cc2)[C@@H](c2ccccc2)C(O)=N1,C16884096_decoy,TRY1,Decoy,0,-7.68504,-7.61,-3.17,-7.472512090252749
N#CC1=C(N)SC(N)=C(C#N)C1c1ccc(F)c(F)c1,C19597319_decoy,TRY1,Decoy,0,-6.93566,-4.75,-0.94,-3.2059093070372544
Cc1ccc([C@H](C)Nc2ccc3[nH]c(=O)[nH]c3c2)c(O)c1,C20095126_decoy,TRY1,Decoy,0,-6.25695,-5.13,-0.0,-3.908666990865673
Cc1ccc(O)c(Nc2cc(C(F)(F)F)cnc2N)c1,C20318401_decoy,TRY1,Decoy,0,-6.65637,-6.95,-2.25,-6.6102142075986965
Nc1cc(S(N)(=O)=O)ccc1Sc1ccccc1,C34974530_decoy,TRY1,Decoy,0,-6.94657,-5.18,-1.74,-4.534751114337582
Nc1cc2c(cc1Nc1cc(Cl)ccc1F)NC(=O)C2,C35345580_decoy,TRY1,Decoy,0,-6.8515,-6.41,-0.46,-4.637446793498789
CSc1cccc(Nc2cc3c(cc2N)CCC(=O)N3)c1,C35355894_decoy,TRY1,Decoy,0,-8.16364,-5.38,-3.23,-4.528415595174528
Nc1cc2c(cc1Nc1cccc(Cl)c1)NC(=O)CC2,C35355942_decoy,TRY1,Decoy,0,-6.96848,-5.52,-0.94,-4.122640207029504
Cc1ccc(Nc2cc3nc[nH]c(=O)c3cc2N)c(F)c1,C35383205_decoy,TRY1,Decoy,0,-6.87804,-7.26,-0.62,-8.390288205963696
CN(C)c1ccc(Nc2cc3c(cc2N)CC(=O)N3)cc1,C36335223_decoy,TRY1,Decoy,0,-6.5399,-5.55,-0.63,-4.028433481120022
C[C@@]12CC[C@H]3[C@@H](CCC4=C/C(=N\N)CC[C@]43C)[C@H]1CC/C2=N\N,C37230461_decoy,TRY1,Decoy,0,-8.44158,-7.65,-2.15,-4.551957897023094
Cc1ccccc1Sc1ccc(S(N)(=O)=O)cc1N,C37665606_decoy,TRY1,Decoy,0,-6.52572,-5.31,-2.68,-4.298354183808879
N#CC1=C(N)Oc2cc(N)ccc2[C@H]1c1cccc(F)c1,C00196790_decoy,TRY1,Decoy,0,-6.25171,-5.64,-1.06,-4.077881945534872
C[C@@H]1O[C@@H](Nc2cccc3ccccc23)[C@@H](O)[C@@H](O)[C@H]1O,C03878480_decoy,TRY1,Decoy,0,-5.78556,-6.87,-0.56,-4.515968066480864
Nc1cc(Sc2ccc(Cl)cc2)cc(S(N)(=O)=O)c1,C37934332_decoy,TRY1,Decoy,0,-8.71284,-6.33,-1.68,-6.062507246318015
CC1(C)CCC[C@@]2(C)[C@@H]1CC[C@@](C)(O)[C@@H]2CC(=O)NN,C05003789_decoy,TRY1,Decoy,0,-6.44585,-5.82,-1.65,-4.344748078237426
C#Cc1cccc(NS(=O)(=O)c2ccc(O)c(N)c2)c1,C40316299_decoy,TRY1,Decoy,0,-7.06647,-4.42,-1.69,-4.071343842585474
Cc1ccsc1C(=O)NC1(/C(N)=N/O)CCC(C)CC1,C40372527_decoy,TRY1,Decoy,0,-7.58446,-4.51,-1.85,-4.40818205201726
Cc1ccc([C@@H]2C3=C(CCCC3=O)Nc3[nH]c(=S)nc(N)c32)cc1,C08507592_decoy,TRY1,Decoy,0,-6.43751,-5.63,-0.46,-3.711085715062862
CC1(C)CC(=O)C2=C(C1)Nc1[nH]c(=S)nc(N)c1[C@@H]2c1cccs1,C08236387_decoy,TRY1,Decoy,0,-8.00494,-4.87,-3.3,-4.319231491261407
[NH3+]C1(C(=O)Nc2ccc(Cl)cc2C(=O)[O-])CCCC1,C40469558_decoy,TRY1,Decoy,0,-7.22052,-5.71,-1.56,-4.925460157386846
CC(C)[NH+]1C[C@H]2CCC[C@@H](C1)C2[NH2+]C[C@@H]1CC[NH+](C)C1,C40769270_decoy,TRY1,Decoy,0,-7.15375,-4.34,-0.38,-4.499209720547315
O=C1CSc2ccc(NCc3cccc(O)c3O)cc2N1,C41117300_decoy,TRY1,Decoy,0,-9.52896,-5.97,-1.43,-5.292948525430123
C[C@@]12CC[C@@H](O)CC1=CC[C@@H]1[C@@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C43191468_decoy,TRY1,Decoy,0,-8.4214,-5.03,-1.25,-3.846590303712611
C[C@H](O)[C@]1(O)CC[C@H]2[C@H]3C[C@H](O)[C@H]4C[C@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C43757366_decoy,TRY1,Decoy,0,-8.9123,-5.31,-2.17,-4.272098028432277
C[C@@]12CC[C@@H](O)C[C@@H]1CC[C@H]1[C@@H]2[C@@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C44460402_decoy,TRY1,Decoy,0,-8.16476,-5.31,-2.78,-4.8975703779728015
N/C(=N/O)C1(C(=O)Nc2cc(F)ccc2F)CCCC1,C44783962_decoy,TRY1,Decoy,0,-5.7914,-4.74,-0.25,-3.784930370795625
Nc1nc2c(Cl)c3sc(N)nc3c(Cl)c2s1,C45891140_decoy,TRY1,Decoy,0,-9.07761,-5.26,-0.13,-10.822507410110967
Cc1cc(C)cc(CSc2nc(N)cc(N)c2C#N)c1,C48380224_decoy,TRY1,Decoy,0,-7.48834,-6.69,-1.01,-6.83093249872887
NC(=O)c1sc2nc3c(c(-c4nccs4)c2c1N)CCCCCC3,C49112216_decoy,TRY1,Decoy,0,-7.90141,-7.39,-0.42,-8.453452574614113
C[C@H](NC(=O)c1c[nH]c2cc(N)ccc12)c1ccc(Cl)s1,C49126473_decoy,TRY1,Decoy,0,-8.49276,-8.09,-0.67,-10.863873508128409
CC[C@@H](Nc1cc2c(cc1N)CC(=O)N2)c1cccs1,C49529206_decoy,TRY1,Decoy,0,-7.29256,-6.25,-0.9,-7.508260548591466
CN(c1cc(N)cc(S(N)(=O)=O)c1)c1ccccc1F,C50003235_decoy,TRY1,Decoy,0,-8.15848,-6.02,-3.48,-5.478806882996712
CC(C)(C)NC(=O)c1cc(Br)cnc1NN,C51095379_decoy,TRY1,Decoy,0,-7.14328,-5.53,-2.41,-5.069083082333208
NNc1ncc(Br)cc1C(=O)NC1CCCC1,C51095616_decoy,TRY1,Decoy,0,-7.32136,-6.22,-1.95,-7.557378155894556
Nc1ccccc1[C@H](O)CN1CC(=O)Nc2ccccc21,C51326023_decoy,TRY1,Decoy,0,-6.57064,-7.64,-0.72,-9.721226115016592
Cc1nnc(N[C@@H]2CCCC[C@H]2O)c(C(N)=S)c1C,C52010587_decoy,TRY1,Decoy,0,-8.86473,-4.99,-2.65,-5.179571019350784
N[C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)c1c(F)cccc1F,C52094423_decoy,TRY1,Decoy,0,-7.4488,-5.15,-1.26,-4.042252652884398
CN(Cc1ccccc1N)c1cccc(Cl)c1C(N)=O,C52906811_decoy,TRY1,Decoy,0,-6.69913,-7.27,-1.53,-8.683506050732708
C[C@@H]1CCC[C@](CO)(NC(=O)c2cc(N)c(Cl)c(Cl)c2)C1,C53112513_decoy,TRY1,Decoy,0,-9.3848,-7.16,-2.06,-5.557390459105744
C[C@@H]1CCC[C@](CO)(Nc2ccc3scnc3c2N)C1,C53114877_decoy,TRY1,Decoy,0,-9.35266,-6.66,-0.41,-10.453593356758528
N/C(=N/O)C1(NC(=O)c2cccc(F)c2F)CCCC1,C54214428_decoy,TRY1,Decoy,0,-6.4364,-7.02,-0.79,-6.832763380488202
C[C@H](NC(=O)c1cccc(F)c1NN)c1ccc(Cl)s1,C54216330_decoy,TRY1,Decoy,0,-7.59382,-5.73,-0.89,-9.544417159644349
Cc1cc(Br)cc(N)c1NC(=O)c1cc[nH]n1,C62775335_decoy,TRY1,Decoy,0,-7.72752,-7.07,-0.28,-7.560992296379979
[NH3+][C@@H]1CCCCC[C@H]1NC(=O)c1cc(F)c(F)c([O-])c1F,C63211157_decoy,TRY1,Decoy,0,-9.24479,-5.22,-4.35,-4.728126305664543
C=CCNC(=S)NNC(=O)c1sc2nc(C)cc(C)c2c1N,C04334742_decoy,TRY1,Decoy,0,-7.21014,-5.37,-2.41,-5.014240183604016
Cc1c(CNc2cccc(Br)c2)ccc2nc(N)nc(N)c12,C01768097_decoy,TRY1,Decoy,0,-8.10725,-7.9,-0.19,-10.740761288631557
CC1(C)Nc2ccccc2C2=C1SSC2=C(C(N)=O)C(N)=O,C00361820_decoy,TRY1,Decoy,0,-7.09086,-5.76,-0.04,-4.5251281238183605
C/C(=N\N)[C@]1(O)CC[C@H]2[C@H]3CCC4=C/C(=N\N)CC[C@@]4(C)[C@@H]3CC[C@@]21C,C05034599_decoy,TRY1,Decoy,0,-8.48376,-5.95,-2.03,-3.935357864661353
NC(=S)NN[C@H](Nc1ccc(Cl)cc1)c1ccc(Cl)cc1,C00048407_decoy,TRY1,Decoy,0,-8.19113,-4.92,-0.35,-5.384992954808827
C[C@@H](Sc1nc(N)nc(N)n1)C(=O)Nc1ccc(C(C)(C)C)cc1,C09366680_decoy,TRY1,Decoy,0,-7.9965,-6.32,-1.17,-5.047717421714104
Nc1nc(N)c2c(n1)NC1=C(C(=O)CCC1)[C@@H]2c1ccc(Cl)cc1,C10339099_decoy,TRY1,Decoy,0,-6.79087,-8.18,-1.25,-7.094351088983914
Nc1nc(N)c2c(n1)NC1=C(C(=O)CCC1)[C@H]2c1ccc(F)cc1,C10339105_decoy,TRY1,Decoy,0,-6.71697,-6.1,-0.33,-4.031995809409463
NC(=S)NNC(=S)NC(=O)c1ccc(Cl)cc1Cl,C12501392_decoy,TRY1,Decoy,0,-8.77329,-5.39,-1.2,-6.642689202196785
C[C@H](Sc1nc(N)nc(N)n1)C(=O)Nc1ccc(C(C)(C)C)cc1,C12617296_decoy,TRY1,Decoy,0,-7.4964,-8.02,-1.6,-9.44849580438069
Cc1ccc(NC[C@@H](O)[C@@H](O)[C@@H](O)CO)c(/N=N/c2ccccc2)c1C,C13110579_decoy,TRY1,Decoy,0,-8.20975,-6.12,-1.06,-8.658049609352593
Nc1nc(N)c2nc(CNc3ccc(Cl)c(Cl)c3)cnc2n1,C13283497_decoy,TRY1,Decoy,0,-8.31756,-8.75,-0.87,-10.506556299573305
NC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2,C13639667_decoy,TRY1,Decoy,0,-7.42498,-7.49,-1.27,-8.467915105717973
C[C@@H](Sc1nc(N)nc(N)n1)C(=O)c1c[nH]c2ccccc12,C14165295_decoy,TRY1,Decoy,0,-7.85986,-8.02,-2.07,-9.504481452446528
C[C@@H]1[C@@H](c2ccccc2O)c2cc3c(cc2O[C@H]1NNC(N)=O)OCO3,C01642708_decoy,TRY1,Decoy,0,-7.46974,-5.88,-1.47,-5.017017379572391
C=CCNC(=S)NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl,C16273707_decoy,TRY1,Decoy,0,-10.268,-4.11,-2.21,-5.55457835200546
CCc1sc(C(=O)NNC(=O)[C@H](NC(N)=O)[C@@H](C)CC)cc1C,C25395537_decoy,TRY1,Decoy,0,-8.86208,-5.62,-3.3,-6.192944501749867
S=C(NNC(=S)Nc1ccccc1Cl)NNc1ccccc1,C06575338_decoy,TRY1,Decoy,0,-7.33585,-6.2,-1.12,-4.964696653338391
C[C@H]1CCc2c(sc3nc(SCC(=O)NC(N)=O)nc(N)c23)C1,C36812549_decoy,TRY1,Decoy,0,-7.88922,-6.73,-2.6,-5.664887231532342
Nc1cc(S(N)(=O)=O)ccc1Nc1ccc(F)c(Cl)c1,C37333735_decoy,TRY1,Decoy,0,-9.37285,-5.86,-1.27,-4.906252139455157
C/C(=N\N)[C@@]1(O)CC[C@@H]2[C@H]3C=CC4=C/C(=N\N)CC[C@]4(C)[C@H]3CC[C@@]21C,C37536206_decoy,TRY1,Decoy,0,-8.20784,-6.37,-1.5,-5.493886691289962
CC(C)(C)c1cc(O)cc(C(C)(C)C)c1C[NH+]1CCN(CC[NH3+])CC1,C19367669_decoy,TRY1,Decoy,0,-7.82027,-3.81,-0.95,-4.354142234427468
Nc1cc(Nc2cc(Cl)ccc2Cl)cc(S(N)(=O)=O)c1,C37934086_decoy,TRY1,Decoy,0,-7.97186,-6.37,-1.45,-9.0622650006341
COC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@H]1c1ccccc1,C39327076_decoy,TRY1,Decoy,0,-7.41044,-6.41,-1.56,-9.01113031411208
COc1cc(Br)cc(C)c1NC(=O)c1ccc(N)cc1N,C40307654_decoy,TRY1,Decoy,0,-6.9947,-7.65,-0.65,-10.477700367685326
C[C@@H](NC(=O)c1ccc(N)cc1N)c1ccccc1Br,C40309615_decoy,TRY1,Decoy,0,-7.96176,-7.84,-0.54,-11.138615073132996
Cc1ccc(C(=O)NNc2ncnc(NC(C)(C)C)c2N)cc1,C40680622_decoy,TRY1,Decoy,0,-6.89491,-5.53,-2.08,-4.747150731427138
CNc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N,C40707044_decoy,TRY1,Decoy,0,-7.67175,-7.41,-2.0,-6.540164036052245
Cc1ccc(C(=O)NNc2ncnc(Nc3ncccc3C)c2N)cc1,C40758080_decoy,TRY1,Decoy,0,-7.42452,-6.19,-1.96,-5.738996672625556
CN(C)Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N,C40760027_decoy,TRY1,Decoy,0,-7.7775,-5.43,-1.63,-4.918060776548302
Nc1ccc(C(=O)NCc2cc(Br)ccc2F)c(N)c1,C41069109_decoy,TRY1,Decoy,0,-7.53267,-8.62,-0.54,-13.059313943230205
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNc1c(F)c(F)c(F)c(F)c1F,C42523420_decoy,TRY1,Decoy,0,-7.52437,-6.25,-3.08,-5.7402622792114215
CCC(CC)(NC(=O)c1ccc(Br)cc1O)/C(N)=N/O,C44490106_decoy,TRY1,Decoy,0,-7.80999,-4.26,-1.85,-4.964300678437183
C[C@H](SCc1nc(N)nc(N)n1)C(=O)Nc1ccc(C(C)(C)C)cc1,C44832328_decoy,TRY1,Decoy,0,-9.03022,-6.89,-2.22,-7.540376161835619
C[C@H](Nc1cc(N)cc(S(N)(=O)=O)c1)c1cccc(Cl)c1,C49515310_decoy,TRY1,Decoy,0,-9.69253,-7.2,-2.99,-7.683729538979162
[NH3+][C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(Br)cc1C(=O)[O-],C50208890_decoy,TRY1,Decoy,0,-8.90147,-7.09,-2.49,-5.99916155656223
C[C@H](Nc1cc(Cl)nc(N)n1)c1ccc(NC(=O)NC2CC2)cc1,C52313875_decoy,TRY1,Decoy,0,-7.5338,-6.84,-2.13,-5.287816173920333
NC(=O)NNC(=O)NCC1(c2cccc(Br)c2)CCC1,C52592105_decoy,TRY1,Decoy,0,-7.3443,-4.86,-0.46,-4.760727101918012
CC[C@@H](C/C(N)=N/O)NC(=O)c1ccc(Br)cc1O,C54163263_decoy,TRY1,Decoy,0,-7.20863,-6.04,-1.58,-5.3477894567527
CS(=O)(=O)NCCc1ccc(-c2csc(N=C(N)N)n2)s1,C29456596_decoy,TRY1,Decoy,0,-8.4444,-6.12,-0.94,-6.764047866485051
Nc1n[nH]c(=Cc2ccc(F)cc2)/c1=C1/NC(=O)c2ccccc2N1,C58294864_decoy,TRY1,Decoy,0,-4.94817,-5.36,-1.61,-3.2054035488068133
OC[C@@H]1O[C@H](Nc2ccc(/N=N/c3ccccc3)cc2)[C@@H](O)[C@@H](O)[C@@H]1O,C13477285_decoy,TRY1,Decoy,0,-6.16409,-6.06,-4.21,-4.370264066547328
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2,C05295606_decoy,TRY1,Decoy,0,-7.81316,-6.53,-3.72,-5.904396491718263
Cc1ccc(NC[C@H](O)[C@H](O)[C@H](O)CO)c(/N=N/c2ccccc2)c1C,C05005333_decoy,TRY1,Decoy,0,-7.27296,-6.96,-1.47,-7.989451500814681
COc1ccc2[nH]/c(=N/C(=O)CS[C@@H]3NN[C@H](N)S3)sc2c1,C38932308_decoy,TRY1,Decoy,0,-10.0459,-6.45,-1.83,-7.627875980764001
Nc1ccc([C@@H](O)[C@@H](CO)NC(=O)c2ccc(Cl)cc2Cl)cc1,C66142161_decoy,TRY1,Decoy,0,-7.4756,-7.56,-2.14,-9.371332255602978
CCc1ccc(OC[C@H](O)CSc2nc(N)cc(N)n2)cc1,C66238902_decoy,TRY1,Decoy,0,-8.33463,-6.22,-1.66,-6.560688803122593
Cc1ccc(OC[C@@H](O)CSc2nc(N)cc(N)n2)c(C)c1,C66238905_decoy,TRY1,Decoy,0,-9.01307,-6.98,-1.13,-8.542749622795517
CCCCNC(=O)NC(=O)[C@@H](C)Nc1ccc(C)c(C(N)=O)c1,C66940779_decoy,TRY1,Decoy,0,-8.17327,-6.66,-1.88,-5.810392792881067
Cc1ccc(NC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)cc1C(N)=O,C67313754_decoy,TRY1,Decoy,0,-8.67546,-8.04,-0.58,-7.827896741471154
Cc1cccc2cc(CN(C[C@H]3CCCO3)S(=O)(=O)c3ccc4c(c3)OCCO4)c(=O)[nH]c12,C00913637_decoy,TRY1,Decoy,0,-8.81339,-6.46,-1.57,-5.98587656297429
CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc2[nH]cc(C(=O)N3CCC4(CC3)OCCO4)c(=O)c2c1,C06181249_decoy,TRY1,Decoy,0,-8.19212,-6.27,-3.07,-5.23701899306908
COc1ccc(N2C(=O)/C(=C/c3cc(Br)c(N4CCOCC4)o3)C(=O)NC2=S)cc1,C02979316_decoy,TRY1,Decoy,0,-8.44198,-7.76,-3.49,-8.793792003168242
Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(Cl)cc3)C2=O)c(C)n1[C@@H]1CCS(=O)(=O)C1,C08622755_decoy,TRY1,Decoy,0,-8.23042,-8.06,-1.57,-6.559981744252216
O=C(CCN1C(=O)c2ccccc2C1=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1,C09005870_decoy,TRY1,Decoy,0,-7.28929,-6.04,-3.56,-5.344988485357931
Cc1ccc(S(=O)(=O)[C@@H](CNS(=O)(=O)C2=CCS(=O)(=O)C2)c2cccs2)cc1C,C09103726_decoy,TRY1,Decoy,0,-8.67739,-7.73,-2.58,-7.729581162941356
Cc1nc(S[C@@H](C)C(=O)N[C@@H]2CCCc3ccccc32)c2c(=O)n(C)c(=O)n(CC(C)C)c2n1,C10525653_decoy,TRY1,Decoy,0,-7.67771,-8.56,-2.97,-7.445558740545284
C[C@H](OC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)c(F)c1F,C10765117_decoy,TRY1,Decoy,0,-9.90853,-8.47,-1.76,-9.983748453545322
CC(=O)N[C@@H]1c2ccccc2C2(CCN(C(=O)c3sc(C)nc3C)CC2)[C@H]1OCc1ccccn1,C12034829_decoy,TRY1,Decoy,0,-8.09375,-5.79,-2.75,-5.555946026531112
Cc1nc(C)c(CCC(=O)N2CCN(S(=O)(=O)c3ccccc3C(F)(F)F)CC2)c(=O)[nH]1,C12769940_decoy,TRY1,Decoy,0,-7.8639,-8.3,-3.3,-7.216861145400975
COc1ccc(OC)c2c1CN(C(=O)CCn1cnc3sc4c(c3c1=O)CCCC4)C[C@@H]2O,C12974558_decoy,TRY1,Decoy,0,-8.45709,-7.92,-2.55,-6.218111787519314
C[C@@]1(c2ccc3c(c2)CCC3)NC(=O)N(CC(=O)N(c2ccccc2)[C@H]2CCS(=O)(=O)C2)C1=O,C13114825_decoy,TRY1,Decoy,0,-7.81421,-8.17,-3.22,-6.197009983542016
O=C1Cc2cc(S(=O)(=O)N3CCN(c4cnn(-c5ccccc5)c(=O)c4Cl)CC3)ccc2N1,C14235144_decoy,TRY1,Decoy,0,-8.36374,-8.17,-1.66,-5.462079396657106
C[C@@H](Sc1nc2scc(-c3cccs3)c2c(=O)n1C)C(=O)N[C@@H]1CCS(=O)(=O)C1,C16797943_decoy,TRY1,Decoy,0,-9.70363,-6.12,-2.25,-5.967400819469377
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(-c3ccc(F)cc3)cc(C(=O)NC[C@@H]3CCCO3)c12,C16992733_decoy,TRY1,Decoy,0,-8.61857,-8.03,-2.33,-6.412195539219065
O=C1N[C@H](CC(=O)N2CCC3(CC2)C[C@@H]3C(=O)N2CCN(Cc3cccs3)CC2)c2ccccc21,C20149518_decoy,TRY1,Decoy,0,-9.2471,-7.0,-2.43,-6.2196046016319775
Cn1c(=O)oc2cc(S(=O)(=O)N3CCC[C@@H](C(=O)Nc4ncc(Br)s4)C3)ccc21,C20326904_decoy,TRY1,Decoy,0,-8.71715,-6.12,-1.51,-5.205206500179709
O=C(Nc1nc2c(s1)C(=O)C[C@@H](C(=O)N1CCN(Cc3ccccn3)CC1)C2)c1cccs1,C14981879_decoy,TRY1,Decoy,0,-9.10671,-6.05,-1.48,-5.403997330130197
CCn1cc(/C([O-])=N/c2nc(-c3ccccc3)cs2)c(=O)c2cc(F)c(N3CC[NH+](C)CC3)cc21,C20840489_decoy,TRY1,Decoy,0,-8.87822,-6.21,-1.86,-5.325391695294031
O=S(=O)(CCN(C1CCCC1)S(=O)(=O)c1ccc(Br)cc1)N1CCNCC1,C15868824_decoy,TRY1,Decoy,0,-8.86686,-6.54,-3.9,-5.73137330707594
CCCN1C(=O)/C(=C\c2c(N3CCN(CCO)CC3)nc3c(C)cccn3c2=O)SC1=S,C24081175_decoy,TRY1,Decoy,0,-7.5679,-6.28,-3.14,-5.2078068675763305
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)Nc2cccc(Cl)c2N2CCOCC2)C1,C25069630_decoy,TRY1,Decoy,0,-8.62936,-8.34,-3.5,-6.0221575984936
O=C([C@H]1COc2ccccc2O1)N1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[nH]2)CC1,C12795242_decoy,TRY1,Decoy,0,-9.981,-6.61,-2.87,-6.29772269953421
CC(C)Oc1ccccc1NS(=O)(=O)c1cccc(S(=O)(=O)[C@H]2CCS(=O)(=O)C2)c1,C31772982_decoy,TRY1,Decoy,0,-8.11861,-6.49,-2.21,-6.04261089927722
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)Nc2cc3c(cc2Cl)OCCO3)c1,C32582292_decoy,TRY1,Decoy,0,-8.78452,-7.1,-1.4,-6.985915720085019
CCCN1CCN(C(=O)C2CCN(S(=O)(=O)c3cc4c(cc3C)NC(=O)[C@@H](C)O4)CC2)CC1,C32958979_decoy,TRY1,Decoy,0,-9.61921,-6.36,-1.25,-5.745891715044599
C[C@@H](Sc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)N1CC(=O)Nc2ccccc21,C18524828_decoy,TRY1,Decoy,0,-8.93172,-7.92,-4.91,-7.111032639729647
COc1ccc(CCN2C(=O)N=C([O-])[C@]3(Cc4ccccc4N4CC[NH+](C)C[C@H]43)C2=O)cc1OC,C35877373_decoy,TRY1,Decoy,0,-6.77958,-8.09,-1.44,-5.127389382479127
C/C(=N/NC(=O)CN1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1)c1ccco1,C36001137_decoy,TRY1,Decoy,0,-9.35918,-6.98,-1.1,-5.804496619199671
O=C(CSc1nnc(-c2ccc(Cl)cc2)n1C[C@H]1CCCO1)N[C@H]1CCS(=O)(=O)C1,C09612761_decoy,TRY1,Decoy,0,-9.16532,-7.52,-1.75,-9.372520008871929
CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc4c(ccc5ccccc54)oc3=O)CC2)cc1,C38711014_decoy,TRY1,Decoy,0,-7.13981,-8.48,-1.99,-5.80592003965012
CCn1c(NCc2ccco2)c(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)c(C)c(C#N)c1=O,C38731542_decoy,TRY1,Decoy,0,-7.50023,-5.61,-1.97,-6.046837614677788
COCc1ccc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)C2=CC4=C(C)C(C)=N[C@H]4C=C2)C3)o1,C39353862_decoy,TRY1,Decoy,0,-8.46928,-6.51,-3.03,-5.338747160180397
CCOn1c2c(c3ncc(S(=O)(=O)C(C)C)cc3c1=O)N[C@H](I)CC2=O,C39451668_decoy,TRY1,Decoy,0,-8.64937,-5.95,-1.24,-5.527302225160712
CCOc1cnc2c3c(n(I)c(=O)c2c1)C(=O)C[C@@H](S(=O)(=O)C(C)C)N3,C39452353_decoy,TRY1,Decoy,0,-7.78389,-5.64,-2.68,-4.855016642998248
CO[P@]1(=O)NN2C[C@@H]3C=C(Br)C(S(=O)(=O)Oc4ccccc4)=C[C@@H]3C[C@@H]2CO1,C39468135_decoy,TRY1,Decoy,0,-7.01776,-6.37,-3.97,-4.704615310002519
O=CC[C@H](NC=O)c1ccc(S(=O)(=O)c2ccccc2)c(S(=O)(=O)c2ccccc2)c1F,C39497104_decoy,TRY1,Decoy,0,-8.09522,-7.78,-3.23,-6.307795653222574
CC(C)CNC(=O)[C@H]1COC2(CCN(C(=O)c3ccc(F)cc3F)CC2)N1C(=O)c1ccco1,C40390686_decoy,TRY1,Decoy,0,-6.80019,-5.68,-3.21,-4.3761404577150405
[H]/N=C1C(=C/c2c(-c3ccccc3)nc3sc(CC)nn23)/C(=O)N=C2SC(C(F)(F)F)=NN2/1,C41074381_decoy,TRY1,Decoy,0,-8.30914,-6.49,-2.27,-7.028263537229626
Cn1c(SCC(=O)Nc2ccc(Br)cc2Cl)nnc1[C@H]1CCS(=O)(=O)C1,C45643247_decoy,TRY1,Decoy,0,-8.96026,-6.44,-1.81,-6.048557534881141
O=C(Nc1nc(CC(=O)N2CCN(c3ncccn3)CC2)cs1)c1ccc(Br)o1,C46899316_decoy,TRY1,Decoy,0,-9.29718,-7.7,-1.22,-6.40222539445832
[H]/N=C1C(=C/c2ccc(OS(C)(=O)=O)c(OC)c2)/C(=O)N=C2SC(c3ccccc3C)=NN2/1,C41108086_decoy,TRY1,Decoy,0,-8.4918,-6.33,-2.72,-5.738415123923427
[H]/N=C1C(=C/c2cc(C)n(-c3ccc(OCC)cc3)c2C)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C34366980_decoy,TRY1,Decoy,0,-8.09289,-2.63,-1.57,-4.13621132637955
[H]/N=C1C(=C\c2cc(C)n(-c3cc(C)cc(C)c3)c2C)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206919_decoy,TRY1,Decoy,0,-6.72472,-8.65,-1.74,-5.163430978396018
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC(c4n[nH]c(C5CC5)n4)CC3)CC2)cc1C,C58223445_decoy,TRY1,Decoy,0,-9.18118,-7.31,-3.45,-6.013483530346955
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CCC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1,C32936169_decoy,TRY1,Decoy,0,-7.18902,-8.76,-2.94,-6.98222124472363
Cc1cc(C(=O)N[C@H]2CS(=O)(=O)C[C@@H]2N2CCCCC2)c(C)n1-c1ccc2c(c1)OCCO2,C60362694_decoy,TRY1,Decoy,0,-8.74569,-8.28,-2.0,-6.208816323784905
O=C(c1ccco1)N1CCN(C(=O)c2cnn3c2N[C@@H](c2cccs2)C[C@H]3C(F)(F)F)CC1,C18209984_decoy,TRY1,Decoy,0,-8.29233,-7.71,-1.68,-6.478995136701592
Cc1ccc(N2N=C(C(=O)N3CCN(S(=O)(=O)c4ccc(F)cc4F)CC3)NCC2=O)cc1,C32713315_decoy,TRY1,Decoy,0,-8.924,-8.61,-4.64,-6.797366781551388
[H]/N=C1C(=C\c2cc(C)n(-c3ccccc3Cl)c2C)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C20208560_decoy,TRY1,Decoy,0,-7.67068,-6.21,-1.14,-4.425665879853339
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2c(C)cc(C)cc21,C02138806_decoy,TRY1,Decoy,0,-7.41405,-8.12,-1.26,-8.269728516671144
C/C(=N\NC(N)=O)[C@H](C[NH+]1CCOCC1)[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O,C05831947_decoy,TRY1,Decoy,0,-7.22734,-5.9,-3.23,-6.338655846082086
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790875_decoy,TRY1,Decoy,0,-9.67341,-6.21,-2.4,-6.133170708611421
CC(=O)c1ccc(NC(=S)/N=C(\Nc2nc(C)cc(C)n2)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C14158013_decoy,TRY1,Decoy,0,-9.63856,-6.79,-1.74,-7.0553511699389295
CCOc1ccc(NC(=S)/N=C(\Nc2nc(C)cc(C)n2)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C14158044_decoy,TRY1,Decoy,0,-9.69181,-6.36,-2.2,-6.58695710963585
Cc1ccc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cc1,C20908275_decoy,TRY1,Decoy,0,-8.45746,-7.1,-2.03,-5.900667225505887
Cc1ccc(NC(=O)C[NH+](C)CC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1,C07623780_decoy,TRY1,Decoy,0,-8.98404,-7.76,-2.11,-7.388121899353472
[NH3+][C@@H]1[C@H](c2ccccc2)[C@H](CSc2nc3ccccc3[nH]2)NN1c1ccc(F)cc1F,C39143300_decoy,TRY1,Decoy,0,-8.78505,-9.1,-1.58,-7.872712535373182
[NH3+][C@@H]1[C@H](c2ccccc2)[C@@H](CSc2nc3ccccc3[nH]2)NN1c1ccc(F)cc1F,C39143302_decoy,TRY1,Decoy,0,-8.95465,-8.49,-2.63,-7.191993319865004
COc1ccc([C@@H]2N[NH+]=C(NCCc3c[nH]c4ccc(C)cc34)N(N)C2=O)cc1,C39154784_decoy,TRY1,Decoy,0,-8.50134,-6.32,-1.65,-5.955579344587463
COCc1cc(C)nc2c1[C@H]([NH3+])[C@H](C(=O)NCCc1c(C)[nH]c3ccc(OC(F)(F)F)cc13)S2,C39211929_decoy,TRY1,Decoy,0,-7.55421,-6.32,-2.94,-5.437838142533024
Oc1ccc([C@@H]2Nc3ccccc3S2)cc1C[NH2+]CCc1c[nH]c2ccccc12,C39421119_decoy,TRY1,Decoy,0,-7.6241,-8.75,-1.77,-6.7351434217180906
Oc1ccc([C@H]2Nc3ccccc3S2)cc1C[NH2+]CCc1c[nH]c2ccccc12,C39421120_decoy,TRY1,Decoy,0,-8.39063,-8.45,-2.74,-6.32026577428856
CC[C@H](C)CC(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661883_decoy,TRY1,Decoy,0,-10.133,-8.2,-2.59,-8.076463951801204
COc1ccc(C)cc1Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40684308_decoy,TRY1,Decoy,0,-8.19874,-6.82,-1.66,-6.57279303507192
COc1cccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c1,C40688031_decoy,TRY1,Decoy,0,-7.66356,-7.24,-2.69,-7.406966457792857
Cc1cc([C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NCCCn2cc[nH+]c2)c1N,C40688810_decoy,TRY1,Decoy,0,-9.02519,-6.88,-3.1,-5.775801882146683
Cc1ccc2c(Nc3ncnc(Nc4cccc(Cl)c4C)c3N)cccc2[nH+]1,C40701681_decoy,TRY1,Decoy,0,-8.60876,-8.78,-2.36,-7.382249364530692
Cc1ccc2c(Nc3ncnc(Nc4ccc(Cl)cc4C)c3N)cccc2[nH+]1,C40703506_decoy,TRY1,Decoy,0,-9.26231,-8.04,-0.64,-7.079930585722636
Cc1ccc2c(Nc3ncnc(Nc4ccc(C)c(Cl)c4)c3N)cccc2[nH+]1,C40703920_decoy,TRY1,Decoy,0,-9.015,-8.49,-2.59,-9.799580512561578
Cc1ccc2c(Nc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3N)cccc2[nH+]1,C40704337_decoy,TRY1,Decoy,0,-9.51004,-8.43,-2.99,-10.1168855290699
Nc1nonc1C(=O)NCC[NH2+]Cc1ccccc1OCc1c(Cl)cccc1Cl,C40744481_decoy,TRY1,Decoy,0,-8.1448,-7.05,-3.91,-6.1635229692151885
Cc1ccc2c(Nc3ncnc(NC45CC6CC(CC(C6)C4)C5)c3N)cccc2[nH+]1,C40755901_decoy,TRY1,Decoy,0,-8.34783,-8.63,-1.6,-13.22132673787704
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1ccc(Cl)c(C(F)(F)F)c1,C40757574_decoy,TRY1,Decoy,0,-7.96216,-6.82,-2.28,-6.676977164023469
CC1(C)CC(Nc2ncnc(Nc3cccc4cccnc34)c2N)CC(C)(C)[NH2+]1,C40758273_decoy,TRY1,Decoy,0,-7.78998,-7.25,-1.13,-6.402942655046941
Cc1ccc2c(Nc3ncnc(Nc4cccc5ccccc45)c3N)cccc2[nH+]1,C40759090_decoy,TRY1,Decoy,0,-7.68546,-9.36,-2.82,-10.387130428817358
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccccc1Cl,C40777741_decoy,TRY1,Decoy,0,-8.06793,-5.97,-0.8,-5.540928179558294
COc1ccccc1Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40777747_decoy,TRY1,Decoy,0,-7.86801,-7.54,-2.04,-7.205411586731911
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cc(F)ccc1F,C40777992_decoy,TRY1,Decoy,0,-7.98852,-7.59,-1.55,-7.254123052132567
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(F)cc1F,C40777996_decoy,TRY1,Decoy,0,-7.16557,-7.09,-2.05,-5.853516012560215
Cc1ccc2c(Nc3ncnc(Nc4cccc(Cl)c4Cl)c3N)cccc2[nH+]1,C40778878_decoy,TRY1,Decoy,0,-8.98496,-8.7,-1.56,-7.923959163073878
Cc1ccc2c(Nc3ncnc(Nc4ccc(F)c(Cl)c4)c3N)cccc2[nH+]1,C40797747_decoy,TRY1,Decoy,0,-8.14122,-8.51,-0.61,-11.087685468595026
COc1cc(C(=O)Oc2c(Cl)cc(Cl)cc2[C@@H]([NH3+])CC(N)=O)cc(OC)c1OC,C44253620_decoy,TRY1,Decoy,0,-8.31594,-6.59,-4.39,-7.831918160995472
Cc1c(C(=O)NC23CC4CC(CC(C4)C2)C3)oc2c(Cl)cc(Cl)cc2/c1=[NH+]\NC(N)=O,C48553243_decoy,TRY1,Decoy,0,-8.71813,-7.08,-1.26,-5.89329452963361
COc1cc2ncc3c(N)nc(-c4cncc(OC[C@H]([NH3+])Cc5ccc(F)cc5)c4)cc3c2cc1OC,C49089588_decoy,TRY1,Decoy,0,-11.0844,-8.95,-2.45,-7.385838700754967
Nc1nc(N)c(-c2ccc(Cl)cc2)c(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)[nH+]1,C01749241_decoy,TRY1,Decoy,0,-9.23056,-7.45,-3.13,-7.919617227629198
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(Cl)cn1,C40777718_decoy,TRY1,Decoy,0,-7.79932,-7.48,-1.44,-6.970831931152053
N/C(=[NH+]\N=C\c1cc(Br)cc(Br)c1O)c1nonc1N,C06224152_decoy,TRY1,Decoy,0,-9.53722,-7.73,-1.44,-10.484284154292306
CSc1ccccc1NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C31038817_decoy,TRY1,Decoy,0,-9.0726,-7.03,-1.97,-7.241226832587787
CC(C)(C)c1cc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)c(O)c(C(C)(C)C)c1,C07127146_decoy,TRY1,Decoy,0,-7.62779,-7.06,-1.85,-9.678628094805743
CC(C)(C)c1cc([C@H]2NC(=[NH2+])Nc3nc4ccccc4n32)c(O)c(C(C)(C)C)c1,C07127155_decoy,TRY1,Decoy,0,-7.22817,-7.79,-3.27,-6.719194534492949
NC(=O)N[C@@H](CC(=O)NC[C@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl)c1ccccc1F,C64066284_decoy,TRY1,Decoy,0,-8.56905,-8.65,-2.1,-8.193347150228115
C[NH+](CCC(=O)Nc1sccc1C(N)=O)CC(=O)Nc1cc(F)cc(F)c1,C66836738_decoy,TRY1,Decoy,0,-8.6719,-7.15,-0.55,-7.468639955787306
NC(=O)CC[C@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C3CCCC3)C(=O)[C@@H]21,C02127713_decoy,TRY1,Decoy,0,-8.25075,-6.64,-3.21,-6.843326727022531
NC(=O)CC[C@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C3CCCC3)C(=O)[C@@H]21,C02127711_decoy,TRY1,Decoy,0,-9.06519,-8.12,-0.85,-8.157818570534475
COc1ccc(NC(=O)c2c(NC(=O)C[NH2+]CCO)sc3c2CCC3)cc1,C03003083_decoy,TRY1,Decoy,0,-9.1433,-7.07,-2.26,-8.442771785871493
[NH3+]CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21,C02560261_decoy,TRY1,Decoy,0,-7.20296,-7.07,-1.77,-7.116750379426965
Cc1ccc2[nH]cc([C@H]3/C(=C(\O)c4ccccc4)C(=O)C(=O)N3CC[NH2+]CCO)c2c1,C06187984_decoy,TRY1,Decoy,0,-6.75675,-7.05,-3.2,-6.549700470313679
CCc1ccc2c(c1)[C@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08790628_decoy,TRY1,Decoy,0,-7.65417,-6.24,-1.53,-4.955963416922954
CS(=O)(=O)NC1CC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C10043137_decoy,TRY1,Decoy,0,-9.96759,-6.17,-1.78,-6.141094468823739
Cc1ccc2c(c1)[C@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C12885595_decoy,TRY1,Decoy,0,-7.14106,-6.05,-1.31,-5.052452827189006
CSc1ccccc1NC(=O)C[NH+](C)CC(=O)Nc1sc2c(c1C(N)=O)CCC2,C12999948_decoy,TRY1,Decoy,0,-9.52403,-6.89,-2.17,-6.944786815691915
C[NH+](C)CCNC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3cccc4ccccc34)[C@@H]21,C08636325_decoy,TRY1,Decoy,0,-7.78438,-5.28,-1.38,-4.99472939061194
CCOc1c(Br)cc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C16688069_decoy,TRY1,Decoy,0,-7.84239,-6.57,-1.24,-7.590167873114335
Cc1cccc(NC(=O)C[NH+]2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)c1C,C20807604_decoy,TRY1,Decoy,0,-10.318,-7.87,-1.35,-8.566864081448665
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C21985990_decoy,TRY1,Decoy,0,-8.35792,-5.32,-1.3,-5.472369484517728
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+](C)CC(=O)Nc1ccccc1Br,C23038662_decoy,TRY1,Decoy,0,-8.40662,-7.03,-0.94,-8.01733398730667
C[C@@H](C(=O)Nc1sccc1C(N)=O)[NH+](C)CC(=O)Nc1ccccc1Br,C23038663_decoy,TRY1,Decoy,0,-8.1764,-6.69,-1.55,-9.451908098144136
CC(C)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661694_decoy,TRY1,Decoy,0,-9.07813,-8.89,-1.5,-12.367723212385211
CC(C)C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661695_decoy,TRY1,Decoy,0,-8.24805,-8.22,-3.44,-8.08117208017301
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39661868_decoy,TRY1,Decoy,0,-8.8178,-6.03,-2.46,-6.516376703910379
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39661869_decoy,TRY1,Decoy,0,-8.95995,-8.69,-3.24,-7.9823702845661
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2,C39661870_decoy,TRY1,Decoy,0,-8.3625,-7.29,-0.87,-6.41732619418659
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2,C39661871_decoy,TRY1,Decoy,0,-9.82432,-6.15,-0.76,-5.6599062011300365
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c(C)c1,C39661872_decoy,TRY1,Decoy,0,-8.99374,-9.52,-1.82,-8.236641965616592
Nc1c(N2CCN(CCO)CC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40734320_decoy,TRY1,Decoy,0,-8.67897,-6.36,-1.91,-6.34034208970266
Cc1ccccc1C(=O)NNc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40760800_decoy,TRY1,Decoy,0,-7.75034,-6.17,-2.08,-5.324316448366383
CC1CC[NH+]([C@@H](CNC(=O)C(=O)Nc2ccccc2CC(N)=O)C(C)C)CC1,C41593547_decoy,TRY1,Decoy,0,-8.78301,-7.58,-1.78,-6.182601534082023
CC1CC[NH+]([C@H](CNC(=O)C(=O)Nc2ccccc2CC(N)=O)C(C)C)CC1,C41593549_decoy,TRY1,Decoy,0,-8.19924,-7.48,-2.25,-6.303680981721855
NS(=O)(=O)c1ccc(CCNC(=O)c2csc(C3CC[NH2+]CC3)n2)cc1,C43227067_decoy,TRY1,Decoy,0,-10.6105,-5.75,-1.84,-5.409423093006282
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C44136120_decoy,TRY1,Decoy,0,-7.62843,-4.8,-2.68,-5.195232476427257
NC(=O)C[C@H]([NH3+])c1ccc(Sc2ccc(C(F)(F)F)cn2)c([N+](=O)[O-])c1,C44253875_decoy,TRY1,Decoy,0,-8.28272,-6.25,-2.12,-7.260311016141977
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NC1CC[NH+](CC(N)=O)CC1,C46742852_decoy,TRY1,Decoy,0,-6.80548,-5.74,-1.77,-5.011688664553716
NC(=O)Cc1ccccc1NC(=O)NC1CC[NH+](Cc2ccccc2F)CC1,C47518342_decoy,TRY1,Decoy,0,-7.37066,-7.85,-2.06,-7.269359285622234
NC(=O)c1ccsc1NC(=O)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C47964407_decoy,TRY1,Decoy,0,-9.34568,-6.6,-1.77,-6.739577654683095
NC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C48768051_decoy,TRY1,Decoy,0,-8.76014,-7.05,-2.47,-6.978067763478967
CCC[C@@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51054699_decoy,TRY1,Decoy,0,-7.2921,-7.0,-4.75,-7.065224321423707
CNC(=[NH2+])c1cc(C)c2nc([C@H]3C(=O)N=CC=C3NC[C@H](O)c3cccc(Cl)c3)[nH]c2c1,C52634759_decoy,TRY1,Decoy,0,-10.8869,-8.44,-1.81,-8.492299077023867
N[C@@H]1C2=CC=C(c3cccnc3)N[C@@H]2S[C@@H]1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63529303_decoy,TRY1,Decoy,0,-7.57723,-8.48,-1.4,-6.303476292198531
N[C@@H]1C2=CC=C(c3cccnc3)N[C@@H]2S[C@H]1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63529304_decoy,TRY1,Decoy,0,-8.46134,-8.27,-1.04,-6.123061443056336
N[C@H]1C2=CC=C(c3cccnc3)N[C@@H]2S[C@@H]1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63529305_decoy,TRY1,Decoy,0,-9.04745,-8.67,-1.66,-6.306541628280424
O=C(C[C@@H]1NO[C@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63818054_decoy,TRY1,Decoy,0,-9.17956,-8.62,-1.92,-7.680210005679751
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)C[NH+]1CCC(C(=O)NCC(F)(F)F)CC1,C64029257_decoy,TRY1,Decoy,0,-9.34987,-7.3,-2.51,-6.272463689573654
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)NC1CC[NH+](CC(F)F)CC1,C64256113_decoy,TRY1,Decoy,0,-7.53759,-5.61,-1.22,-5.106441252938284
O=C(NCCCO)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O,C64380697_decoy,TRY1,Decoy,0,-8.3425,-6.61,-1.62,-6.321602407099035
CNC(=O)C1CCC([NH2+]Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC1,C67503712_decoy,TRY1,Decoy,0,-8.55938,-6.66,-2.38,-5.900370608456631
CN(C)c1ccc(C(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)c4cnccn4)c(=O)n2C3)cc1,C03841774_decoy,TRY1,Decoy,0,-7.89364,-7.03,-3.11,-6.163873029455393
CCOCCCn1c(=S)[nH]c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1=O,C02973345_decoy,TRY1,Decoy,0,-8.41296,-7.08,-3.34,-5.740887933334229
C[C@@H]1CN(C(=O)C(=O)NC[C@@H](c2cccs2)S(=O)(=O)c2ccc3c(c2)OCO3)C[C@H](C)O1,C09103154_decoy,TRY1,Decoy,0,-8.12397,-7.81,-1.96,-7.234571081531382
O=C(c1cc(NS(=O)(=O)c2ccc(F)cc2)ccn1)N1CCN(C(=O)c2ccco2)CC1,C09152249_decoy,TRY1,Decoy,0,-7.12784,-7.9,-4.57,-5.24208744039628
CC(C)S(=O)(=O)c1ccc(-c2nnc(NC(=O)Cc3ccc(S(C)(=O)=O)cc3)o2)cc1,C09814391_decoy,TRY1,Decoy,0,-8.29501,-6.37,-2.03,-6.1411568639414265
O=C(Cn1cnc2c(cnn2CCO)c1=O)N1N=C(c2cccs2)C[C@H]1c1ccc(F)cc1,C10188030_decoy,TRY1,Decoy,0,-9.54731,-6.75,-4.09,-7.413274340102561
O=C(Cn1cnc2c(cnn2CCO)c1=O)N1N=C(c2cccs2)C[C@@H]1c1ccc(F)cc1,C10188031_decoy,TRY1,Decoy,0,-9.48615,-8.71,-2.69,-8.314322023375695
C[C@@H](C(=O)Nc1nc2ccc(S(C)(=O)=O)cc2s1)N1C(=O)c2ccccc2S1(=O)=O,C10188070_decoy,TRY1,Decoy,0,-8.69392,-5.87,-3.58,-6.177353980311404
Cc1ccn(CCC(=O)N2CCc3c(cnc(C)c3CNC(=O)c3ccc4c(c3)OCO4)C2)n1,C11790969_decoy,TRY1,Decoy,0,-7.60493,-6.19,-3.43,-5.709626051758567
COc1ccc(N2C[C@H](C(=O)Nn3cnc4c(cnn4-c4ccc(C)cc4)c3=O)CC2=O)cc1,C12313277_decoy,TRY1,Decoy,0,-8.15324,-6.5,-1.07,-7.010450491408721
Cc1ccc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)c2ccc(-n4ccnc4)cc2)C3)s1,C12242540_decoy,TRY1,Decoy,0,-8.3031,-5.9,-2.01,-5.291373277659338
Cc1nc(NCC(=O)N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)c2c(C)c(C)sc2n1,C12762921_decoy,TRY1,Decoy,0,-8.75028,-7.18,-2.19,-5.5391309424785415
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)N[C@@H](C)c2ccc(-n3ccnc3)cc2)CC1,C09201709_decoy,TRY1,Decoy,0,-7.46966,-7.26,-2.11,-6.562498798725402
Cn1c(=O)c2c(ncn2CCCC(=O)Nc2cc3c(cc2Br)OCCO3)n(C)c1=O,C09672202_decoy,TRY1,Decoy,0,-8.41953,-6.98,-1.96,-6.559882516709613
O=C1CN(C(=O)c2nn(Cc3ccccc3)c3c2CN(C(=O)[C@@H]2CC(=O)c4ccccc42)CC3)CCN1,C14748884_decoy,TRY1,Decoy,0,-7.88952,-9.33,-2.66,-7.657707541515332
Cc1ncc2c(c1CNC(=O)c1ccco1)CCN(C(=O)c1cccc(Cn3cccn3)c1)C2,C14887303_decoy,TRY1,Decoy,0,-8.15797,-8.44,-1.95,-6.182872010549573
O=C1CCSc2ccc(C(=O)N3CCN(S(=O)(=O)c4ccc(F)cc4F)CC3)cc2N1,C15039572_decoy,TRY1,Decoy,0,-8.45809,-8.64,-2.7,-5.702719493458263
Cn1cc(S(=O)(=O)NCCSc2ncc(C(F)(F)F)cc2Cl)c(=O)n(C)c1=O,C15360698_decoy,TRY1,Decoy,0,-7.50956,-7.42,-4.6,-7.191759907055581
C[C@@]1(c2ccco2)NC(=O)N(CC(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)C1=O,C16401800_decoy,TRY1,Decoy,0,-6.82067,-8.05,-1.54,-6.658813765486567
CC[C@H](C)N1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC1=S,C20057980_decoy,TRY1,Decoy,0,-9.93223,-6.31,-2.64,-6.297135341685261
Cc1ccc(S(=O)(=O)Cc2noc([C@@H]3C[C@@H](O)CN3Cc3nc4ccccc4n3C)n2)cc1,C15674595_decoy,TRY1,Decoy,0,-8.83632,-8.42,-3.39,-8.545803915021915
O=C(C[C@H]1CSc2nc3c(cnn3-c3ccc(F)cc3)c(=O)n21)NCCN1CCOCC1,C14012376_decoy,TRY1,Decoy,0,-7.8226,-6.77,-0.84,-5.980304641293206
O=C(NCc1nnc2n1CCCCC2)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1,C22416375_decoy,TRY1,Decoy,0,-8.86214,-7.47,-4.63,-6.136460996219464
O=C(CSc1nnc(-c2c[nH]c3ccccc23)o1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1,C22742255_decoy,TRY1,Decoy,0,-10.1059,-8.06,-2.91,-6.799066716608453
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)OCC(=O)N[C@H]1CCOc2ccccc21,C23215155_decoy,TRY1,Decoy,0,-7.20583,-7.47,-1.9,-5.163049691852829
O=C(c1c[nH]c(=S)n1-c1ccc(F)cc1)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1,C24628216_decoy,TRY1,Decoy,0,-8.27285,-5.89,-3.56,-5.423234546108638
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1,C24655705_decoy,TRY1,Decoy,0,-5.82219,-8.48,-2.26,-5.303513772283244
O=C(Cn1c(=O)ncc2c1cnn2[C@@H]1CCS(=O)(=O)C1)Nc1ccccc1C(F)(F)F,C32616624_decoy,TRY1,Decoy,0,-7.15775,-8.54,-1.68,-6.02824154088169
CCS(=O)(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)CC1,C32744583_decoy,TRY1,Decoy,0,-9.38416,-6.38,-1.89,-5.853743278995837
C=CCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N([C@@H]2CCS(=O)(=O)C2)C1=O,C33724081_decoy,TRY1,Decoy,0,-8.13086,-7.81,-3.9,-5.558918947576287
N#C/C(=C/c1c(N2CCC3(CC2)OCCO3)nc2ccccn2c1=O)C(=O)NC[C@H]1CCCO1,C34990368_decoy,TRY1,Decoy,0,-7.28077,-5.81,-1.23,-5.33106241936406
CC[C@@H](C)N1C(=O)/C(=C\c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC1=S,C35074010_decoy,TRY1,Decoy,0,-8.79365,-5.98,-3.76,-6.063090373530862
O=C(NCC(=O)N1CCN(CC(=O)N2CCCCCC2)CC1)c1ccc(Br)o1,C12750767_decoy,TRY1,Decoy,0,-8.66561,-7.08,-1.87,-6.589391477502224
Cc1c(NC(=O)[C@H](C)N2CCN(C(=O)N3CCOCC3)CC2)c(=O)n(-c2ccccc2)n1C,C12801755_decoy,TRY1,Decoy,0,-8.40199,-6.08,-1.57,-5.6881576886665
O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1nn(-c2ccc(F)cc2)ccc1=O,C11915112_decoy,TRY1,Decoy,0,-8.31474,-6.73,-2.82,-6.761582710704914
CC(=O)c1ccc(N2CCN(S(=O)(=O)c3c(C)[nH]c(C)c3C(=O)N3CCCC3)CC2)cc1,C09684195_decoy,TRY1,Decoy,0,-8.0499,-6.77,-2.29,-5.177389007624734
COC1=C(C(=O)NCc2ccco2)[C@H]2CCN(C(=O)C3=C[C@H]4N=CC=C4C=C3)CCN2C(=O)C1,C39360359_decoy,TRY1,Decoy,0,-7.01255,-7.92,-1.24,-6.153850547993998
O=C1C[C@@H](Br)Nc2c1n(S(=O)(=O)Oc1ccccc1)c(=O)c1cc(F)cnc21,C39451456_decoy,TRY1,Decoy,0,-8.94851,-5.63,-5.38,-4.933774516223207
CC(=O)OC[C@]12[C@H](O)C(=O)[C@@H](C)[C@@]3(C[C@@H](c4ccoc4)O[C@H]3OC(C)=O)[C@@H]1CCC[C@]21CO1,C43510437_decoy,TRY1,Decoy,0,-6.21994,-5.0,-2.86,-4.548129550938022
COc1ccc([C@@H]2C[C@H](C(=O)N3CCC4(CC3)OCCO4)N(C)S(=O)(=O)N2)cc1OC,C57730391_decoy,TRY1,Decoy,0,-8.40983,-7.7,-1.79,-5.753729903057226
[H]/N=C1C(=C\c2cc(C)n(-c3ccc(C)cc3C)c2C)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20208072_decoy,TRY1,Decoy,0,-7.79189,-7.92,-1.2,-5.0616331526955705
Cc1nc(-c2ccc(NC(=O)N3CCN(S(=O)(=O)c4c(C)noc4C)CC3)cc2)cs1,C58879717_decoy,TRY1,Decoy,0,-8.80704,-7.3,-2.09,-5.731822720393703
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)S(=O)(=O)c1cc(Br)ccc1F,C60321113_decoy,TRY1,Decoy,0,-8.34669,-6.89,-2.05,-5.84262478669256
[H]/N=C1C(=C\c2ccc(OCCOc3ccccc3)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C15935199_decoy,TRY1,Decoy,0,-7.16723,-7.73,-3.6,-5.0899683870504
C[C@@H](C(=O)NC1CC1)N1CCN(CC2=NC(=O)C3=C(c4ccc(F)cc4)CSC3=N2)CC1,C39779964_decoy,TRY1,Decoy,0,-8.3005,-5.58,-1.77,-4.995395403199246
[H]/N=C1C(=C\c2ccc(OCc3cc(=O)n4nc(C)sc4n3)cc2)/C(=O)N=C2SC(C)=NN2/1,C20332012_decoy,TRY1,Decoy,0,-8.42823,-7.46,-3.52,-5.667165420297942
Cc1cc2c(cc1S(=O)(=O)N1CCN(C(=O)c3ccc4c(c3)OCO4)CC1)OCC(=O)N2,C64889591_decoy,TRY1,Decoy,0,-8.05179,-6.91,-1.49,-5.784499190633812
C[C@@H]1Oc2cc(S(=O)(=O)N3CCN(C(=O)c4ccsc4)CC3)c(Cl)cc2NC1=O,C64889784_decoy,TRY1,Decoy,0,-8.79713,-6.69,-1.99,-5.9140452596303055
C[C@H]1Oc2ccc(S(=O)(=O)N3CCN(C(=O)c4ccc(N(C)C)cc4)CC3)cc2NC1=O,C64889980_decoy,TRY1,Decoy,0,-8.71738,-7.11,-0.76,-5.490126922429407
O=C(c1cncc(Br)c1)N1CCN(S(=O)(=O)c2ccc3[nH]c(=O)sc3c2)CC1,C65032508_decoy,TRY1,Decoy,0,-8.85194,-6.92,-1.51,-7.339244931851524
OCC(CO)(CO)[NH2+]C[C@@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C03628223_decoy,TRY1,Decoy,0,-7.91967,-6.85,-1.2,-5.589387968204467
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2c(C)cc(C)cc21,C02138804_decoy,TRY1,Decoy,0,-8.78408,-5.39,-2.51,-5.329628861949368
CCCC[NH2+][C@H](C)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O)C1)C(=O)c1c(OC)cccc1C3=O,C05373345_decoy,TRY1,Decoy,0,-9.7941,-5.28,-2.74,-6.463716870877506
C/C(=N\NC(N)=O)[C@H](C[NH+]1CCCCC1)[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O,C05824378_decoy,TRY1,Decoy,0,-6.97721,-6.2,-1.58,-5.086732467994062
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)[nH]c(=O)n([C@H](C)c2ccccc2)c1=O,C08791670_decoy,TRY1,Decoy,0,-7.35614,-6.48,-2.47,-5.014519841092
C=CCOc1c(Br)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1OC,C09194444_decoy,TRY1,Decoy,0,-7.02606,-6.15,-2.1,-5.001358445798718
CC(=O)Oc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3Cc3ccc(O)c(O)c3)C(=O)Nc3ccccc32)cc1,C12881065_decoy,TRY1,Decoy,0,-7.99824,-9.56,-1.76,-8.425861774782296
NC(=O)C1CC[NH+](CCOc2ccc(-c3n[nH]cc3-c3ccc(Br)cc3)c(O)c2)CC1,C09410859_decoy,TRY1,Decoy,0,-8.99706,-5.95,-3.7,-5.879064111479204
Cc1cc(C)nc(N/C(=N\C(=O)Nc2ccc(Cl)c(Cl)c2)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1,C14158052_decoy,TRY1,Decoy,0,-11.2541,-9.37,-2.84,-8.510028217634433
O=C(NCC1(O)CCCCC1)c1ccc(C[NH+]2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)[nH]c1=O,C14997365_decoy,TRY1,Decoy,0,-10.6736,-7.94,-3.36,-7.143878371011244
COc1ccc(-n2c(O)nc(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccc(OC)cc43)c2=O)cc1,C09331326_decoy,TRY1,Decoy,0,-7.82807,-6.21,-2.25,-5.469383822774266
CCOC(=O)C1=C(C[NH2+]C2CC(C)(C)NC(C)(C)C2)NC(=O)N[C@H]1c1ccc2c(c1)OCO2,C12412579_decoy,TRY1,Decoy,0,-8.92369,-7.11,-2.3,-7.561788967320854
CCOc1cccc2cc(C(N)=O)/c(=[NH+]/c3sc4c(c3C(N)=O)CCCC4)oc12,C01506520_decoy,TRY1,Decoy,0,-7.90553,-7.3,-3.33,-5.890913021033639
COc1ccc(C#CC(C)(C)[NH3+])cc1-c1[nH]nc2nc(Nc3ccc(F)cc3F)ccc12,C28564979_decoy,TRY1,Decoy,0,-8.6339,-8.01,-1.83,-6.441439035752467
CCCCCCc1cc2cc(C(N)=O)/c(=[NH+]/c3sc4c(c3C(N)=O)CCCC4)oc2cc1O,C04177575_decoy,TRY1,Decoy,0,-11.1589,-6.87,-1.96,-7.201315773164976
COc1ccccc1NC(=O)Nc1c(C(C)(C)C)[nH+]n(-c2ccc(C)cc2C)c1N,C35542186_decoy,TRY1,Decoy,0,-8.51655,-7.56,-2.38,-6.480641033978642
[NH2+]=C(Nc1nc(=O)cc(CSc2ccc(Cl)cc2)[nH]1)Nc1cccc2ccccc12,C18249700_decoy,TRY1,Decoy,0,-8.51727,-8.21,-1.8,-7.443309257932317
CC1=NN[C@H](SCc2cc(=O)nc(NC(=[NH2+])Nc3cccc(Cl)c3)[nH]2)S1,C38964316_decoy,TRY1,Decoy,0,-8.52824,-7.58,-3.08,-7.029767654772858
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@@H]1NN[C@H](SCc2c(F)cccc2Cl)O1,C38966456_decoy,TRY1,Decoy,0,-9.8392,-6.17,-1.99,-5.307484097064793
Cc1ccc(N2NC(CSc3nc4ccccc4[nH]3)=C(c3ccccc3)[C@H]2[NH3+])cc1,C39143296_decoy,TRY1,Decoy,0,-8.1688,-8.66,-3.01,-7.899194694528116
Cc1ccc(N2NC(CSc3nc4ccccc4[nH]3)=C(c3ccccc3)[C@@H]2[NH3+])cc1,C39143297_decoy,TRY1,Decoy,0,-8.6506,-8.84,-1.38,-7.286804773935091
[NH3+][C@@H]1[C@@H](c2ccccc2)[C@H](CSc2nc3ccccc3[nH]2)NN1c1ccc(F)cc1F,C39143301_decoy,TRY1,Decoy,0,-8.67099,-8.51,-2.4,-7.410899447556798
[NH3+][C@@H]1[C@@H](c2ccccc2)[C@@H](CSc2nc3ccccc3[nH]2)NN1c1ccc(F)cc1F,C39143303_decoy,TRY1,Decoy,0,-9.9088,-9.02,-1.4,-8.493236643155845
Oc1ccccc1-c1ccc([C@H](CNI)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533974_decoy,TRY1,Decoy,0,-9.66579,-5.71,-2.02,-5.602164795929497
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661882_decoy,TRY1,Decoy,0,-10.481,-8.9,-2.13,-9.589499196635709
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39674103_decoy,TRY1,Decoy,0,-9.09419,-9.21,-3.2,-7.611048999159743
CC1(C)C[C@H]([NH2+]Cc2ccc(CO)o2)[C@@]2(CCC(=O)NC3CC3)CC[C@](C)(O)C[C@@H]12,C12531679_decoy,TRY1,Decoy,0,-8.43744,-5.48,-2.29,-5.340001721162752
Cc1cc([C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NCC[NH+]2CCCCC2)c1N,C40688684_decoy,TRY1,Decoy,0,-8.92521,-8.67,-3.34,-7.574436150337657
Cc1ccc2c(Nc3ncnc(Nc4cc(Cl)cc(Cl)c4)c3N)cccc2[nH+]1,C40701189_decoy,TRY1,Decoy,0,-8.54509,-7.27,-2.51,-7.579026529836781
CC1(C)CC(Nc2ncnc(Nc3ccccc3C(F)(F)F)c2N)CC(C)(C)[NH2+]1,C40701772_decoy,TRY1,Decoy,0,-6.41334,-6.8,-1.44,-4.670731994913199
CCCOc1c(Br)cc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C40744431_decoy,TRY1,Decoy,0,-9.6501,-7.12,-3.45,-8.097142760285053
Nc1nonc1C(=O)NCC[NH2+]Cc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl,C40744544_decoy,TRY1,Decoy,0,-8.01917,-7.52,-4.53,-7.544675298498205
CCCCOc1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40754995_decoy,TRY1,Decoy,0,-8.44394,-6.05,-3.72,-5.407874049736487
Cc1ccc2nc(Nc3ncnc(NC4CC(C)(C)[NH2+]C(C)(C)C4)c3N)sc2c1,C40760782_decoy,TRY1,Decoy,0,-8.70856,-5.83,-1.58,-4.9151120688569785
CC1(C)CC(Nc2ncnc(N(Cc3ccccc3)c3ccccn3)c2N)CC(C)(C)[NH2+]1,C40760884_decoy,TRY1,Decoy,0,-9.28636,-7.4,-1.73,-7.675197470302559
CCOc1ccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)cc1,C40777780_decoy,TRY1,Decoy,0,-7.93262,-5.48,-1.4,-6.432564472074434
Cc1ccc2c(Nc3ncnc(Nc4cc(Cl)ccc4Cl)c3N)cccc2[nH+]1,C40778483_decoy,TRY1,Decoy,0,-9.02294,-7.77,-2.65,-6.754562387510478
Cc1ccc2c(Nc3ncnc(Nc4ccc(Cl)cc4Cl)c3N)cccc2[nH+]1,C40783357_decoy,TRY1,Decoy,0,-9.57769,-8.21,-1.95,-6.49442117107694
COc1cc(C(=O)Oc2c(Cl)cc(Cl)cc2[C@H]([NH3+])CC(N)=O)cc(OC)c1OC,C44253617_decoy,TRY1,Decoy,0,-8.66743,-6.25,-3.45,-8.255416659818934
COc1cc2ncc3c(N)nc(-c4cncc(OC[C@@H]([NH3+])Cc5ccc(F)cc5)c4)cc3c2cc1OC,C49089587_decoy,TRY1,Decoy,0,-10.7804,-8.08,-2.55,-7.113097570523203
CC(C)S(=O)(=O)N1c2cc(-c3[nH]c(-c4ccncc4)nc3-c3ccccc3)ccc2N[C@H]1[NH3+],C52637644_decoy,TRY1,Decoy,0,-7.40153,-7.51,-1.45,-6.45023204560079
NC(=O)COc1ccc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc1,C15504240_decoy,TRY1,Decoy,0,-8.23069,-6.98,-0.95,-5.29592477174675
C=CCNC(=S)NNC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1cccs1,C64220473_decoy,TRY1,Decoy,0,-10.4916,-6.66,-2.96,-8.32255037818477
CC1(C)CC(/N=C(\O)c2ccccc2NS(=O)(=O)c2ccc(Cl)s2)CC(C)(C)[NH2+]1,C06146062_decoy,TRY1,Decoy,0,-8.64007,-5.8,-1.02,-6.089801039569872
CCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2c(Cl)cccc21,C08791540_decoy,TRY1,Decoy,0,-8.20512,-7.89,-2.15,-7.96676532126051
NC(=O)c1c(NC(=O)C2CCN(c3[nH+]cc(C(F)(F)F)cc3Cl)CC2)sc2c1CCCC2,C09254292_decoy,TRY1,Decoy,0,-10.172,-7.45,-2.69,-5.999261444919981
C[C@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C09595753_decoy,TRY1,Decoy,0,-9.63869,-6.66,-2.36,-6.914042354755076
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H](Cc3ccc(O)cc3)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C12881507_decoy,TRY1,Decoy,0,-9.04546,-7.85,-1.49,-9.368012085535566
COc1cc2c(cc1OC)[C@H](c1c(O)nc(O)n(-c3cccc(C(F)(F)F)c3)c1=O)[NH2+]CC2,C09330779_decoy,TRY1,Decoy,0,-8.49239,-6.47,-4.25,-5.5343013319335
C[NH+]1CCN(S(=O)(=O)c2ccc(Nc3cc(Cl)c(N)c(Cl)c3)c([N+](=O)[O-])c2)CC1,C20666775_decoy,TRY1,Decoy,0,-7.58425,-7.25,-1.07,-6.225056430854385
O=S(=O)(NNC1=[NH+][C@@H](c2ccccc2)c2ccccc2N1)c1ccc(Br)cc1,C16478524_decoy,TRY1,Decoy,0,-9.10425,-10.17,-1.06,-9.507445802168853
O=S(=O)(NNC1=[NH+][C@H](c2ccccc2)c2ccccc2N1)c1ccc(Br)cc1,C16478521_decoy,TRY1,Decoy,0,-8.64952,-10.17,-2.86,-8.260722708277335
CC(C)(C(=O)NC1C[C@@H]2CC(C(N)=O)C[C@H](C1)C2)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C36286381_decoy,TRY1,Decoy,0,-9.06791,-8.23,-3.44,-6.376341293420172
C[NH+](C)CCCNC(=O)[C@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccc(Cl)cc1,C03619922_decoy,TRY1,Decoy,0,-8.39421,-4.88,-3.34,-5.253331368683653
C=C(NNC1=c2ccc(Cl)cc2=[NH+]C1=O)c1c(O)c2ccccc2n(-c2ccccc2)c1=O,C13401932_decoy,TRY1,Decoy,0,-7.96867,-9.33,-1.9,-6.225860611708061
O=C(NCCOc1ccccc1)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39227959_decoy,TRY1,Decoy,0,-8.83033,-6.9,-3.07,-6.238938344451023
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39597728_decoy,TRY1,Decoy,0,-9.74535,-8.81,-2.06,-8.12052836385873
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)C4(C)CCCCC4)CC34CC[NH2+]CC4)c2c1,C39655959_decoy,TRY1,Decoy,0,-8.64826,-7.26,-3.41,-6.967583512292007
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)C4(C)CCCCC4)CC34CC[NH2+]CC4)c2c1,C39655962_decoy,TRY1,Decoy,0,-9.94772,-6.56,-2.42,-7.0174052447186375
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39656147_decoy,TRY1,Decoy,0,-8.36304,-7.63,-0.91,-7.537237231260458
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39674009_decoy,TRY1,Decoy,0,-9.75937,-6.91,-1.89,-6.152893917642907
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39674085_decoy,TRY1,Decoy,0,-8.26347,-6.98,-1.42,-6.094187039399022
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39674124_decoy,TRY1,Decoy,0,-8.90903,-8.2,-1.7,-7.327778341066427
O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39676496_decoy,TRY1,Decoy,0,-10.0515,-7.47,-1.22,-7.449751818877111
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39676500_decoy,TRY1,Decoy,0,-10.7095,-8.48,-1.67,-8.300889990157025
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676523_decoy,TRY1,Decoy,0,-8.58961,-6.27,-2.26,-6.31647509721111
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4cccc(Br)c4)CC34CC[NH2+]CC4)c[nH]c12,C39684088_decoy,TRY1,Decoy,0,-10.1577,-6.78,-2.54,-7.581453029073949
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4cccc(Cl)c4Cl)CC34CC[NH2+]CC4)c[nH]c12,C39684142_decoy,TRY1,Decoy,0,-9.74802,-7.38,-1.82,-6.803307051683291
Cc1ccc2nc(Nc3ncnc(N4CC[NH+](Cc5ccc6c(c5)OCO6)CC4)c3N)sc2c1,C40783609_decoy,TRY1,Decoy,0,-8.68099,-6.15,-3.22,-4.952676586922265
Nc1c(N2CCN(c3ccccc3F)CC2)nc[nH+]c1Nc1ncc(C(F)(F)F)cc1Cl,C40799619_decoy,TRY1,Decoy,0,-9.08153,-6.07,-3.51,-5.105856755363577
Cc1ccc2c(CC(=O)N/N=C3\CCCc4oc(C(=O)NC5CC(C)(C)[NH2+]C(C)(C)C5)c(C)c43)coc2c1C,C40826775_decoy,TRY1,Decoy,0,-9.45553,-7.95,-2.84,-6.914143086641637
Cc1cc(C)c2c(CC(=O)N/N=C3\CCCc4oc(C(=O)NC5CC(C)(C)[NH2+]C(C)(C)C5)c(C)c43)coc2c1,C40827021_decoy,TRY1,Decoy,0,-9.32719,-8.4,-1.97,-7.245466045702411
CC[C@H](C)[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)co1,C43213495_decoy,TRY1,Decoy,0,-10.2768,-8.74,-3.61,-7.870546596072744
O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc(C[NH+]2CC[C@](O)(c3ccccc3)[C@H]3CCCC[C@@H]32)[nH]c1=O,C43632876_decoy,TRY1,Decoy,0,-8.53249,-7.93,-3.82,-7.466057127807812
CC(C)(C)c1cc([C@H]2C[S@@+]([O-])C[C@@H](C(=O)NCCc3ccccc3F)[NH2+]2)cc(C(C)(C)C)c1O,C44170674_decoy,TRY1,Decoy,0,-8.48484,-5.93,-1.92,-6.020880792555425
CC(C)(C)c1cc([C@H]2C[S@+]([O-])C[C@@H](C(=O)NCCc3ccccc3F)[NH2+]2)cc(C(C)(C)C)c1O,C44170682_decoy,TRY1,Decoy,0,-8.99899,-6.62,-1.49,-7.168428309192663
CNC(=O)NC(=O)[C@H](C)S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1,C44658333_decoy,TRY1,Decoy,0,-7.57724,-7.11,-1.57,-6.017868030477757
CNC(=O)NC(=O)[C@H](C)S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1,C44658341_decoy,TRY1,Decoy,0,-8.58385,-8.02,-0.84,-8.202844461074708
CC1=C[C@@H](c2ncc(OC[C@@H]([NH3+])Cc3ccccc3)cc2-c2ccc3[nH]nc(C)c3c2)SC1,C52565419_decoy,TRY1,Decoy,0,-10.5233,-9.64,-1.33,-11.7272734829085
CC1=C[C@H](c2ncc(OC[C@@H]([NH3+])Cc3ccccc3)cc2-c2ccc3[nH]nc(C)c3c2)SC1,C52565421_decoy,TRY1,Decoy,0,-10.2756,-8.59,-1.37,-11.303534343928376
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccccc4C(F)(F)F)CC34CC[NH2+]CC4)[nH]c2c1,C44737087_decoy,TRY1,Decoy,0,-9.7073,-8.95,-1.55,-8.389451921726145
Cc1ccc2c(Nc3ncnc(N4CC[NH+](Cc5ccc6c(c5)OCO6)CC4)c3N)cccc2n1,C40799489_decoy,TRY1,Decoy,0,-9.61248,-9.92,-2.56,-7.001082440608756
COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1C[NH+]1CCN(c2ccc(F)cc2)CC1,C32511889_decoy,TRY1,Decoy,0,-6.66045,-9.0,-2.5,-5.691240978266329
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3c(Cl)cc(Cl)cc3Cl)sc2[nH+]1,C10644876_decoy,TRY1,Decoy,0,-9.35608,-7.46,-1.41,-6.997836705958501
CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)CC1,C58157833_decoy,TRY1,Decoy,0,-8.71085,-6.61,-2.73,-6.134106571171244
COc1cccc2cc(C(=O)Nc3ccc(F)cc3)/c(=[NH+]\c3sc4c(c3C(N)=O)CCCC4)oc12,C17130865_decoy1,TRY1,Decoy,0,-8.2449,-8.23,,-6.956136714590127
Cc1ccc(NC(=O)c2cc3ccc(O)cc3o/c2=[NH+]\NS(=O)(=O)c2ccc(C)cc2)cc1,C59170420_decoy,TRY1,Decoy,0,-10.1895,-9.43,-3.1,-8.475372433565058
Cc1ccc(S(=O)(=O)N/[NH+]=c2/oc3cc(O)ccc3cc2C(=O)Nc2cccc(C)c2)cc1,C59170444_decoy,TRY1,Decoy,0,-9.11128,-9.7,-3.18,-7.576500555793262
Cc1ccc(S(=O)(=O)N/[NH+]=c2\oc3cc(O)ccc3cc2C(=O)Nc2ccccc2C)cc1,C59170468_decoy,TRY1,Decoy,0,-9.14844,-9.32,-2.24,-8.215221036779246
C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258745_decoy,TRY1,Decoy,0,-8.91366,-6.01,-1.54,-5.54679775331687
[NH2+]=C1Nc2nc3cc4c(cc3n2[C@H](c2ccc(OC(F)F)cc2OC(F)F)N1)OCCCO4,C12507755_decoy,TRY1,Decoy,0,-7.36598,-6.52,-1.22,-5.725524705839972
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@H]1C[C@@H]2N[C@H](c3ccc(Cl)cc3)C[C@H](C(F)(F)F)N2N1,C63537910_decoy,TRY1,Decoy,0,-9.71894,-6.42,-1.26,-6.165520313814281
Cc1ccc(S(=O)(=O)N[C@@H]2Nc3c(C)cc(NC(=O)[C@@H]4C=c5ccccc5=[NH+]4)cc3S2)cc1,C64623284_decoy,TRY1,Decoy,0,-8.65707,-8.22,-1.84,-6.482574118512043
CCCCCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)N1CCC(C(N)=O)CC1,C04237037_decoy,TRY1,Decoy,0,-10.9831,-7.85,-1.62,-8.167236771810085
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@]1(O)CSC(C)=N1)C[C@H]3O,C05437612_decoy,TRY1,Decoy,0,-8.35188,-8.73,-1.4,-5.527021566072026
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)([C@@]1(O)CSC(C)=N1)C[C@H]3O,C05437616_decoy,TRY1,Decoy,0,-8.70717,-8.21,-1.21,-5.394481452609119
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@H]1CCCO1)c1ccc(F)cc1,C06860678_decoy,TRY1,Decoy,0,-8.57952,-5.75,-1.57,-6.07422965775998
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3cc(Cl)ccc23)O[C@@](C)(CO)[C@@](C)(O)[C@@]1(C)O,C09970245_decoy,TRY1,Decoy,0,-7.22894,-6.44,-2.23,-5.270276070999143
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@]1(C)O,C09970382_decoy,TRY1,Decoy,0,-7.52828,-6.46,-2.12,-4.671138586783776
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(C)o2)c(C)c1,C12480027_decoy,TRY1,Decoy,0,-8.14664,-6.15,-3.31,-6.347007636809359
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCCC2)c2ccc(C)o2)cc1,C12714731_decoy,TRY1,Decoy,0,-8.63271,-8.72,-1.54,-11.319223539167377
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCCC2)c2ccc(C)o2)c1,C12714785_decoy,TRY1,Decoy,0,-9.15786,-5.54,-3.94,-5.806590001518804
Cc1coc2c(C)c3oc(=O)c(CCC(=O)N(C)C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(C)c3cc12,C12892797_decoy,TRY1,Decoy,0,-9.34059,-6.22,-2.09,-5.726311301527827
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c(CC=C(C)C)c3o2)cc1,C14984435_decoy,TRY1,Decoy,0,-7.91902,-6.26,-1.55,-5.675264067025477
O=C([O-])[C@H]1O[C@@H](Oc2cnc3c(c2)CCc2cc(Cl)ccc2C3=C2CC[NH2+]CC2)[C@H](O)[C@@H](O)[C@@H]1O,C21981244_decoy,TRY1,Decoy,0,-7.98883,-7.94,-2.9,-4.500820006540308
O=C([O-])[C@@H]1O[C@H](Oc2cnc3c(c2)CCc2cc(Cl)ccc2C3=C2CC[NH2+]CC2)[C@H](O)[C@@H](O)[C@H]1O,C22060580_decoy,TRY1,Decoy,0,-8.6459,-6.61,-3.05,-5.222820783366734
C[C@H](OC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)Nc1sccc1C(N)=O,C24080858_decoy,TRY1,Decoy,0,-8.41832,-7.44,-2.94,-7.601756273786779
N#Cc1c(N2CCC[C@@H](O)C2)nc(N)c2c(N)nc3c(c12)CC(=O)N3c1ccc2c(c1)OCO2,C25435867_decoy,TRY1,Decoy,0,-8.06225,-7.13,-2.07,-5.646597441535282
N#Cc1c(N2CCC[C@H](O)C2)nc(N)c2c(N)nc3c(c12)CC(=O)N3c1ccc2c(c1)OCO2,C25435870_decoy,TRY1,Decoy,0,-7.16803,-7.28,-0.85,-4.441772671515776
N#Cc1c(N2CCC[C@@H](CO)C2)nc(N)c2c(N)nc3c(c12)CC(=O)N3c1cccc(F)c1,C25463543_decoy,TRY1,Decoy,0,-7.55134,-7.0,-1.73,-5.615259888073421
N#Cc1c(N2CCC[C@H](CO)C2)nc(N)c2c(N)nc3c(c12)CC(=O)N3c1cccc(F)c1,C25463550_decoy,TRY1,Decoy,0,-7.16547,-5.68,-2.16,-4.920098061415239
N#CC1=C(N)NC(SCC(=O)c2ccc(Br)cc2)=C(C(N)=O)C12CCCC2,C14671745_decoy,TRY1,Decoy,0,-9.43756,-5.22,-0.87,-5.45396034861735
CC[C@@H](C)[C@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CSSC[C@@H](NC(=O)[C@H]([C@@H](C)CC)NC1=O)C(=O)N2,C31158277_decoy,TRY1,Decoy,0,-7.64318,-6.05,-2.13,-5.981969710963128
Nc1c(C(=O)NNC(=O)c2c[nH]c3c(Cl)cccc3c2=O)cnc2ccc(Cl)cc12,C32605634_decoy,TRY1,Decoy,0,-9.55734,-6.15,-1.76,-5.90920959870186
O=C(Nc1nc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2,C35088765_decoy,TRY1,Decoy,0,-7.29396,-6.82,-1.95,-5.169608855886674
CC1=C(C)[C@H]2[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]23C(=O)C[C@H](O)[C@H](O)C[C@@H](C)C/C=C/[C@@H]3[C@@H]1O,C35270736_decoy,TRY1,Decoy,0,-8.70187,-7.97,-2.01,-5.6026895497492495
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)cc12,C35270813_decoy,TRY1,Decoy,0,-9.43627,-6.41,-1.91,-6.10677426073964
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccc(C)o2)c1,C12714543_decoy,TRY1,Decoy,0,-9.40436,-5.34,-1.55,-6.14144277648005
Cc1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)o1,C12715057_decoy,TRY1,Decoy,0,-8.41171,-6.82,-1.26,-8.954950770507358
COc1cc([C@H]2[C@H]3CO[C@@]4(O)C(=O)[C@@H]2C=C([C@H]2Oc5cc(O)cc(O)c5C(=O)[C@@H]2O)[C@@H]34)ccc1O,C31159723_decoy,TRY1,Decoy,0,-8.22026,-6.55,-2.13,-6.9537411896799926
Cc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4cc(Cl)ccc4C)N3N)N=N2)cc1,C39006591_decoy,TRY1,Decoy,0,-10.3671,-8.4,-1.56,-9.606933247982084
Cc1cc(C)c(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)c(C)c1,C39007665_decoy,TRY1,Decoy,0,-8.60844,-7.01,-2.28,-6.241710227900376
NN1[C@@H](SCC(=O)Nc2ccc(F)c(F)c2)NN[C@@H]1[C@H]1C=C(c2ccc(Cl)cc2)N=N1,C39016366_decoy,TRY1,Decoy,0,-9.09602,-6.53,-0.78,-7.0031412190542985
CC(C)C[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@@H]1c1ccco1,C39689959_decoy,TRY1,Decoy,0,-6.86198,-7.92,-1.67,-7.030783483412215
Cc1c(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)oc2c1/C(=N/NC(N)=S)CC(C)(C)C2,C39856215_decoy,TRY1,Decoy,0,-11.6794,-7.23,-1.44,-9.327435320932937
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C43505183_decoy,TRY1,Decoy,0,-10.7905,-6.59,-1.48,-6.3703552966687225
Nc1cc(N)nc(SCc2nc3scc(-c4ccc(Br)cc4)c3c(=O)[nH]2)n1,C31819181_decoy,TRY1,Decoy,0,-9.43266,-8.08,-1.74,-7.603270675204672
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)CC[C@@]4(C)[C@H]3CC[C@@]12C,C43746717_decoy,TRY1,Decoy,0,-9.27659,-6.36,-1.47,-6.273203683889294
CC1=C(C)[C@H]2[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]23C(=O)C[C@H](O)[C@H](O)C[C@H](C)C/C=C\[C@@H]3[C@@H]1O,C43769372_decoy,TRY1,Decoy,0,-8.52631,-7.42,-2.63,-4.7179336731315145
Cc1c2c(c(O)c3c(O)cccc13)C(=O)[C@@]1(O)C([O-])=C(C(=O)NC(C)(C)C)C(=O)[C@@H]([NH+](C)C)[C@@H]1C2,C44123343_decoy,TRY1,Decoy,0,-8.66686,-8.46,-1.58,-6.328839321331621
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@@H](CO)[C@H](O)[C@@H]1O,C44167855_decoy,TRY1,Decoy,0,-8.11562,-6.57,-2.42,-5.537648904523516
CC(=O)N[C@@H]1[C@@H](Oc2cc3c(Cl)c(Br)ccc3[nH]2)O[C@H](CO)[C@H](O)[C@@H]1O,C45201885_decoy,TRY1,Decoy,0,-7.11988,-5.84,-1.82,-4.921200699944053
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@H]2C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C48574016_decoy,TRY1,Decoy,0,-9.92541,-6.99,-1.22,-6.750731003848325
N#CC1=C(N)Nc2sc(C(=O)c3ccc(Br)cc3)c(N)c2C12CCCCC2,C49581157_decoy,TRY1,Decoy,0,-8.93387,-7.63,-2.52,-5.241320370422792
N#CC1=C(N)Nc2nc(SCc3ccc(F)cc3)[nH]c(=O)c2[C@]12C(=O)Nc1ccccc12,C12377349_decoy,TRY1,Decoy,0,-7.89732,-6.46,-3.1,-4.869544827160767
N#CC1=C(N)Nc2nc(SCc3ccc(F)cc3)[nH]c(=O)c2[C@@]12C(=O)Nc1ccccc12,C12377350_decoy,TRY1,Decoy,0,-8.08417,-9.01,-1.8,-7.574876273710897
N#CC1=C(N)Nc2nc(SCc3cccc(F)c3)[nH]c(=O)c2[C@@]12C(=O)Nc1ccccc12,C12377352_decoy,TRY1,Decoy,0,-8.28242,-7.35,-1.8,-5.317684296046245
Cc1nc(N)sc1C(=O)N/N=C/c1cc(Br)c(O)c(Br)c1O,C00954365_decoy,TRY1,Decoy,0,-10.0837,-7.97,-0.85,-8.092446245575593
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(Cl)cc2Cl)NC(=S)N1,C59384938_decoy,TRY1,Decoy,0,-8.37718,-6.15,-1.86,-4.892471196406984
C[NH+]1CCc2cccc3c2[C@H]1Cc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c(O)c1-3,C65734391_decoy,TRY1,Decoy,0,-6.27956,-6.63,-1.21,-3.976339909476202
C[NH+]1CCc2cccc3c2[C@H]1Cc1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c(O)c1-3,C65734393_decoy,TRY1,Decoy,0,-5.63313,-6.08,-3.67,-4.557390763669847
O=C([O-])[C@@H]1O[C@H](Oc2cnc3c(c2)CCc2cc(Cl)ccc2C3=C2CC[NH2+]CC2)[C@H](O)[C@H](O)[C@@H]1O,C65742868_decoy,TRY1,Decoy,0,-8.14064,-8.3,-4.91,-5.696395536430265
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@]3(C(=O)Nc4c(C)cc(C)cc43)[C@@H]2C1=O,C02138807_decoy,TRY1,Decoy,0,-8.85402,-6.87,-1.28,-7.115760481883531
C[NH+](C)CCNC(=O)C[C@@H]1c2nc(NC(=O)c3cccs3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222498_decoy,TRY1,Decoy,0,-11.5809,-5.76,-4.46,-6.847726699514532
Oc1ccccc1OCC[NH2+]C[C@@H](O)COc1cccc2[nH]c3ccccc3c12,C02509755_decoy,TRY1,Decoy,0,-6.47997,-6.27,-1.5,-4.825327532517026
CC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)CC(=O)NC(C)(C)C,C07685068_decoy,TRY1,Decoy,0,-9.55221,-5.32,-2.52,-6.003010321098527
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790876_decoy,TRY1,Decoy,0,-9.2217,-6.16,-2.04,-5.710474663916132
NC(=O)N[C@@H](CC(=O)NCc1ccccc1C[NH+]1CCCCC1)c1ccccc1Cl,C14197470_decoy,TRY1,Decoy,0,-8.12075,-6.34,-2.91,-5.819162761322402
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccc(F)cc3F)C[NH+]12,C15708446_decoy,TRY1,Decoy,0,-9.15852,-4.71,-1.81,-5.160602758221143
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccccc3)C[NH+]12,C15708470_decoy,TRY1,Decoy,0,-7.5048,-4.33,-2.28,-4.67516991867834
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C22061866_decoy,TRY1,Decoy,0,-6.86683,-5.53,-3.15,-5.254346297084269
O=C(NCC[NH2+]CCO)/C(=C/c1ccc(Cl)cc1Cl)NC(=O)c1ccco1,C26580555_decoy,TRY1,Decoy,0,-10.2947,-7.05,-3.43,-8.789885507731507
O=C(C[NH2+][C@@H]1Nc2ccccc2S1)NNC(=O)C1=C(c2ccccc2)N=NC1,C38799048_decoy,TRY1,Decoy,0,-8.20183,-5.94,-1.4,-7.405115877880924
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@H]1NN[C@H](SCc2c(F)cccc2Cl)O1,C38966457_decoy,TRY1,Decoy,0,-8.5947,-6.39,-2.38,-5.5517373452706575
CC[C@@H](C)CC(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661884_decoy,TRY1,Decoy,0,-9.6521,-8.6,-1.27,-10.039471915117147
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39684239_decoy,TRY1,Decoy,0,-9.00522,-9.28,-1.6,-7.799881911777422
CC(C)c1ccc([C@H]([NH2+][C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)C(C)C)cc1,C12903242_decoy,TRY1,Decoy,0,-8.09114,-7.29,-2.3,-7.745756198393772
CC(C)c1ccc([C@@H]([NH2+][C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)C(C)C)cc1,C12903246_decoy,TRY1,Decoy,0,-8.11224,-7.42,-2.21,-6.689764358175591
CC(C)c1ccc([C@H]([NH2+][C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)C(C)C)cc1,C12903249_decoy,TRY1,Decoy,0,-7.79015,-8.04,-2.35,-8.588941148965423
CC1(C)CC(Nc2ncnc(Sc3ccc(Cl)cc3)c2N)CC(C)(C)[NH2+]1,C40723014_decoy,TRY1,Decoy,0,-9.21518,-5.81,-1.74,-6.02105304976939
Nc1nonc1C(=O)NCC[NH2+]Cc1cn(Cc2ccccc2Cl)c2ccccc12,C40744393_decoy,TRY1,Decoy,0,-6.77463,-8.28,-0.64,-7.762005515190911
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1ccc(Br)cn1,C40756277_decoy,TRY1,Decoy,0,-8.10687,-5.48,-1.33,-5.311051763148986
Cc1ccc2c(Nc3ncnc(Nc4cccc5cccnc45)c3N)cccc2[nH+]1,C40758527_decoy,TRY1,Decoy,0,-8.96493,-8.72,-0.87,-6.402441728241596
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccc(Br)cc3)c2N)CC(C)(C)[NH2+]1,C40760805_decoy,TRY1,Decoy,0,-8.97709,-6.67,-1.2,-5.96415671018507
CC1(C)CC(Nc2ncnc(Nc3ccc(F)c(Cl)c3)c2N)CC(C)(C)[NH2+]1,C40760866_decoy,TRY1,Decoy,0,-8.83346,-6.94,-1.28,-5.102764438795033
Cc1ccc2c(Nc3ncnc(Nc4cccc5ncccc45)c3N)cccc2[nH+]1,C40797075_decoy,TRY1,Decoy,0,-8.89143,-9.16,-1.89,-11.214564449269634
NC(=O)C[C@@H]([NH3+])c1ccccc1N1CCN(c2ccc(C(F)(F)F)cn2)CC1,C44251870_decoy,TRY1,Decoy,0,-8.30356,-7.17,-2.03,-5.675854914762002
NC(=O)C[C@H]([NH3+])c1ccccc1N1CCN(c2ccc(C(F)(F)F)cn2)CC1,C44251873_decoy,TRY1,Decoy,0,-9.05572,-5.58,-2.9,-5.515963061281762
Cn1nc(C(F)(F)F)c([C@H]([NH3+])CC(N)=O)c1SCc1ccccc1Cl,C44253908_decoy,TRY1,Decoy,0,-7.51225,-6.15,-2.38,-5.499691963105441
Cn1nc(C(F)(F)F)c([C@@H]([NH3+])CC(N)=O)c1SCc1ccccc1Cl,C44253911_decoy,TRY1,Decoy,0,-8.227,-5.64,-4.06,-5.351130476383902
Cn1nc(C(F)(F)F)c([C@H]([NH3+])CC(N)=O)c1SCc1ccc(Cl)cc1,C44253914_decoy,TRY1,Decoy,0,-7.45427,-6.08,-3.91,-5.560833726899946
NC(=O)c1ccsc1NC(=O)C(=O)NCC1([NH+]2CCSCC2)CCCC1,C48001909_decoy,TRY1,Decoy,0,-7.80835,-6.47,-2.63,-7.921977525296279
CCC[C@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51054702_decoy,TRY1,Decoy,0,-7.03882,-6.41,-2.43,-4.874119081413111
CC(C)(C)[C@H]([NH2+]CC(=O)Nc1ccccc1SCC(N)=O)c1cccs1,C52838562_decoy,TRY1,Decoy,0,-9.38016,-6.37,-3.12,-8.052314676399586
CC(C)(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1SCC(N)=O)c1cccs1,C52838564_decoy,TRY1,Decoy,0,-7.39992,-5.32,-2.44,-5.6890920715415065
Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1,C56159739_decoy,TRY1,Decoy,0,-7.66557,-7.58,-1.16,-6.193500357685036
Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1,C56159740_decoy,TRY1,Decoy,0,-8.14592,-7.35,-2.02,-5.831382318176962
CSc1ccccc1NC(=O)C[NH+](C)[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C31038820_decoy,TRY1,Decoy,0,-9.80799,-6.72,-1.89,-6.92799403925598
NC(=[NH2+])N/N=C/c1cc(I)c(O)c(I)c1,C59145545_decoy,TRY1,Decoy,0,-8.85252,-6.2,-0.53,-11.78822504467973
NC(=O)[C@@H]1Oc2ccccc2[C@@H]1NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1,C63710337_decoy,TRY1,Decoy,0,-6.92701,-8.28,-3.72,-5.972902677082367
CC(=O)Nc1ccccc1OC[C@H]1NO[C@@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1,C63808354_decoy,TRY1,Decoy,0,-9.74685,-7.84,-1.21,-7.18166719751718
NC(=O)N[C@@H](CC(=O)NC[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl)c1ccccc1F,C64066285_decoy,TRY1,Decoy,0,-7.87385,-6.87,-2.78,-5.797928664977674
CC[C@H](C)[C@@H](NC(N)=O)C(=O)N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C65695955_decoy,TRY1,Decoy,0,-8.22294,-6.14,-1.33,-5.231727447382121
CCNc1cc(N)[n+](CC)c2[nH]nc(/N=C/c3cc(Cl)cc(Cl)c3O)c12,C18190197_decoy,TRY1,Decoy,0,-10.063,-7.2,-2.19,-8.059692136308865
CC1(C)CC(NC(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)CC(C)(C)[NH2+]1,C67589426_decoy,TRY1,Decoy,0,-8.15768,-6.17,-2.19,-6.267839794919028
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C03947433_decoy,TRY1,Decoy,0,-8.59765,-9.3,-2.38,-8.381964630003168
O=c1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C04349434_decoy,TRY1,Decoy,0,-8.99867,-8.65,-2.66,-7.959295352495696
O=c1cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C04349516_decoy,TRY1,Decoy,0,-7.76573,-8.43,-2.3,-5.069627956418479
CSc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)n1C,C05760544_decoy,TRY1,Decoy,0,-7.13978,-5.61,-2.11,-4.981000184431035
CSc1nc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)n1C,C05760545_decoy,TRY1,Decoy,0,-7.65549,-5.73,-1.94,-5.613597199663995
COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C05809745_decoy,TRY1,Decoy,0,-7.34901,-6.92,-1.62,-6.380777598327402
COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C05809747_decoy,TRY1,Decoy,0,-7.01879,-6.44,-1.2,-5.026183632275181
Cc1nc2ccc(Br)cc2c(=O)n1-c1ccc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05741596_decoy,TRY1,Decoy,0,-7.16915,-6.67,-2.2,-4.485322169599065
Cc1nc2ccc(Br)cc2c(=O)n1-c1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05741597_decoy,TRY1,Decoy,0,-7.32611,-6.52,-2.37,-4.739097618904412
Cn1cnnc1SCc1c(C(=O)N/N=C/c2ccc(O)cc2O)nnn1-c1nonc1N,C09411350_decoy,TRY1,Decoy,0,-9.16591,-8.71,-3.83,-8.396400878177571
COc1cc([C@@H]2NC(=O)N[C@@H](c3ccc(O)c(OC)c3)C23C(=O)NC(=O)NC3=O)ccc1O,C10013986_decoy,TRY1,Decoy,0,-8.12401,-5.75,-1.58,-6.005125190527593
COc1cc([C@H]2NC(=O)N[C@H](c3ccc(O)c(OC)c3)C23C(=O)NC(=O)NC3=O)ccc1O,C10013987_decoy,TRY1,Decoy,0,-8.39236,-7.47,-0.75,-6.3523735958789045
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c12,C12153134_decoy,TRY1,Decoy,0,-8.87503,-8.85,-2.35,-7.733662995640747
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(C[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C12374689_decoy,TRY1,Decoy,0,-7.76973,-7.62,-2.55,-6.637593176926121
N#CC1=C(N)N(Nc2cc(=O)[nH]nc2-c2ccccc2)C2=C(C(=O)CCC2)[C@@H]1c1ccc(O)cc1,C12376880_decoy,TRY1,Decoy,0,-7.41885,-8.72,-1.45,-7.715376707857998
N#CC1=C(N)N(Nc2cc(=O)[nH]nc2-c2ccccc2)C2=C(C(=O)CCC2)[C@H]1c1ccc(O)cc1,C12376881_decoy,TRY1,Decoy,0,-6.72174,-7.14,-2.42,-5.396005569588204
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C06193899_decoy,TRY1,Decoy,0,-9.80276,-5.51,-1.06,-7.016178968604412
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C13424700_decoy,TRY1,Decoy,0,-8.83869,-9.21,-1.64,-8.45382503451229
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c2O,C13424704_decoy,TRY1,Decoy,0,-8.88751,-9.02,-2.19,-8.069460595872139
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C13424731_decoy,TRY1,Decoy,0,-8.41385,-9.06,-1.05,-8.084571904885793
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc(O)c12,C13515389_decoy,TRY1,Decoy,0,-8.40379,-9.24,-1.59,-6.7301252849368565
O=C1c2c(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O[C@H](c2ccc(O)cc2)[C@@H]1O,C14728214_decoy,TRY1,Decoy,0,-9.65332,-9.35,-2.46,-8.980396929432954
NC(=O)C1CCN(C(=O)[C@@H]2C[C@@H](O)[C@H](O)[C@@H]3NC(=S)N(c4ccc(-n5cccn5)cc4)[C@@H]32)CC1,C08636518_decoy,TRY1,Decoy,0,-8.8409,-5.85,-1.11,-5.842545293424795
CSc1nc(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(I)c(=O)n1C,C16952390_decoy,TRY1,Decoy,0,-7.70354,-5.37,-2.04,-5.123977720280161
Cc1nc2ccc(Br)cc2c(=O)n1-c1ccc(N[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1,C16958546_decoy,TRY1,Decoy,0,-7.39722,-8.03,-1.31,-5.2837827385989975
COc1ccc([C@@H]2CC(=O)C3=C(C2)Nc2[nH]nc(O)c2[C@H]3c2ccc(O)c(O)c2)cc1OC,C18197683_decoy,TRY1,Decoy,0,-8.41627,-6.77,-2.86,-5.517705803937131
COc1ccc(-c2[nH]c3[nH]c(=O)[nH]c(=O)c3c2-c2c(-n3cccc3)[nH]c(=O)[nH]c2=O)cc1F,C20896821_decoy,TRY1,Decoy,0,-6.88335,-5.89,-1.4,-5.056282842334051
Cc1c(Cl)cccc1NC(=O)[C@H]1CC(=O)Nc2nc(N3CCC(C(N)=O)CC3)[nH]c(=O)c21,C22610528_decoy,TRY1,Decoy,0,-9.48687,-6.95,-1.92,-6.344451868124468
N#Cc1c(N2CCC(C(N)=O)CC2)nc(N)c2c(N)nc3c(c12)CC(=O)N3Cc1ccco1,C23409039_decoy,TRY1,Decoy,0,-7.55396,-6.8,-4.74,-4.877176244351803
COc1cc([C@@H]2Oc3ccc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3O[C@H]2CO)ccc1O,C30731533_decoy,TRY1,Decoy,0,-10.2647,-6.55,-2.44,-6.534511212034863
COc1cc(-c2coc3c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)ccc3c2=O)ccc1O,C33832534_decoy,TRY1,Decoy,0,-8.35387,-7.68,-2.63,-6.292163890103248
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc1CCC(=O)CCCCc1ccc(O)c-2c1,C35455279_decoy,TRY1,Decoy,0,-4.85713,-8.39,,99.0
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c2O,C35466129_decoy,TRY1,Decoy,0,-7.96631,-7.77,-1.28,-6.933737266552672
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C35466151_decoy,TRY1,Decoy,0,-7.9507,-8.86,-2.12,-6.385421047487156
Cc1coc2c(C)c3oc(=O)c(CCC(=O)N(C)C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc12,C36369709_decoy,TRY1,Decoy,0,-8.03528,-7.91,-3.57,-5.959233019128085
O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C31155609_decoy,TRY1,Decoy,0,-8.72385,-7.59,-2.9,-5.677216652572476
O=c1cc(-c2ccc(O)c(O)c2)c2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)cc2o1,C31158310_decoy,TRY1,Decoy,0,-6.69232,-5.68,-4.95,-4.395337279152847
COc1cc([C@@H]2Oc3cc([C@@H]4Oc5cc(O)cc(O)c5C(=O)[C@H]4O)ccc3O[C@H]2CO)ccc1O,C01554609_decoy,TRY1,Decoy,0,-10.0456,-8.32,-3.09,-6.974824995666568
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C40422816_decoy,TRY1,Decoy,0,-8.9899,-9.26,-2.06,-8.423791581832319
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C43465402_decoy,TRY1,Decoy,0,-9.87503,-9.04,-1.69,-9.0804246164006
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)c2O,C43465407_decoy,TRY1,Decoy,0,-8.90868,-6.65,-2.51,-6.471558684450042
O=c1c(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C43465447_decoy,TRY1,Decoy,0,-8.47047,-8.42,-0.9,-7.550079076422289
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc(O)c12,C44608422_decoy,TRY1,Decoy,0,-8.7744,-8.59,-1.87,-7.866659274720819
CCn1c(C)cc2c(c1=O)[C@H](c1cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c1=O)C(C#N)=C(N)O2,C45356374_decoy,TRY1,Decoy,0,-5.532,-6.7,-1.73,-4.405461754413293
CCn1c(C)cc2c(c1=O)[C@@H](c1cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c1=O)C(C#N)=C(N)O2,C45356378_decoy,TRY1,Decoy,0,-5.62194,-6.06,-1.71,-4.614000203978872
CC[NH+]1CCN(c2nc(N)c3c(N)nc4c(c3c2C#N)CC(=O)N4Cc2ccccc2Cl)CC1,C25463231_decoy,TRY1,Decoy,0,-7.04506,-6.97,-2.86,-4.854048081646412
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)CC(=O)N3)CC1,C12323328_decoy,TRY1,Decoy,0,-9.60075,-8.75,-1.76,-8.02607596651592
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)CC(=O)N3)CC1,C12323329_decoy1,TRY1,Decoy,0,-10.3923,-6.96,,-7.165578855253183
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)CC(O)=N3)CC1,C12323329_decoy2,TRY1,Decoy,0,-9.94963,-6.79,,-6.863538355634842
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C03947431_decoy,TRY1,Decoy,0,-8.35749,-6.93,-2.05,-5.421468581687464
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C04348841_decoy,TRY1,Decoy,0,-8.5397,-8.04,-2.43,-7.253725629811501
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c2O,C04348855_decoy,TRY1,Decoy,0,-8.11549,-9.48,-2.84,-6.802856147469373
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C04349372_decoy,TRY1,Decoy,0,-8.65895,-7.82,-2.78,-5.5026257407488455
O=c1cc(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C04349513_decoy,TRY1,Decoy,0,-8.82154,-7.38,-3.89,-5.957314482002856
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C04349525_decoy,TRY1,Decoy,0,-8.1394,-9.24,-2.61,-6.729412562484954
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C05004608_decoy,TRY1,Decoy,0,-9.27635,-8.38,-2.7,-7.053338528213393
Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccc(O)cc2O)c1-c1ccc([N+](=O)[O-])cc1,C01897070_decoy,TRY1,Decoy,0,-9.11787,-9.23,-2.3,-8.179623620992135
C[C@]1(O[C@@]2(C)[C@@](C)(O)[C@@](C)(O)[C@H](O)O[C@]2(C)CO)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970286_decoy,TRY1,Decoy,0,-5.02409,-4.63,-4.81,-4.166824749349241
C[C@]1(OC[C@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970506_decoy,TRY1,Decoy,0,-5.0492,-5.98,-2.62,-3.962886497738933
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c12,C12153087_decoy,TRY1,Decoy,0,-9.39264,-9.44,-2.81,-8.565840465717164
C[C@@]1(O[C@]2(C)[C@@H](CO)O[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C12358614_decoy,TRY1,Decoy,0,-5.04084,-5.68,-4.6,-4.398325115084411
C[C@@]1(O[C@]2(C)[C@@H](CO)O[C@@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C12358636_decoy,TRY1,Decoy,0,-4.96482,-6.06,-3.73,-4.582656553074142
CC1(C)O[C@@](O)(CO)[C@](C)(O[C@@]2(C)O[C@H](CO)[C@@](C)(O)[C@@H](O)[C@@]2(C)O)[C@@](C)(O)[C@@]1(C)O,C12358954_decoy,TRY1,Decoy,0,-5.17629,-5.51,-4.68,-4.223675511681968
O=c1cc(-c2cc(O)c(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c2)oc2cc(O)cc(O)c12,C12428288_decoy,TRY1,Decoy,0,-9.52374,-10.24,-1.98,-8.993400044638106
O=c1cc(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C12428585_decoy,TRY1,Decoy,0,-8.27972,-7.96,-1.98,-6.767198904660184
O=c1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C13424730_decoy,TRY1,Decoy,0,-8.98323,-8.96,-4.26,-8.03087979564098
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C13424733_decoy,TRY1,Decoy,0,-8.49147,-8.86,-2.41,-7.925200641969948
O=C1c2c(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O[C@H](c2ccc(O)cc2)[C@@H]1O,C14728213_decoy,TRY1,Decoy,0,-8.88562,-9.03,-3.38,-8.276736034177787
O=C1/C(=C/c2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c21,C17191063_decoy,TRY1,Decoy,0,-10.0477,-6.83,-1.34,-6.6514738599918575
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C14951118_decoy,TRY1,Decoy,0,-7.96541,-9.12,-3.26,-7.603281207634884
COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)ccc3O[C@H]2CO)ccc1O,C25995973_decoy,TRY1,Decoy,0,-11.1602,-6.24,-1.3,-6.0309151409237165
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)O[C@@H](c2ccc(O)c(O)c2)[C@H](O)C3)[C@H](O)[C@@H](O)[C@@H]1O,C31160358_decoy,TRY1,Decoy,0,-10.5626,-9.06,-1.93,-9.29995660022798
OC[C@H]1O[C@@H](O[C@@H]2Cc3c(O)cc(O)cc3O[C@H]2c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C31165296_decoy,TRY1,Decoy,0,-9.33592,-10.01,-1.42,-10.218939402201338
COc1c(-c2ccc(O)c(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O,C31166753_decoy,TRY1,Decoy,0,-7.97828,-10.15,-1.34,-8.911817673316856
O[C@@H]1[C@H](O)[C@H](O)CO[C@@H]1Nc1ccc(-c2ccc(N[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)cc2)cc1,C35338726_decoy,TRY1,Decoy,0,-5.48877,-7.49,-2.14,-4.893556923232489
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C35466149_decoy,TRY1,Decoy,0,-8.03024,-9.62,-2.24,-6.7254218535264485
Cc1coc2c(C)c3oc(=O)c(CCC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc12,C36369708_decoy,TRY1,Decoy,0,-8.58608,-8.17,-3.21,-6.246628600859935
O=c1c(O)c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C04349687_decoy,TRY1,Decoy,0,-8.79507,-7.73,-3.01,-6.112044276925727
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C31155036_decoy,TRY1,Decoy,0,-9.61114,-7.17,-1.56,-7.398420024760488
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C03947432_decoy,TRY1,Decoy,0,-8.38941,-9.05,-3.48,-7.906819151432267
COc1cc([C@H]2Oc3cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@H]4O)ccc3O[C@H]2CO)ccc1O,C03831448_decoy,TRY1,Decoy,0,-11.4404,-7.12,-1.54,-6.422568569802428
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C08681630_decoy,TRY1,Decoy,0,-7.79961,-7.8,-3.21,-7.886731231375103
O[C@@H]1[C@H](O)[C@H](O)CO[C@H]1Nc1ccc(-c2ccc(N[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)cc2)cc1,C35338729_decoy,TRY1,Decoy,0,-5.82695,-6.47,-2.84,-4.730446873523585
CC(C)[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])C(C)C)CCOCCOCC1,C39988344_decoy,TRY1,Decoy,0,-8.81967,-4.6,-3.86,-6.123429864940399
O=c1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C03869766_decoy,TRY1,Decoy,0,-7.83004,-8.92,-2.07,-8.252660671891373
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O)c2O,C43465406_decoy,TRY1,Decoy,0,-8.67392,-9.76,-1.18,-8.134073714517458
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2c(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C43465419_decoy,TRY1,Decoy,0,-8.57299,-6.75,-3.39,-6.530353286049603
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C43465423_decoy,TRY1,Decoy,0,-8.03627,-7.16,-1.8,-5.452453456364872
O=c1c(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C43465446_decoy,TRY1,Decoy,0,-8.33817,-8.53,-1.45,-7.662768405051497
O=c1cc(-c2ccc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C43465451_decoy,TRY1,Decoy,0,-8.93007,-7.41,-2.41,-5.920835644504804
O=c1c(O)c(-c2ccc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C43465466_decoy,TRY1,Decoy,0,-9.10978,-7.78,-3.85,-6.05555396964941
C[C@]1(O[C@]2(C)[C@H](CO)O[C@](C)(O)[C@@](C)(O)[C@@]2(C)O)O[C@H](CO)[C@](C)(O)[C@](C)(O)[C@@]1(C)O,C43509297_decoy,TRY1,Decoy,0,-5.05689,-5.28,-3.84,-4.061464691384171
CC1(C)O[C@](O)(CO)[C@](C)(O[C@]2(C)O[C@H](CO)[C@@](C)(O)[C@H](O)[C@@]2(C)O)[C@@](C)(O)[C@@]1(C)O,C43509426_decoy,TRY1,Decoy,0,-4.81205,-5.28,-2.44,-4.125082706226711
COC(=O)[C@H]1O[C@H]2C[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](OC)[C@@H]3O[C@]2(O)[C@@H](O)[C@@H]1O,C43509761_decoy,TRY1,Decoy,0,-5.38035,-7.55,-2.56,-6.809997599208425
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc(O)c12,C44608421_decoy,TRY1,Decoy,0,-8.28185,-8.77,-3.61,-7.716153806658705
O=c1c(O)c(-c2c(O)cccc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)oc2cc(O)cc(O)c12,C49601735_decoy,TRY1,Decoy,0,-7.28633,-7.18,-4.95,-5.115129296632076
COc1cccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1O,C36047066_decoy,TRY1,Decoy,0,-7.65607,-9.24,-1.5,-7.709482174625307
O=c1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C05004612_decoy,TRY1,Decoy,0,-7.8162,-9.33,-1.4,-9.304451373061848
O=c1c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)nc(O)n1CCc1ccccc1,C09014202_decoy,TRY1,Decoy,0,-7.59471,-7.95,-2.66,-6.445429851774625
O=c1c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)nc(O)n1CCc1ccccc1,C09014204_decoy,TRY1,Decoy,0,-8.13223,-9.37,-0.69,-6.832831334846101
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(NS(C)(=O)=O)CC1,C11717885_decoy,TRY1,Decoy,0,-7.8849,-7.45,-1.26,-5.483739209239783
Cn1c(=O)c2c(nc(N3CCOCC3)n2CCC[NH2+]C[C@H](O)c2ccc(O)c(O)c2)n(C)c1=O,C17107037_decoy,TRY1,Decoy,0,-9.29223,-7.97,-1.57,-8.075712621270556
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C19331495_decoy,TRY1,Decoy,0,-9.36219,-7.27,-0.85,-8.050985687867469
CC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)NCCC[NH+]3CCC(C(N)=O)CC3)c2C1,C19661498_decoy,TRY1,Decoy,0,-9.01553,-6.19,-3.36,-5.857082730609524
C[NH+](C)CCCNc1cc(N2CCN(CCO)CC2)c(N)c2c1C(=O)c1ccccc1C2=O,C20588982_decoy,TRY1,Decoy,0,-9.18337,-5.95,-0.07,-6.033045268357705
Cc1ccc(C)c(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c1,C14156509_decoy,TRY1,Decoy,0,-10.2726,-7.69,-1.38,-9.92645219660514
Cc1n[nH]c(=O)c2c(NC(=O)C[NH+](C)[C@@H](C)c3ccc(S(N)(=O)=O)cc3)oc(C)c12,C22134604_decoy,TRY1,Decoy,0,-8.31508,-7.58,-3.44,-6.124803505228729
NC(=O)NC(=O)CCN1CC[NH+](CC(=O)Nc2ccccc2C(F)(F)F)CC1,C22848975_decoy,TRY1,Decoy,0,-5.60094,-7.93,-1.13,-6.136688452750495
Cc1cc(C)c2c(N)c(C(=O)NNC(=O)[C@H]3COc4ccccc4C3)sc2[nH+]1,C24987502_decoy,TRY1,Decoy,0,-7.75435,-6.32,-0.78,-4.9165121378564205
NC(=O)C[NH+]1CCC(NC(=O)CCCNC(=O)c2ccc(F)cc2F)CC1,C25518068_decoy,TRY1,Decoy,0,-8.12426,-6.77,-5.07,-5.569496856739916
C[NH+](C)CCNC(=O)Nc1c(-c2ccc(Cl)cc2)nn(-c2ccc(F)cc2)c1N,C34785615_decoy,TRY1,Decoy,0,-7.89681,-6.43,-1.42,-5.962730264801746
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C35565241_decoy,TRY1,Decoy,0,-6.54881,-6.1,-2.71,-5.116463567155305
CC[C@@H]([NH2+][C@H]1N=NC(=O)NC1=O)C(=O)N/N=C\c1c(O)ccc2ccccc12,C38815325_decoy,TRY1,Decoy,0,-6.9122,-8.2,-4.13,-7.066709127444977
O=C(CS[C@H]1NN[C@H]([NH+]2CCCCC2)N1C[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12,C39470426_decoy,TRY1,Decoy,0,-9.88491,-7.19,-1.86,-6.80800456133112
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39597930_decoy,TRY1,Decoy,0,-8.54121,-9.64,-3.2,-7.889845108646089
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)NN1C,C39597976_decoy,TRY1,Decoy,0,-8.81705,-8.81,-1.79,-7.314437619644834
Cc1cccc(N2C(N3CCOCC3)=[NH+]N[C@@H]2SCC(=O)N[C@H]2O[C@@H](C)C3=C2C(=O)NN[C@H]3C)c1,C39729734_decoy,TRY1,Decoy,0,-8.99184,-7.31,-1.18,-7.23070988897228
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1ncc(C(F)(F)F)cc1Cl,C40687700_decoy,TRY1,Decoy,0,-7.38838,-7.72,-1.03,-10.766832900589092
Cc1ccc2nc(Nc3ncnc(NCC[NH+]4CCCCC4)c3N)sc2c1,C40756332_decoy,TRY1,Decoy,0,-8.00137,-5.48,-2.78,-5.1860242317650345
CC1(C)CC(Nc2ncnc(Nc3ccc4c(c3)OCCO4)c2N)CC(C)(C)[NH2+]1,C40760716_decoy,TRY1,Decoy,0,-8.92553,-7.49,-1.83,-5.582017864620797
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(Br)cn1,C40780000_decoy,TRY1,Decoy,0,-7.35646,-6.03,-2.53,-5.418432027931425
Cc1ccc2c(Nc3ncnc(NNC(=O)c4ccccc4C)c3N)cccc2[nH+]1,C40784414_decoy,TRY1,Decoy,0,-7.84936,-7.13,-1.6,-6.013969812463601
NC(=O)c1c(Nc2nc(NCCCn3cc[nH+]c3)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026315_decoy,TRY1,Decoy,0,-8.57998,-6.68,-2.79,-6.586057883547485
C[C@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2,C45355894_decoy,TRY1,Decoy,0,-8.31106,-6.35,-1.89,-5.566642838099775
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)cc2C1,C45545597_decoy,TRY1,Decoy,0,-9.84157,-5.81,-2.25,-5.365056765788581
O=C(C[NH+](CC(=O)NC(=O)NC1CC1)Cc1ccsc1)NC(=O)NC1CC1,C47045044_decoy,TRY1,Decoy,0,-8.62742,-6.84,-4.18,-8.290975257785503
NC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1C[NH+]1CCCC1,C49392638_decoy,TRY1,Decoy,0,-7.81557,-7.68,-2.91,-6.040237183455669
C[C@H]([NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1cccc(F)c1,C56159744_decoy,TRY1,Decoy,0,-7.60336,-7.39,-1.41,-6.031216694132662
C[C@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1ccccc1F,C56159855_decoy,TRY1,Decoy,0,-8.14255,-7.07,-1.32,-6.049627318904394
CCCNC(=O)CCNC(=O)Nc1nc(CN2CC[NH2+]CC2)nc2ccccc12,C57296465_decoy,TRY1,Decoy,0,-8.98007,-7.46,-2.5,-8.52025918235046
CC(C)[NH+](CCNC(=O)N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(C)C,C47684070_decoy,TRY1,Decoy,0,-8.31138,-2.05,-4.02,-4.020818386183118
NC(=O)[C@@H]1Oc2ccccc2[C@H]1NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1,C63710338_decoy,TRY1,Decoy,0,-7.94005,-8.15,-2.66,-6.831224796403026
NC(=O)CS[C@H]1NN=C(SCC(=O)NCCC2=c3ccccc3=[NH+]C2)S1,C64137914_decoy,TRY1,Decoy,0,-9.50689,-6.68,-1.92,-6.3239250049225335
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@H](O)N1Cc1ccccc1,C64227798_decoy,TRY1,Decoy,0,-7.6239,-6.71,-1.72,-6.052342032691797
Oc1cccc(NC(=S)/[NH+]=N/c2c(O)[nH]c3ccc(Br)cc23)c1,C13123395_decoy,TRY1,Decoy,0,-8.35497,-5.64,-0.88,-3.909876331782812
CC(=O)Nc1ccccc1NC(=O)C[NH2+][C@H](C)C12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2,C65380342_decoy,TRY1,Decoy,0,-7.42679,-5.96,-1.78,-5.68292085435143
CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCC[NH+](CC(N)=O)C2)cc(C)c1C,C66451874_decoy,TRY1,Decoy,0,-7.87442,-5.2,-4.24,-5.131353779831689
C[NH+](CC(=O)Nc1cc(F)cc(F)c1)CC(=O)Nc1sccc1C(N)=O,C66844606_decoy,TRY1,Decoy,0,-7.68707,-6.19,-3.58,-5.4338189452934245
Cc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)cc1C(N)=O,C67534420_decoy,TRY1,Decoy,0,-9.29196,-8.36,-2.45,-6.497131611907935
CC(=O)Nc1cc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c(F)cc1F,C67550361_decoy,TRY1,Decoy,0,-9.74701,-7.71,-1.78,-6.943330146373904
Cc1cc(CNC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c2[nH]c(C)c(C)c2c1,C67638556_decoy,TRY1,Decoy,0,-9.25206,-7.56,-3.04,-6.897040582277112
Nc1nc2c(nc(SCC(=O)[O-])n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C03958672_decoy,TRY1,Decoy,0,-7.40985,-7.6,-2.02,-9.07646043128453
O=C([O-])C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@H]1CC(=O)[C@@]2(O)CO,C04270012_decoy,TRY1,Decoy,0,-7.0759,-5.52,-2.25,-5.256012416130306
O=C([O-])C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]1CC(=O)[C@@]2(O)CO,C04270015_decoy,TRY1,Decoy,0,-6.91174,-6.04,-3.9,-5.583446644613413
Nc1nc(N)nc(-c2cc(Br)c(N)c(Br)c2)n1,C01607504_decoy,TRY1,Decoy,0,-7.4264,-4.55,-3.96,-3.216678577209851
OC[C@@H]1O[C@@H](Oc2cc(O)cc(/C=C\c3ccc(O)cc3)c2)[C@@H](O)[C@H](O)[C@@H]1O,C05923208_decoy,TRY1,Decoy,0,-7.3456,-7.67,-3.29,-6.601133363054028
CNNC(=NS(=O)(=O)c1cc(C#N)c(NNC)cc1[S-])NNC,C05856320_decoy,TRY1,Decoy,0,-7.85958,-6.48,-1.82,-7.473481503674195
O=c1c(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)coc2cc(O)cc(O)c12,C06143118_decoy,TRY1,Decoy,0,-7.34876,-8.43,-2.11,-5.494774958986593
Nc1ncnc2c1ncn2[C@H]1O[C@@](F)(COS(N)(=O)=O)[C@@H](O)[C@@H]1O,C05606969_decoy,TRY1,Decoy,0,-7.21709,-6.33,-1.35,-4.822662021106671
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C13549420_decoy,TRY1,Decoy,0,-8.06547,-7.6,-1.35,-6.629736665363466
Cc1ccc(C2=NN[C@H]([C@](C)(O)[C@@](C)(O)[C@@](C)(O)[C@@](C)(O)CO)S2)cc1,C16292186_decoy,TRY1,Decoy,0,-9.39174,-5.73,-1.58,-6.263753092284353
CC1(C)N(N)C(O)=C[C@H]2C3=C(NN21)OC(N)=C(C#N)[C@@H]3c1cccnc1,C16605288_decoy,TRY1,Decoy,0,-6.49034,-5.12,-1.12,-4.326107981529931
C[C@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@H]3[C@@H](O)[C@H]21,C14984391_decoy,TRY1,Decoy,0,-6.98056,-6.56,-3.47,-4.5363822720237
CNc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@@]3(O)C([O-])=C1C2=O,C22064236_decoy,TRY1,Decoy,0,-8.58552,-6.58,-3.1,-6.205717061853604
Nc1nc2c(nc(SCC(=O)[O-])n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C23397339_decoy,TRY1,Decoy,0,-6.17146,-8.38,-3.06,-8.482739805319671
CC1=CC(=O)C[C@@](C)(CO)[C@]1(O)/C=C/[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31168190_decoy,TRY1,Decoy,0,-6.8363,-7.05,-3.06,-5.098114980674568
NS(=O)(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)/C([O-])=N/c1n[nH]c(=S)[nH]1,C08653477_decoy,TRY1,Decoy,0,-8.71482,-5.1,-0.86,-5.982159156111939
NS(=O)(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)/C([O-])=N/c1n[nH]c(=S)[nH]1,C08653475_decoy,TRY1,Decoy,0,-8.97527,-7.93,-1.2,-8.414144215628713
O=c1c(-c2ccc(O)cc2)coc2c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)ccc12,C35050942_decoy,TRY1,Decoy,0,-7.6026,-8.64,-0.99,-7.170268079095976
Nc1ncnc2c1c1c(=S)nc([O-])[nH]c1n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C17109697_decoy,TRY1,Decoy,0,-7.55072,-4.72,-1.14,-4.631437541466089
C[C@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@H]3[C@H](O)[C@H]21,C35565138_decoy,TRY1,Decoy,0,-7.71259,-5.1,-3.02,-4.217761561448082
CC(=O)N[C@]1(C)[C@](C)([C@H](O)[C@H](O)CO)O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C35570737_decoy,TRY1,Decoy,0,-5.61937,-5.46,-2.78,-4.80418674706636
N#Cc1c(N)nc2c(c1N)[C@H](c1ccccc1Cl)c1ccc(N)cc1O2,C36559232_decoy,TRY1,Decoy,0,-6.43543,-8.33,-0.6,-5.71347120484406
C[NH+](C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@@H]3C[C@@H]12,C16121502_decoy,TRY1,Decoy,0,-9.54349,-6.15,-3.83,-5.1881071881020535
C[NH+](C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@@H]3C[C@@H]12,C16121502_decoy,TRY1,Decoy,0,-9.54349,-6.15,-1.9,-5.1881071881020535
C[C@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@]3(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@@H]21,C13783291_decoy1,TRY1,Decoy,0,-6.02854,-5.54,,-4.143700964016251
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@@H]12,C14879978_decoy,TRY1,Decoy,0,-7.70608,-6.22,-2.44,-4.524857028707508
C[C@@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@H]([NH+](C)C)[C@H]3[C@H](O)[C@@H]21,C19203897_decoy,TRY1,Decoy,0,-7.55432,-7.94,-3.22,-6.138619191149323
[NH-]C1=NC(=O)C2=N[C@H](N/N=C3/C(=O)Nc4ccccc43)N([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39939892_decoy,TRY1,Decoy,0,-7.50434,-9.27,-1.56,-7.366965655339558
[NH-]C1=NC(=O)C2=N[C@H](N/N=C3/C(=O)Nc4ccccc43)N([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39939894_decoy,TRY1,Decoy,0,-7.19911,-8.33,-1.87,-7.233155367018645
[NH-][NH2+]Nc1nc2c(N)ncnc2n1[C@H]1O[C@H]2CO[P@](=O)([O-])O[C@@H]2[C@H]1O,C39946843_decoy,TRY1,Decoy,0,-6.4702,-8.0,-1.45,-8.115748785379106
[NH-][NH2+]Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H]2CO[P@](=O)([O-])O[C@@H]2[C@H]1O,C39946844_decoy,TRY1,Decoy,0,-6.41266,-8.08,-0.44,-8.780623842499297
C[C@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]21,C43763888_decoy,TRY1,Decoy,0,-6.6108,-5.83,-3.16,-4.001053785033919
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C44020452_decoy,TRY1,Decoy,0,-8.2503,-7.68,-1.34,-10.018155591426646
CC(=O)N[C@@]1(C)[C@@](C)([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C44185602_decoy,TRY1,Decoy,0,-5.0852,-5.39,-1.74,-5.030546746943525
CC(=O)N[C@@]1(C)[C@@](C)([C@H](O)[C@H](O)CO)O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C44185610_decoy,TRY1,Decoy,0,-4.92492,-5.33,-1.73,-4.360460380730563
C=C1c2cccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]12,C44832120_decoy,TRY1,Decoy,0,-9.50043,-5.83,-1.46,-4.861777533599242
CN(C)[C@@H]1C(=O)/C(=C(/N)O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@H](O)[C@H]12,C37865942_decoy,TRY1,Decoy,0,-9.52298,-6.76,-1.96,-5.756524018982385
CN(C)[C@@H]1C(=O)/C(=C(/N)O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@H]12,C38140525_decoy,TRY1,Decoy,0,-9.11081,-6.48,-2.39,-4.594280554286667
N#Cc1c(N)nc2c(c1N)=C(N)SC1=[NH+]C(=O)C[C@@H](c3ccco3)C=21,C06829197_decoy,TRY1,Decoy,0,-7.76982,-7.31,-1.04,-7.532637740726047
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C([O-])[C@H](N(C)C)[C@H]3[C@@H](O)[C@@H]21,C36377967_decoy,TRY1,Decoy,0,-7.81187,-5.81,-2.65,-4.181691830883607
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H](N(C)C)[C@H]3[C@@H](O)[C@@H]21,C36379569_decoy,TRY1,Decoy,0,-8.7161,-5.92,-2.51,-4.973584236877279
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H](N(C)C)[C@H]3[C@@H](O)[C@H]21,C35565140_decoy,TRY1,Decoy,0,-7.55969,-5.28,-1.48,-4.549994256540597
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c2cc1C,C04353345_decoy,TRY1,Decoy,0,-7.28187,-6.98,-1.46,-5.956675877752185
C=C1c2cccc(O)c2C(=O)C2=C([O-])[C@]3(O)C(=O)/C(=C(\N)O)C(=O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12,C14879985_decoy,TRY1,Decoy,0,-7.10231,-5.55,-1.2,-4.334962685895038
N#Cc1c(N)nc2c(c1N)=C(N)SC1=NC(=O)C[C@@H](c3c(F)cccc3Cl)C=21,C13122852_decoy1,TRY1,Decoy,0,-7.11386,-6.14,,-2.872327046655417
N#Cc1c(N)nc2c(c1N)=C(N)SC1=NC(=O)C[C@@H](c3ccccc3Cl)C=21,C13110742_decoy,TRY1,Decoy,0,-6.55056,-6.32,-0.19,-3.3395712485435776
N#Cc1c(N)[nH+]c2c3c(sc(=[NH2+])c2c1N)N=C(O)C[C@H]3c1ccccc1,C13122797_decoy2,TRY1,Decoy,0,-6.58106,-7.65,,-4.421213665470158
N#Cc1c(N)nc2c(c1N)=C(N)SC1=[NH+]C(=O)C[C@@H](c3c(F)cccc3Cl)C=21,C13122852_decoy2,TRY1,Decoy,0,-6.52672,-6.1,,-4.042598190377053
N#Cc1c(N)[nH+]c2c3c(sc(=[NH2+])c2c1N)N=C(O)C[C@H]3c1c(F)cccc1Cl,C13122852_decoy3,TRY1,Decoy,0,-7.24063,-5.2,,-3.674198729074448
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@H](N(C)C)[C@@H]3[C@@H](O)[C@@H]21,C13783291_decoy2,TRY1,Decoy,0,-7.31529,-6.62,,-5.384133458814156
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H](N(C)C)[C@H]3[C@@H](O)[C@@H]21,C16248873_decoy,TRY1,Decoy,0,-8.24302,-6.5,-2.63,-3.9484962243557855
CCCCCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)[nH]c1=O,C02130283_decoy,TRY1,Decoy,0,-8.13529,-5.78,-4.65,-5.73892863656791
NC(=O)C[C@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C3CCCC3)C(=O)[C@@H]21,C02130924_decoy,TRY1,Decoy,0,-8.08334,-6.25,-1.48,-5.80298028310745
NC(=O)C[C@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C3CCCC3)C(=O)[C@@H]21,C02130923_decoy,TRY1,Decoy,0,-8.64798,-5.07,-1.43,-4.982576059292684
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)c3cccnc3)c2C(N)=O)C1,C02316391_decoy,TRY1,Decoy,0,-8.54737,-5.53,-3.28,-5.659138149878827
Cc1ccc(Nc2nc(C[NH+](C)CCCc3n[nH]c(N)c3C#N)cs2)cc1,C06657851_decoy,TRY1,Decoy,0,-8.60623,-5.85,-1.42,-6.6290495417335125
NC(=O)C1CC[NH+](Cc2nc(N)nc(Nc3ccc4c(c3)OCCO4)n2)CC1,C09096617_decoy,TRY1,Decoy,0,-8.57161,-7.28,-3.1,-5.767929522595742
COc1ccc(-n2c(=S)[nH]c(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)cc1,C02106332_decoy,TRY1,Decoy,0,-8.13753,-6.31,-3.07,-6.254767391468165
O=C(NC1CC[NH2+]CC1)c1[nH]ncc1NC(=O)c1c(Cl)cccc1Cl,C16052857_decoy,TRY1,Decoy,0,-9.08811,-5.68,-1.89,-5.309394224997603
C[NH+]1CCN([C@@H]2[C@H](O)[C@H](CO)O[C@@H]2CNC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1,C20465168_decoy,TRY1,Decoy,0,-7.41381,-5.5,-0.85,-5.388377791502412
NC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@H]2[C@@H]1S/C(=[NH+]\CCN1CCOCC1)N2Cc1cccs1,C08296032_decoy,TRY1,Decoy,0,-9.71257,-5.53,-2.36,-5.840736700907642
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)CC(C)(C)[NH2+]1,C20833598_decoy,TRY1,Decoy,0,-9.91744,-9.2,-2.44,-8.254789900515869
C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680472_decoy,TRY1,Decoy,0,-9.72243,-6.48,-3.19,-5.785753169803827
Cc1cc(C)c2c(N)c(C(=O)NNC(=O)c3ccc(O)c(Cl)c3)sc2[nH+]1,C32901219_decoy,TRY1,Decoy,0,-8.63436,-7.62,-2.29,-6.24568099369603
C[NH+](C)CCCNC(=O)Nc1c(C(C)(C)C)nn(-c2cc(F)ccc2F)c1N,C34784877_decoy,TRY1,Decoy,0,-7.89921,-5.34,-1.19,-5.314704270760823
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C35565242_decoy,TRY1,Decoy,0,-6.77995,-4.51,-3.62,-4.277562029839423
NC(=S)N/N=C1/[NH+]=c2ccccc2=C1NNC(=S)NCc1ccccc1,C18115466_decoy,TRY1,Decoy,0,-8.75112,-6.88,-0.95,-7.343223370054245
Cc1cc(C)nc(N/C(=N/C(=O)CS[C@@H]2N[NH2+]NN2C)NCCc2c[nH]c3ccc(Cl)cc23)n1,C39313498_decoy,TRY1,Decoy,0,-9.74281,-8.36,-2.43,-8.935270018428426
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](c2cc(C)on2)ON1,C39597831_decoy,TRY1,Decoy,0,-8.26636,-9.01,-2.22,-7.870936064655883
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)NN1C,C39656240_decoy,TRY1,Decoy,0,-9.11421,-7.16,-3.93,-6.464506476864303
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39661731_decoy,TRY1,Decoy,0,-9.99491,-6.63,-1.14,-6.245086478780178
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39661913_decoy,TRY1,Decoy,0,-8.57355,-6.64,-0.39,-5.793398384176365
Nc1c(NCc2cccnc2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40686584_decoy,TRY1,Decoy,0,-7.49406,-7.33,-0.25,-6.973892906200994
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1NNc1ccccc1,C40757593_decoy,TRY1,Decoy,0,-7.7534,-6.97,-1.3,-6.321028546184698
Nc1c(Nc2ncc(C(F)(F)F)cc2Cl)nc[nH+]c1Nc1ccccn1,C40779284_decoy,TRY1,Decoy,0,-8.2044,-7.8,-1.73,-7.527261356763057
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccccc1Br,C40781481_decoy,TRY1,Decoy,0,-7.44473,-6.49,-1.78,-5.927218467712319
C[C@@H]1CCc2noc(Nc3nc(NCC[NH2+]CCO)nc(N)c3[N+](=O)[O-])c2C1,C41301435_decoy,TRY1,Decoy,0,-7.7602,-7.19,-1.27,-7.648388067160784
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCC4)n2)CC1,C41302069_decoy,TRY1,Decoy,0,-8.43813,-7.36,-2.13,-7.165841125286521
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1C,C42910180_decoy,TRY1,Decoy,0,-8.24543,-6.09,-3.47,-5.5862224914291865
Cc1ccccc1NC(=O)NNC(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C,C43307494_decoy,TRY1,Decoy,0,-7.77399,-8.31,-1.97,-6.797336015237603
Cc1ccccc1NC(=O)NNC(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C,C43307496_decoy,TRY1,Decoy,0,-7.09426,-6.86,-2.55,-5.654054546351262
CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NC1CC[NH+](CC(N)=O)CC1,C45891034_decoy,TRY1,Decoy,0,-9.49939,-6.29,-2.73,-7.580884553271664
NC(=O)c1ccsc1NC(=O)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C47963686_decoy,TRY1,Decoy,0,-8.5937,-6.12,-2.36,-6.712901164783142
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(OCCC[NH3+])cc21,C49784022_decoy,TRY1,Decoy,0,-10.5478,-6.04,-2.51,-7.888639595151878
C[NH+](C)Cc1c(C(=O)N/N=C2\C(=O)Nc3ccccc32)nnn1-c1nonc1N,C02229104_decoy,TRY1,Decoy,0,-8.80428,-8.29,-1.38,-15.052211399599429
C[C@@H](NC(=O)NCCc1[nH+]ccn1C)c1ccc(-n2cc(C(N)=O)nn2)cc1,C58244569_decoy,TRY1,Decoy,0,-7.12717,-6.83,-1.38,-5.699085323299796
CCNC(=S)/N=C(\Nc1nc(C)cc(C)n1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C14158022_decoy,TRY1,Decoy,0,-7.59461,-6.58,-2.44,-7.192380832590512
Cc1cc(C)nc(/N=C(/NC(=S)Nc2ccccc2C)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161196_decoy,TRY1,Decoy,0,-8.78923,-5.95,-2.46,-5.584980628674537
O=C(C[C@@H]1NO[C@@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63795091_decoy,TRY1,Decoy,0,-8.61215,-8.19,-1.4,-6.519007370239547
C[C@@H]1[C@H](C[NH2+]CCc2n[nH]c(-c3ccncc3)n2)c2ccccc2N1CC(N)=O,C63848242_decoy,TRY1,Decoy,0,-7.92575,-6.19,-2.83,-5.594740411988227
C[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)NC(N)=O,C64055451_decoy,TRY1,Decoy,0,-8.02377,-7.32,-1.64,-7.218328661917406
O=C(NCCCO)C1=CN(C2CCN(C[C@H]3C=c4ccccc4=[NH+]3)CC2)NN1,C64640493_decoy,TRY1,Decoy,0,-8.79074,-5.82,-2.58,-5.663061421900024
CC1CC[NH+]([C@@H](C)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1,C65477713_decoy,TRY1,Decoy,0,-7.85153,-5.82,-3.23,-4.984850179313471
Cc1ccsc1C(=O)NNC(=O)NCc1cccc(NC(=O)C[NH+](C)C)c1,C67102330_decoy,TRY1,Decoy,0,-9.13592,-6.42,-1.28,-6.444557895394117
Cc1ccc(Nc2nc(NCCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C05050804_decoy,TRY1,Decoy,0,-7.08677,-6.82,-2.4,-6.81236860825084
C=C([NH3+])[C@@H](C#N)C(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1N,C06279602_decoy,TRY1,Decoy,0,-9.39733,-6.86,-2.53,-7.310918154198813
OCC(CO)(CO)[NH2+]C[C@H](O)Cn1c2c(c3cccc(Cl)c31)CCCC2,C12421989_decoy,TRY1,Decoy,0,-7.89372,-6.89,-1.85,-5.875824782720503
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@H](CCC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12885352_decoy,TRY1,Decoy,0,-9.00455,-9.82,-2.23,-8.729972443243751
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H]([C@H](C)O)C[C@@H]1C(=O)Nc1ccc(F)cc1)C(=O)N2,C13591583_decoy,TRY1,Decoy,0,-7.48157,-6.13,-1.11,-5.144320776128909
O=C(NCC[NH+]1CCOCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(-n4cccn4)cc3)S[C@@H]21,C08636351_decoy,TRY1,Decoy,0,-10.633,-7.66,-1.51,-7.095378260926435
CN(C)c1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCCCC4)[C@H]3S2)cc1,C08636528_decoy,TRY1,Decoy,0,-9.71679,-6.19,-1.53,-6.685705894970025
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cccnc3)n2)CC(C)(C)[NH2+]1,C20832103_decoy,TRY1,Decoy,0,-8.93389,-8.01,-1.15,-8.48825000485159
CCCCN(C(=O)C[NH+]1CCN(c2ccc(O)cc2)CC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C25785138_decoy,TRY1,Decoy,0,-8.51721,-7.56,-2.6,-7.422941905354572
Cn1cc(C2=C(c3cn(CCCSC(N)=[NH2+])c4ccccc34)C(=O)NC2=O)c2ccccc21,C03797930_decoy,TRY1,Decoy,0,-7.4214,-7.26,-1.98,-7.332580691272271
CCC[C@H]1C[C@@H](C(=O)N[C@@H](CC)[C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[NH+](C)C1,C38337197_decoy,TRY1,Decoy,0,-7.13961,-6.12,-2.37,-5.531409281622625
CC[C@H]([NH2+][C@H]1N=NC(=O)NC1=O)C(=O)N/N=C\c1c(O)ccc2ccccc12,C38815324_decoy,TRY1,Decoy,0,-6.51347,-8.55,-1.42,-7.11300752241138
CC[C@@H]([NH2+][C@@H]1N=NC(=O)NC1=O)C(=O)N/N=C\c1c(O)ccc2ccccc12,C38815327_decoy,TRY1,Decoy,0,-6.69982,-7.15,-0.81,-6.133408448629025
COc1ccc(N2N[NH2+]N[C@@H]2SCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccc(F)cc2)cc1,C39210616_decoy,TRY1,Decoy,0,-8.84816,-8.42,-1.96,-7.116385969718012
O=C(CS[C@@H]1NN[C@H]([NH+]2CCCCC2)N1C[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12,C39470425_decoy,TRY1,Decoy,0,-10.6204,-7.05,-1.59,-8.957204153837369
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39684242_decoy,TRY1,Decoy,0,-8.62046,-6.63,-1.86,-6.663478560630444
Nc1c(NCc2ccccc2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40709277_decoy,TRY1,Decoy,0,-6.67832,-6.02,-2.04,-7.088149539472648
Nc1c(NNc2ccccc2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40757424_decoy,TRY1,Decoy,0,-6.94394,-5.96,-2.14,-5.021686688331221
Cc1cc(Oc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)ccc1Cl,C40760872_decoy,TRY1,Decoy,0,-8.36539,-5.48,-1.97,-4.842537603513242
NC(=O)N[C@H](CC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1cccs1,C41953285_decoy,TRY1,Decoy,0,-9.73659,-5.02,-1.45,-6.243530544057866
O=C(NCC1([NH+]2CCCCC2)CCCCC1)NNC(=S)NC1CCCC1,C43112186_decoy,TRY1,Decoy,0,-10.4521,-7.07,-3.1,-7.441823201268696
C[C@@H]1[C@@H](NC(=O)c2coc([C@@H]([NH3+])Cc3ccc(O)cc3)n2)C[C@@H]2C[C@H]1C2(C)C,C43217928_decoy,TRY1,Decoy,0,-8.9963,-6.51,-1.24,-6.146302021971115
CC1(C)C[C@H]([NH2+]Cc2ccc(CO)o2)[C@]2(CCC(=O)NC3CC3)CC[C@](C)(O)C[C@@H]12,C43548061_decoy,TRY1,Decoy,0,-9.01324,-5.06,-1.28,-6.228657685940063
O=C(NCC1([NH+]2CCSCC2)CCCC1)NNC(=S)NC1CCCC1,C47009109_decoy,TRY1,Decoy,0,-10.3355,-5.77,-1.58,-6.092376091404672
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1cccs1,C48743405_decoy,TRY1,Decoy,0,-9.39437,-7.61,-2.0,-11.779402959067053
Cc1c(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cccc1C(N)=O,C48768041_decoy,TRY1,Decoy,0,-7.80429,-6.26,-1.85,-5.707827112604403
CCC[C@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51054706_decoy,TRY1,Decoy,0,-7.60153,-7.39,-1.95,-8.480062112560686
Cc1cccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)n1,C40685513_decoy,TRY1,Decoy,0,-8.28177,-5.78,-1.75,-5.90946725556829
NC(=O)c1c(NC(=O)C[NH+]2CCC(C(=O)NC3CC3)CC2)sc2c1CCC2,C55915464_decoy,TRY1,Decoy,0,-10.1178,-7.25,-0.7,-6.676205767423603
Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1,C56159741_decoy,TRY1,Decoy,0,-7.72038,-7.77,-1.75,-6.886552206731637
Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(C)c1,C56159749_decoy,TRY1,Decoy,0,-7.01315,-7.43,-2.11,-5.839133112234654
C[C@@H]([NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1ccccc1F,C56159858_decoy,TRY1,Decoy,0,-7.33959,-7.0,-2.32,-6.584664785902852
NC(=O)c1cc2cc(Br)cc(Br)c2o/c1=[NH+]\c1ccc(S(N)(=O)=O)cc1,C59170357_decoy,TRY1,Decoy,0,-8.4264,-5.48,-3.25,-4.7566473867306005
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1,C60095045_decoy,TRY1,Decoy,0,-9.15204,-6.62,-1.92,-7.899078475427378
COCC[NH+](C)CCNS(=O)(=O)c1cc(Br)cnc1NN,C61399738_decoy,TRY1,Decoy,0,-8.09833,-4.57,-1.33,-5.095316755174817
O=C(NNC(=S)NC1CCCC1)NC1CC[NH+](CC2CCCCC2)CC1,C62529474_decoy,TRY1,Decoy,0,-9.05206,-6.19,-0.87,-6.687998365016443
NC(=O)N[C@H](CC(=O)NCCC1=c2ccccc2=[NH+]C1)c1ccc(Cl)cc1,C63122557_decoy,TRY1,Decoy,0,-8.27,-8.01,-1.51,-6.394331076912724
CC(=O)Nc1ccccc1OC[C@@H]1NO[C@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1,C63808361_decoy,TRY1,Decoy,0,-8.1052,-7.66,-1.39,-6.388074099747553
O=C(NCCCO)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O,C64380700_decoy,TRY1,Decoy,0,-8.72092,-5.32,-1.7,-5.93558838811495
Oc1ccc(NC(=S)/[NH+]=N/c2c(O)[nH]c3ccc(Br)cc23)cc1,C05593609_decoy,TRY1,Decoy,0,-8.89639,-5.14,-0.16,-4.544838946155486
CC(=O)Nc1ccccc1NC(=O)C[NH2+][C@@H](C)C12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2,C65380341_decoy,TRY1,Decoy,0,-8.88967,-7.38,-2.99,-7.395130983085355
CCCC[NH+]1Cc2cccc(N[C@@H](C)C(=O)Nc3sccc3C(N)=O)c2C1,C66967260_decoy,TRY1,Decoy,0,-8.35635,-7.32,-1.78,-6.543636309515149
Cc1ccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1C(N)=O,C67491578_decoy,TRY1,Decoy,0,-8.76707,-6.52,-2.7,-5.989225005451913
[H]/N=C1C(=N\Nc2c(Cl)cc(Cl)cc2Cl)\C(=[NH2+])NN\1c1ccccc1,C04477459_decoy,TRY1,Decoy,0,-7.59497,-6.73,-2.78,-5.07464048378604
Cc1ccc2[nH]c3c(cc(NCC[NH3+])c4c(=O)c5ccccc5c(=O)c43)oc2c1,C04188940_decoy,TRY1,Decoy,0,-9.40433,-6.29,-0.78,-6.338264447718895
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H]([C@@H](C)O)C[C@@H]1C(=O)Nc1ccc(F)cc1)C(=O)N2,C05450921_decoy,TRY1,Decoy,0,-7.44892,-7.01,-2.43,-5.671820136673273
C/C(=N\NC(=O)c1[nH+]c(Cl)c(Cl)c(N)c1Cl)c1cc(F)ccc1O,C06683794_decoy,TRY1,Decoy,0,-10.479,-6.88,-1.92,-6.256205835878956
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(CC)CC)cc3)c2C(=O)NC(N)=O)C1,C08920736_decoy,TRY1,Decoy,0,-9.28735,-6.06,-3.34,-6.400171675732306
CCCCCCn1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09311964_decoy,TRY1,Decoy,0,-7.60421,-6.69,-3.57,-5.981925347894046
OCC(CO)(CO)[NH2+]C[C@@H](O)Cn1c2c(c3cccc(Cl)c31)CCCC2,C12421988_decoy,TRY1,Decoy,0,-7.82108,-6.81,-1.69,-5.887891926944038
Cc1cc(C)c2c(c1)[C@]1([NH2+][C@H](CCC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12885345_decoy,TRY1,Decoy,0,-9.01937,-6.05,-2.6,-5.220970159982745
CCc1ccc(-n2c(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c(=O)[nH]c2=S)cc1,C05625533_decoy,TRY1,Decoy,0,-7.63555,-7.01,-2.1,-6.0220460577687
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3cccc(Cl)c3)C[NH+]12)NCc1cccs1,C15708005_decoy,TRY1,Decoy,0,-9.42713,-7.89,-2.85,-8.369052272237726
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccsc1,C20465311_decoy,TRY1,Decoy,0,-6.67652,-6.19,-1.74,-5.042604103476832
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(N4CCOCC4)nc3)C[NH+]12,C15708480_decoy,TRY1,Decoy,0,-9.13813,-6.88,-2.56,-7.679800101132192
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)NCC(=O)Nc3ccc(F)c(F)c3)sc2[nH+]1,C22313502_decoy,TRY1,Decoy,0,-10.0394,-8.42,-0.61,-15.137782980982758
CCC[C@H]1C[C@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C24987189_decoy,TRY1,Decoy,0,-7.15253,-5.68,-1.84,-5.637777682663957
CCCCCCOc1cccc(O)c1-c1cc(C2CC[NH2+]CC2)c(C#N)c(N)n1,C28347051_decoy,TRY1,Decoy,0,-9.53404,-7.42,-1.05,-8.447584202331953
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC(=O)NCC(F)(F)F)cc1,C30499333_decoy,TRY1,Decoy,0,-6.14339,-6.45,-0.84,-5.007412813382954
Cc1ccc(S(=O)(=O)c2cnc(N3CCC(C(N)=O)([NH+]4CCCCC4)CC3)nc2N)cc1C,C33301923_decoy,TRY1,Decoy,0,-8.21661,-5.71,-1.75,-4.855956952193842
[NH3+]/C(=C/Sc1ncc(C(F)(F)F)cc1Cl)NNC(=O)c1ccncc1,C20219079_decoy,TRY1,Decoy,0,-7.99372,-5.91,-3.46,-5.0344237753206
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H]([C@@H](C)O)[NH2+][C@]12C(=O)Nc1ccc(Cl)cc12,C35828160_decoy,TRY1,Decoy,0,-7.09726,-5.82,-0.77,-4.580030448114443
[NH3+]CC(=O)NCC(=O)Nc1cc(Cl)cc(Br)c1OC(F)F,C37628102_decoy,TRY1,Decoy,0,-7.841,-5.38,-1.32,-5.565013935875848
COc1ccc(N2N[NH2+]N[C@H]2SCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccc(F)cc2)cc1,C39210614_decoy,TRY1,Decoy,0,-8.57007,-7.48,-2.59,-6.85259340274297
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39684241_decoy,TRY1,Decoy,0,-9.40618,-6.63,-3.27,-6.576248803641223
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1ncc(C(F)(F)F)cc1Cl,C40757666_decoy,TRY1,Decoy,0,-7.08149,-6.12,-3.6,-4.720616149569289
Nc1c(Nc2ncc(C(F)(F)F)cc2Cl)nc[nH+]c1Nc1cccnc1,C40759892_decoy,TRY1,Decoy,0,-7.52821,-7.72,-1.49,-6.446871995196415
CC(=O)c1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40782852_decoy,TRY1,Decoy,0,-9.07294,-0.93,-3.13,-3.390640121932877
Cc1ccc2c(Nc3ncnc(NCc4ccccc4Cl)c3N)cccc2[nH+]1,C40801445_decoy,TRY1,Decoy,0,-7.91008,-6.48,-2.39,-5.25639359390552
NC(=O)N[C@@H](CC(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1)c1cccs1,C41953282_decoy,TRY1,Decoy,0,-8.97204,-6.95,-2.91,-8.290726489508154
C[NH+]1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCCCC(N)=O)CC1,C42044406_decoy,TRY1,Decoy,0,-8.73098,-5.42,-1.26,-5.595146547713148
C[C@@H](O)[C@H]([NH3+])c1nc(C(=O)Nc2ccc(I)cc2)co1,C43216954_decoy,TRY1,Decoy,0,-8.88656,-7.23,-2.93,-8.128692439262585
CC1(C)[C@@H]2CC[C@H](CNC(=O)c3coc([C@@H]([NH3+])Cc4ccc(O)cc4)n3)[C@H]1C2,C43217510_decoy,TRY1,Decoy,0,-9.03583,-8.3,-4.54,-6.273092040375798
C[C@@H]1[C@@H](NC(=O)c2coc([C@@H]([NH3+])Cc3ccc(O)cc3)n2)C[C@H]2C[C@@H]1C2(C)C,C43217927_decoy,TRY1,Decoy,0,-8.89271,-5.85,-2.86,-6.037964049587522
Cc1ccccc1NC(=O)NNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C43231296_decoy,TRY1,Decoy,0,-8.92772,-8.05,-1.29,-7.427020913953748
NC(=O)C[C@H]([NH3+])c1cc([N+](=O)[O-])ccc1Sc1ccc(C(F)(F)F)cn1,C44254678_decoy,TRY1,Decoy,0,-7.77268,-5.59,-1.94,-7.063376405118623
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CC[NH+](C3CC3)CC2)nc1,C45410066_decoy,TRY1,Decoy,0,-8.67475,-6.49,-3.53,-5.456346307467258
NC(=O)c1c(NC(=O)C[NH+]2CCC[C@@H](C(=O)NC3CC3)C2)sc2c1CCC2,C51047842_decoy,TRY1,Decoy,0,-10.0446,-6.48,-1.95,-7.728065162129332
CCC[C@@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51054704_decoy,TRY1,Decoy,0,-7.03957,-7.43,-1.76,-8.542790315691747
CNC(=[NH2+])c1cc(C)c2nc([C@@H]3C(=O)N=CC=C3NC[C@H](O)c3cccc(Cl)c3)[nH]c2c1,C52634761_decoy,TRY1,Decoy,0,-9.82616,-6.55,-1.66,-7.089760493382819
Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(C)c1,C56159748_decoy,TRY1,Decoy,0,-8.65045,-7.45,-2.8,-7.200627572393729
C[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1F)c1ccc(NC(=O)NC2CC2)cc1,C56159857_decoy,TRY1,Decoy,0,-7.14125,-7.31,-2.6,-5.553519893081142
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1,C60095044_decoy,TRY1,Decoy,0,-8.22353,-6.81,-3.47,-5.52040912644566
NC(=O)N[C@@H](CC(=O)NCCC1=c2ccccc2=[NH+]C1)c1ccc(Cl)cc1,C63122556_decoy,TRY1,Decoy,0,-7.98705,-7.62,-1.85,-7.374565477409609
O=C(NCCCO)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O,C64380699_decoy,TRY1,Decoy,0,-7.43688,-6.31,-0.67,-7.143035854336134
Cc1ccc(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cc1C(N)=O,C67491577_decoy,TRY1,Decoy,0,-8.16368,-6.78,-1.68,-7.483176074162018
[H]/N=C1C(=N\Nc2ccc(Cl)c(C(F)(F)F)c2)\C(=[NH2+])NN\1c1ccccc1,C04477474_decoy,TRY1,Decoy,0,-7.40138,-8.25,-3.95,-5.4381206013466326
CC(=O)c1cc2c(N)c(C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)sc2nc1C,C03253478_decoy,TRY1,Decoy,0,-7.84846,-5.11,-1.52,-4.072237273495393
C[C@]1(CO)[C@H]2Cc3sc(N)nc3[C@@H](CC(=O)NCC[NH+]3CCOCC3)[C@]2(C)CC[C@H]1O,C03842075_decoy,TRY1,Decoy,0,-9.20678,-6.05,-2.04,-6.08256595937154
N#Cc1c(CCCCC[NH2+]Cc2c[nH]nc2-c2ccc(Cl)cc2)n[nH]c1N,C09378443_decoy,TRY1,Decoy,0,-7.0084,-5.79,-3.41,-5.709246493046511
COc1ccc(OC)c(-n2c(=S)[nH]c(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)c1,C02149095_decoy,TRY1,Decoy,0,-7.94643,-5.88,-1.25,-5.136934269432013
C[NH2+][C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2cc/c(=N\Cc3cnc(C)c(N)c3OC)c(O)cc21,C09185077_decoy,TRY1,Decoy,0,-8.96066,-7.56,-2.17,-7.067320392598027
Cn1c(=O)c2c(nc(N3CCOCC3)n2CCC[NH2+]C[C@@H](O)c2ccc(O)c(O)c2)n(C)c1=O,C13207398_decoy,TRY1,Decoy,0,-8.57792,-8.77,-0.67,-7.184837177465488
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(Cl)cc3)C[NH+]12,C15708477_decoy,TRY1,Decoy,0,-8.7824,-5.83,-2.45,-6.516452722996723
Cc1ccc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c(C)c1,C14156507_decoy,TRY1,Decoy,0,-9.26684,-8.65,-2.24,-10.304356705567924
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(Cl)cc2Cl)NCCc2c[nH]c[nH+]2)n1,C14156516_decoy,TRY1,Decoy,0,-11.2126,-6.98,-2.71,-7.274260590200673
Oc1ccccc1OCC[NH2+]C[C@H](O)COc1cccc2[nH]c3ccccc3c12,C02528486_decoy,TRY1,Decoy,0,-7.26005,-7.96,-1.25,-7.361865484303864
COc1ccccc1NC(=O)C1CC[NH+]([C@H](C)C(=O)Nc2sccc2C(N)=O)CC1,C29907662_decoy,TRY1,Decoy,0,-7.49626,-6.9,-2.29,-7.184051697931915
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)O)[NH+](C)C1,C31357046_decoy,TRY1,Decoy,0,-8.08674,-7.44,-2.56,-6.890858684679801
CC[NH+]1CCc2c(sc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2C(N)=O)C1,C32579207_decoy,TRY1,Decoy,0,-8.81473,-4.93,-1.87,-5.173134209057828
C[NH+](C)CCCNc1cc(NCCO)c(N)c2c1C(=O)c1ccccc1C2=O,C06664701_decoy,TRY1,Decoy,0,-7.10858,-6.11,-1.03,-5.297065081810136
CCC[C@H]1C[C@@H](C(=O)N[C@H](CC)[C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[NH+](C)C1,C38337198_decoy,TRY1,Decoy,0,-7.10822,-4.74,-2.21,-4.779261140654124
[H]/N=C1\N/C(=C\CNC(=O)/C(Cc2cc(Br)c(OC)c(Br)c2)=N\O)C=[NH+]1,C39446141_decoy,TRY1,Decoy,0,-9.56841,-7.77,-1.16,-15.644232125428564
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39597928_decoy,TRY1,Decoy,0,-9.18687,-8.78,-3.56,-6.865901427173676
CC1=C[C@H](C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)NN1C,C39597973_decoy,TRY1,Decoy,0,-9.62672,-7.04,-2.14,-6.544915566291319
CC1=C(C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39671586_decoy,TRY1,Decoy,0,-8.19459,-6.39,-1.33,-5.873272494270675
CC1=C(C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39671587_decoy,TRY1,Decoy,0,-8.10733,-6.63,-1.37,-6.42615864157037
CC1=C(C(=O)N2C[C@@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39671588_decoy,TRY1,Decoy,0,-9.03778,-7.24,-1.98,-6.557076997529545
CC1=C(C(=O)N2C[C@@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39671589_decoy,TRY1,Decoy,0,-8.40039,-6.57,-2.18,-5.395276411138642
CC1(C)Cc2c(sc(NC(=O)C[NH+]3CCN(CCO)CC3)c2C(N)=O)CO1,C40287690_decoy,TRY1,Decoy,0,-9.22967,-7.15,-2.09,-6.179858609942091
Cc1ccc(COc2ccc(Br)cc2C[NH2+]CCNC(=O)c2nonc2N)cc1,C40744379_decoy,TRY1,Decoy,0,-9.58056,-8.37,-2.14,-8.58626464257839
COc1ccc(CNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40753756_decoy,TRY1,Decoy,0,-7.19292,-5.92,-3.33,-4.940325946300905
Cc1ccc(C(=O)NNc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40784250_decoy,TRY1,Decoy,0,-7.97623,-7.75,-2.66,-6.920527751697632
NC(=O)N[C@@H](CC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1)c1cccs1,C41953288_decoy,TRY1,Decoy,0,-9.82963,-6.0,-2.11,-7.284752985802033
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3C#CCCO)cc12,C45354506_decoy,TRY1,Decoy,0,-10.0474,-7.85,-2.66,-7.876374598479695
C[C@@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2,C45355890_decoy,TRY1,Decoy,0,-10.0983,-7.48,-2.51,-7.593938255454508
CC1(C)CC(NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC(C)(C)[NH2+]1,C45860797_decoy,TRY1,Decoy,0,-7.72116,-6.19,-2.92,-5.984796643650576
Cc1c(Cl)cccc1NNC(=O)NCc1cccc(NC(=O)C[NH+](C)C)c1,C46302270_decoy,TRY1,Decoy,0,-9.28235,-6.97,-2.13,-6.982724960865577
CCCNC(=O)C[NH+]1CCC(NC(=O)NNC(=S)NC2CCCC2)CC1,C46869535_decoy,TRY1,Decoy,0,-8.03566,-6.42,-2.57,-7.033387122940531
Cc1ccccc1NC(=O)NNC(=O)NCC1([NH+]2CCSCC2)CCCC1,C47008991_decoy,TRY1,Decoy,0,-8.37387,-6.91,-0.71,-6.388960558265089
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1cccs1,C48743408_decoy,TRY1,Decoy,0,-10.0168,-6.66,-2.94,-7.27080205111988
C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1,C60095046_decoy,TRY1,Decoy,0,-9.0712,-5.26,-2.43,-6.197804818643761
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@@H](O)N1Cc1ccccc1,C64227795_decoy,TRY1,Decoy,0,-7.67069,-7.07,-2.23,-5.773085128895171
NC(=O)c1ccsc1NC(=O)CCC(=O)NCCC1=c2ccccc2=[NH+]C1,C64719878_decoy,TRY1,Decoy,0,-8.14848,-6.98,-2.86,-5.815537743777499
CS(=O)(=O)c1ccc(NCCN/C(N)=[NH+]/Cc2ccco2)c([N+](=O)[O-])c1,C66244510_decoy,TRY1,Decoy,0,-7.1447,-6.01,-2.42,-5.151855656826102
CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCC[NH+](CC(N)=O)C2)cc(C)c1C,C66451871_decoy,TRY1,Decoy,0,-7.69545,-6.14,-5.03,-5.248893735812596
NC(=O)C[NH+](CC(N)=O)Cc1nc(Cc2cccc(Br)c2)no1,C67379645_decoy,TRY1,Decoy,0,-8.29612,-6.86,-0.73,-5.9124343938729895
Cc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@H](C)C2)cc1C(N)=O,C67534418_decoy,TRY1,Decoy,0,-9.4522,-8.42,-1.33,-7.145387351023
Cc1cc(CNC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c2[nH]c(C)c(C)c2c1,C67638554_decoy,TRY1,Decoy,0,-8.6118,-7.01,-1.93,-6.413521740817769
Nc1nonc1C(=[NH2+])N/N=C/c1cc(Br)cc(Br)c1O,C03155828_decoy,TRY1,Decoy,0,-9.28557,-7.11,-0.5,-8.931059585860929
Cc1[nH]c(=O)nc(NCC[NH2+]CCO)c1C(=O)Nc1cccc2cc3ccccc3cc12,C01647200_decoy,TRY1,Decoy,0,-8.25954,-6.22,-2.73,-5.545882728327447
Cc1c(O)c(C=O)c2nc3c(O)ccc(C(=O)NCC[NH+](C)C)c3nc2c1O,C05663666_decoy,TRY1,Decoy,0,-7.4311,-6.23,-1.81,-5.427504494960747
O=C1c2cccc(O)c2C(=O)c2c(OC[C@@H](O)C[NH+](CCO)CCO)cccc21,C05663815_decoy,TRY1,Decoy,0,-7.78475,-7.54,-3.08,-9.340969769698637
CCCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c(=O)[nH]c1=O,C05897997_decoy,TRY1,Decoy,0,-7.36241,-6.93,-0.94,-5.450907466567776
C[NH+](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)CC(=O)Nc1ccc(F)c(F)c1F,C07987953_decoy,TRY1,Decoy,0,-8.84915,-8.43,-0.72,-7.067500964084283
COc1ccccc1Nc1nc(NCC[NH+]2CCOCC2)nc(N)c1[N+](=O)[O-],C09191220_decoy,TRY1,Decoy,0,-6.73246,-6.61,-0.31,-8.402140727304143
CCCCn1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c1=O,C09320823_decoy,TRY1,Decoy,0,-6.83321,-5.8,-3.2,-5.499159441578609
Cn1c(=O)c2c(ncn2CCC[NH2+]C[C@H](O)c2ccc(O)c(O)c2)n(C)c1=O,C13161687_decoy,TRY1,Decoy,0,-7.43695,-8.45,-2.61,-7.118392829301703
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccccc3)C[NH+]12,C15708443_decoy,TRY1,Decoy,0,-7.26425,-4.38,-2.9,-5.507131304282966
CC(C)[NH+]1CCN(c2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C04256218_decoy,TRY1,Decoy,0,-6.29177,-6.16,-1.69,-4.605064566333694
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3OC[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19325245_decoy,TRY1,Decoy,0,-8.34647,-4.47,-3.79,-4.915894462132907
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3OC[C@H](O)[C@@H](O)[C@H](O)CO)C2=O,C19325251_decoy,TRY1,Decoy,0,-8.77499,-6.35,-2.34,-6.786655125451872
C[C@]12CN3C[C@](c4ccccc4)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19327385_decoy,TRY1,Decoy,0,-8.96753,-7.01,-1.39,-6.437478235894755
Cc1csc(CC(=O)NNC(=O)C[NH+]2Cc3ccccc3C[C@H]2C(N)=O)n1,C21672070_decoy,TRY1,Decoy,0,-9.32359,-7.16,-1.43,-6.280240507161801
CN1C(=O)[C@H]2[C@@H](c3cc(Cl)ccc3O)[NH2+][C@@](CCCC[NH3+])(C(=O)[O-])[C@@H]2C1=O,C34387438_decoy,TRY1,Decoy,0,-8.74632,-7.81,-2.23,-8.371430946298572
Cc1sc2[nH]c(C[NH+]3CCN(CC(=O)Nc4sccc4C(N)=O)CC3)nc(=O)c2c1C,C22247168_decoy,TRY1,Decoy,0,-8.86391,-7.07,-2.5,-7.204643616824091
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C35644877_decoy,TRY1,Decoy,0,-6.98422,-6.06,-2.06,-5.28504161152004
Nc1ncnc2c1nc(NCC[NH3+])n2[C@@H]1O[C@@H]2CO[P@@](O)(=S)O[C@H]2[C@H]1O,C38580920_decoy,TRY1,Decoy,0,-7.489,-8.04,-0.95,-7.622586205630982
Cc1cc(C)nc(N/C(=N/C(=O)CS[C@H]2N[NH2+]NN2C)NCCc2c[nH]c3ccc(Cl)cc23)n1,C39313499_decoy,TRY1,Decoy,0,-11.297,-9.34,-2.22,-11.168477856907874
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)Nc1ccc(N2N=N[C@@H](C(=O)N3CCOCC3)[C@@H]2[NH3+])cc1,C39337584_decoy,TRY1,Decoy,0,-6.92715,-7.93,-3.2,-6.330866631192782
C[C@@H]1CN(C[C@@H]2N[NH2+]NN2CC(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)C[C@H](C)O1,C39442654_decoy,TRY1,Decoy,0,-7.32953,-7.96,-1.42,-5.966390757010745
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@H](c2cc(C)on2)ON1,C39597833_decoy,TRY1,Decoy,0,-8.62295,-8.56,-2.69,-9.584508680616173
CC1=C[C@H](C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)NN1C,C39656243_decoy,TRY1,Decoy,0,-7.39391,-7.6,-2.37,-5.801784679162269
Cc1ccc(C2=NN(C3=NNC([NH3+])=Cc4nncn43)[C@](O)(C(F)(F)F)C2)cc1,C15226870_decoy,TRY1,Decoy,0,-9.48384,-6.98,-0.58,-5.715008817793738
COc1ccc([C@H](CNc2n[nH+]c(C)c(=O)n2N)c2c[nH]c3ccccc23)cc1,C06603008_decoy,TRY1,Decoy,0,-7.45002,-7.81,-3.87,-7.646392977921638
CCCOc1c(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1Cl,C40744423_decoy,TRY1,Decoy,0,-7.78095,-6.88,-1.21,-7.207945868841161
C[NH+]1CCN(Nc2ncnc(Nc3ccc(OC(F)(F)F)cc3)c2N)CC1,C40757021_decoy,TRY1,Decoy,0,-7.06613,-6.28,-2.39,-5.252338269639161
Cc1ccc(S(=O)(=O)NNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40760833_decoy,TRY1,Decoy,0,-8.47455,-6.56,-1.98,-5.517594475058334
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(N)=O)CCC2,C40824414_decoy,TRY1,Decoy,0,-7.97535,-5.73,-1.19,-5.887038078163872
C[C@H]1CCc2noc(Nc3nc(NCC[NH2+]CCO)nc(N)c3[N+](=O)[O-])c2C1,C41301438_decoy,TRY1,Decoy,0,-7.5577,-6.79,-0.52,-8.50848312717111
Cc1cc(Nc2nc(NCC[NH2+]CCO)nc3c2cnn3-c2ccccc2)no1,C41333182_decoy,TRY1,Decoy,0,-8.28833,-5.7,-1.03,-5.68306812639793
NC(=O)C[C@H]([NH3+])c1cc([N+](=O)[O-])ccc1OCc1cc(Cl)cc2c1OCOC2,C44253655_decoy,TRY1,Decoy,0,-7.2714,-5.91,-1.16,-5.200113371458418
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(OCC[NH2+]C)cc21,C49088379_decoy,TRY1,Decoy,0,-8.41965,-4.42,-3.34,-5.248947791675645
COc1ccc(Cl)cc1NC(=[NH2+])Nc1nc(CSc2nnc(C)s2)cc(=O)[nH]1,C10156491_decoy,TRY1,Decoy,0,-9.3702,-6.09,-2.83,-6.17149928436252
CC1(C)CC(NC(=O)NNC(=O)c2nnc(-c3ccccc3)o2)CC(C)(C)[NH2+]1,C56541167_decoy,TRY1,Decoy,0,-7.64887,-6.43,-0.75,-5.945077606815975
CCNC(=S)N/C(=N\c1nc(C)cc(C)n1)N1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C14161184_decoy,TRY1,Decoy,0,-8.61627,-7.57,-3.31,-8.804308338965624
C[C@]1(CCc2ccc(O)cc2)NC(N)=Nc2[nH+]c3cc4c(cc3n21)OCCCO4,C61385855_decoy,TRY1,Decoy,0,-7.77664,-8.46,-1.46,-5.061808494409388
NC(=O)[C@H]1Oc2ccccc2[C@H]1NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1,C63710340_decoy,TRY1,Decoy,0,-7.67078,-8.91,-3.5,-7.544389448899137
O=C(C[C@H]1NO[C@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63795094_decoy,TRY1,Decoy,0,-8.1165,-6.24,-2.17,-5.440159906518832
C[C@H]1[C@H](C[NH2+]CCc2n[nH]c(-c3ccncc3)n2)c2ccccc2N1CC(N)=O,C63848244_decoy,TRY1,Decoy,0,-7.90331,-7.55,-1.55,-5.77141715025625
Cc1c[nH]c(=O)n1-c1ccc(C(=O)NNC(=O)NCCCn2cc[nH+]c2)cc1,C64885809_decoy,TRY1,Decoy,0,-6.48697,-6.56,-2.16,-5.092774385768902
C[NH+](CCNC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12)Cc1ccccc1,C65541648_decoy,TRY1,Decoy,0,-7.62581,-7.5,-2.62,-6.11993069158466
Nc1nc2c(nc(I)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C04159868_decoy,TRY1,Decoy,0,-7.03013,-7.26,-2.28,-7.221346099868475
C[C@@]12C[C@@H](O)[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)C[C@@H](O)[C@]34CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C04974278_decoy,TRY1,Decoy,0,-9.77119,-6.49,-2.0,-6.249304419054028
C=CCSc1nc2c(=O)[nH]c(N)nc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05052832_decoy,TRY1,Decoy,0,-7.75701,-7.78,-1.83,-9.261197415588953
[NH3+][C@@H]1[C@@H](O)[C@H](O)O[C@H](CN2c3ccccc3Sc3ccccc32)[C@H]1O,C05660792_decoy,TRY1,Decoy,0,-7.8528,-5.78,-1.3,-4.652090453086702
Nc1nc(N)nc(SCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)n1,C09882564_decoy,TRY1,Decoy,0,-8.27327,-6.6,-1.21,-6.310227591593459
Nc1nc(N)nc(SCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)n1,C09882566_decoy,TRY1,Decoy,0,-8.55569,-7.67,-1.8,-10.344134119723927
Nc1ncnc2c1nc(NCc1ccco1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08986173_decoy,TRY1,Decoy,0,-7.20873,-7.41,-1.34,-9.329192825971411
CSc1c(C(N)=O)c2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04824945_decoy,TRY1,Decoy,0,-5.82979,-5.06,-1.55,-4.257893570543207
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c12,C13132547_decoy,TRY1,Decoy,0,-7.84969,-7.13,-2.55,-6.070149965606657
Nc1ncnc2c1nc(N/N=C/c1ccccc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740542_decoy,TRY1,Decoy,0,-6.55605,-8.16,-1.26,-7.979106470593781
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N\Nc1nnc2c(n1)[nH]c1ccccc12,C15775232_decoy,TRY1,Decoy,0,-7.33557,-6.45,-2.51,-6.460136404847601
OC[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N\Nc1nnc2c(n1)[nH]c1ccccc12,C15775234_decoy,TRY1,Decoy,0,-7.61842,-9.04,-2.66,-7.369808400167098
OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N\Nc1nnc2c(n1)[nH]c1ccccc12,C15775236_decoy,TRY1,Decoy,0,-7.9443,-7.65,-1.53,-8.463968760878211
OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775382_decoy,TRY1,Decoy,0,-7.73267,-7.66,-3.94,-7.040578244831787
Cn1c(N)c(C(c2ccc(Cl)cc2)c2c(N)n(C)c(=S)[nH]c2=O)c(=O)[nH]c1=S,C20607387_decoy,TRY1,Decoy,0,-7.63576,-5.33,-2.09,-4.295322650655299
O=c1c(-c2ccc(O)cc2)coc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C25763620_decoy,TRY1,Decoy,0,-8.21774,-9.2,-3.14,-8.561206969591376
CC(C)(O)[C@@H](O)Cc1cc(O)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159727_decoy,TRY1,Decoy,0,-7.28877,-7.5,-2.29,-8.281790313269562
CC(C)(O)[C@@H](O)Cc1cc(O)ccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159735_decoy,TRY1,Decoy,0,-8.60091,-7.88,-1.24,-11.023076009939931
COc1cc([C@@H](CO)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31169446_decoy,TRY1,Decoy,0,-7.32472,-6.26,-2.52,-5.304830148349235
COc1cc([C@H](CO)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31169449_decoy,TRY1,Decoy,0,-7.07654,-6.39,-3.08,-5.309537740059518
Nc1nc(=O)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2nc(I)[nH]c12,C17025571_decoy,TRY1,Decoy,0,-7.52918,-4.69,-1.48,-3.829953027096349
CSc1nc2c(nc(N)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=O)n1C,C17194169_decoy,TRY1,Decoy,0,-7.09237,-4.51,-2.56,-4.449660683631075
Nc1n[nH]c(=O)c2c1c(Br)cn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C17196558_decoy,TRY1,Decoy,0,-6.23197,-6.45,-0.53,-4.558182630642415
COC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)C1,C35465645_decoy,TRY1,Decoy,0,-8.73094,-5.99,-1.68,-5.750224951843763
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C(=O)[C@@H]3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3C[C@@H]12,C37868227_decoy,TRY1,Decoy,0,-8.80507,-7.99,-1.23,-5.205491727203982
CC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](CO)[C@@H](O)C[C@H]12,C31156618_decoy,TRY1,Decoy,0,-6.77558,-6.61,-1.65,-5.398633664245368
O=C(N/N=C/c1ccc(O)cc1O)C(=O)N/N=C/c1ccc(O)cc1O,C01684672_decoy,TRY1,Decoy,0,-8.65661,-9.2,-1.53,-10.800544950765325
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C33957283_decoy,TRY1,Decoy,0,-7.13083,-5.81,-3.24,-5.127844933147085
NC(=O)CS[C@H]1NN[C@H]([C@H]2C=C(c3ccc(Cl)cc3)N=N2)N1N,C38999325_decoy,TRY1,Decoy,0,-8.65746,-6.03,-1.01,-6.719350804442245
Cc1cc(C)c2[nH+]c3sc(C(=O)Nc4c(C)[nH]c(=O)[nH]c4=O)c(N)c3cc2c1,C04848763_decoy,TRY1,Decoy,0,-8.78511,-5.9,-1.15,-5.054493451296225
C[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)cc1,C42959830_decoy,TRY1,Decoy,0,-9.53797,-7.19,-4.08,-8.118481521423325
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1cccc(Br)c1,C43025223_decoy,TRY1,Decoy,0,-8.70965,-7.31,-2.05,-7.774277241677261
CC[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)s1,C43284233_decoy,TRY1,Decoy,0,-8.40617,-6.25,-0.86,-5.503583277464467
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cc(Br)cs1,C43291183_decoy,TRY1,Decoy,0,-9.25433,-6.62,-2.61,-7.940504748213316
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@H]3C(=O)c4c(O)cccc4[C@](C)(O)[C@@H]3C[C@@H]12,C43620480_decoy,TRY1,Decoy,0,-6.99108,-6.2,-1.87,-4.879383180330884
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@@H]3C(=O)c4c(O)cccc4[C@](C)(O)[C@@H]3C[C@H]12,C43620481_decoy,TRY1,Decoy,0,-9.17423,-7.34,-1.63,-6.252853058584138
C[C@@]12C[C@H](O)[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)C[C@@H](O)[C@]34CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43758872_decoy,TRY1,Decoy,0,-9.00322,-5.79,-1.37,-5.058453084096365
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C33957284_decoy,TRY1,Decoy,0,-7.82077,-8.73,-1.03,-7.455765166072655
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C(=O)[C@@H]3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@H]12,C43875528_decoy,TRY1,Decoy,0,-7.43308,-8.17,-4.57,-5.395556328876508
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@@H]3C(=O)c4c(O)ccc(N)c4C[C@H]3C[C@H]12,C44699256_decoy,TRY1,Decoy,0,-7.02564,-6.94,-2.53,-5.007294128648525
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C(=O)[C@@H]3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3C[C@H]12,C44699813_decoy,TRY1,Decoy,0,-9.33589,-7.51,-2.57,-5.722784523490204
CC1(C)CC(NC(=O)C(=O)Nc2sccc2C(N)=O)CC(C)(C)[NH2+]1,C47962646_decoy,TRY1,Decoy,0,-7.47758,-6.03,-1.89,-5.514936461707321
NNc1ncc(Br)cc1C(=O)NCCCS(N)(=O)=O,C51095212_decoy,TRY1,Decoy,0,-8.9215,-6.16,-1.74,-8.903747175142264
Nn1c(N/[NH+]=C/c2ccccc2[O-])nnc1N/[NH+]=C/c1ccccc1[O-],C16449063_decoy,TRY1,Decoy,0,-7.05985,-8.61,-1.61,-9.610946514554673
Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c1C2=O,C05412534_decoy,TRY1,Decoy,0,-6.61549,-6.11,-2.48,-4.380866888593565
NC1=[NH+]C(=S)N=C([O-])[C@H]1C(c1ccccc1Cl)[C@H]1C([O-])=NC(=S)[NH+]=C1N,C63598705_decoy,TRY1,Decoy,0,-5.19303,-4.84,0.11,-3.794404213527487
NC1=NC(=O)NC(=O)[C@@H]1[C@@H](c1ccc(F)cc1)c1c(N)[nH]c(=O)[nH]c1=O,C64117742_decoy,TRY1,Decoy,0,-5.30119,-4.57,-2.66,-3.057520337502761
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2cccs2)=N[C@@H]2NC(=O)N[C@@H](O)[C@H]12,C64480248_decoy,TRY1,Decoy,0,-6.37995,-5.2,-1.47,-4.054266426398462
C[NH+](C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(ccc(N)c4O)C[C@H]3C[C@H]12,C40163483_decoy,TRY1,Decoy,0,-8.15064,-0.69,-3.26,-3.02661367220825
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(ccc(N)c4O)C[C@H]3C[C@H]12,C29547083_decoy,TRY1,Decoy,0,-8.5773,-6.32,-1.37,-6.543876234545673
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCOC)c1ccc(N(C)C)cc1,C06135415_decoy,TRY1,Decoy,0,-8.42716,-5.79,-3.02,-6.798791507042765
Cc1cc(=O)oc2cc(O[P@](=O)([O-])OC3(C)[C@](C)(O)[C@@](C)(O)C(C)(O)[C@@](C)(O)[C@@]3(C)O)ccc12,C09970418_decoy,TRY1,Decoy,0,-7.32935,-8.42,-3.52,-7.056663548560999
O=C([O-])[C@@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C12153631_decoy,TRY1,Decoy,0,-7.42808,-6.6,-3.02,-5.646847971150677
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1,C06280322_decoy,TRY1,Decoy,0,-8.19128,-6.25,-5.31,-7.225909604130166
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C12476998_decoy,TRY1,Decoy,0,-8.49876,-7.9,-2.54,-10.631756002306238
O=C([O-])c1[nH]nc(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C12656499_decoy,TRY1,Decoy,0,-8.9277,-7.4,-3.24,-5.523358979002959
COC1=C(Br)[C@@H](O)[C@]2(C=C1Br)CC(C(=O)NCCCc1cnc(N)[nH]1)=NO2,C13308561_decoy,TRY1,Decoy,0,-10.1539,-8.41,-2.41,-8.046705563164453
O=[P@@]([O-])(Oc1c[nH]c2cc(Cl)c(Br)cc12)OC1[C@@H](O)[C@@H](O)C(O)[C@@H](O)[C@H]1O,C15206035_decoy,TRY1,Decoy,0,-8.97115,-6.19,-2.42,-5.432440534399943
O=c1[nH]c2ccccc2nc1/C(=N\Nc1ccc(I)cc1)[C@@H](O)[C@H](O)CO,C15774856_decoy,TRY1,Decoy,0,-7.52314,-8.43,-2.01,-7.775434238311155
C[C@@H](Sc1nnc(-c2ccc(Cl)cc2Cl)n1N)C(=O)Nc1sccc1C(N)=O,C16067623_decoy,TRY1,Decoy,0,-9.26768,-8.25,-1.39,-7.073598929658096
Nc1nc(SCc2cc([N+](=O)[O-])ccc2[O-])c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1,C29059342_decoy,TRY1,Decoy,0,-6.37316,-7.97,-2.59,-6.053365597847742
Nc1ccc(C(=O)N/C(=C/c2ccc3c(c2)OCO3)c2nc3c([O-])[nH]c(=S)nc3[nH]2)cc1,C17190694_decoy,TRY1,Decoy,0,-9.1361,-9.96,-1.68,-8.43914768428877
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3ccc(Cl)s3)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33736105_decoy,TRY1,Decoy,0,-8.61512,-8.11,-1.47,-9.805933000433797
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)ccc1O,C35271351_decoy,TRY1,Decoy,0,-6.4657,-8.54,-2.13,-8.674997105537225
Cc1c(C(=O)NNC(=O)c2cc(=O)[nH]c3ccccc23)sc2c1C(=O)NNS2(=O)=O,C35683903_decoy,TRY1,Decoy,0,-8.46833,-6.66,-1.63,-5.96478061800243
O=C([O-])c1[nH]nc(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C08740253_decoy,TRY1,Decoy,0,-8.3319,-6.09,-3.88,-5.290562001864594
Cc1coc2c(C)c3oc(=O)c(CCC(=O)N(C)C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc12,C36369706_decoy,TRY1,Decoy,0,-8.13124,-6.36,-2.56,-5.440116697301177
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)c1cccc(Cl)c1,C36552851_decoy,TRY1,Decoy,0,-8.77302,-6.56,-1.5,-6.911229661913588
Cc1ccc(CN(C(=O)c2ccccc2O)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36595286_decoy,TRY1,Decoy,0,-7.44813,-7.34,-4.46,-8.48199329507599
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2cccs2)c1,C12711216_decoy,TRY1,Decoy,0,-7.56181,-6.04,-2.52,-6.599017267239082
CN(C)c1ccc([O-])c2c1C[C@@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@@]3(O)C(=O)[C@H]1C2=O,C35189266_decoy,TRY1,Decoy,0,-7.82363,-6.16,-3.15,-3.986544220397739
CN(C)c1ccc([O-])c2c1C[C@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@@]3(O)C(=O)[C@@H]1C2=O,C35189267_decoy,TRY1,Decoy,0,-6.54323,-5.77,-2.75,-3.763599318531722
NC(=O)c1nsc(C(=O)N(c2ccc(F)cc2)[C@H](C(=O)NC2CCCC2)c2ccncc2)c1N,C06444841_decoy,TRY1,Decoy,0,-8.92826,-6.76,-2.93,-7.067503252790108
CC(C)(CO)NS(=O)(=O)c1ccc2c(c1)C(=NO)c1cc(S(=O)(=O)NC(C)(C)CO)ccc1-2,C02818155_decoy,TRY1,Decoy,0,-8.41907,-6.38,-4.33,-6.732967431873275
[NH-]C1=NC(=O)C2=N[C@H](N/N=C/c3ccc(Br)cc3)N([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39774492_decoy,TRY1,Decoy,0,-8.71076,-9.01,-1.2,-7.555016942809049
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@@]1(O)O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C39937478_decoy,TRY1,Decoy,0,-5.24882,-7.78,-2.42,-6.226659252966141
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@@]1(O)O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C39937480_decoy,TRY1,Decoy,0,-6.62917,-5.6,-1.7,-4.872846134869541
CN(C)c1ccc([O-])c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@]3(O)C(=O)[C@H]1C2=O,C35024913_decoy,TRY1,Decoy,0,-7.36301,-5.48,-3.81,-4.003128674040369
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@H]3[C@@H](O)[C@@H]12,C43763851_decoy,TRY1,Decoy,0,-5.78396,-6.24,-2.0,-4.009957780881847
O=C([O-])[C@@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@H](O)[C@@H]1O,C33949416_decoy,TRY1,Decoy,0,-7.68924,-7.31,-3.02,-5.767981606672341
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@@H](O)[C@@H]12,C44136589_decoy,TRY1,Decoy,0,-8.27403,-6.25,-3.66,-4.674155505767346
O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C45789238_decoy,TRY1,Decoy,0,-6.61937,-6.88,-2.83,-5.611636089746519
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C49180751_decoy,TRY1,Decoy,0,-8.36801,-8.69,-2.22,-7.726561962990198
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@@H](O)[C@H]12,C37865937_decoy,TRY1,Decoy,0,-9.52148,-6.56,-3.26,-4.43376376905721
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@H]12,C34025923_decoy,TRY1,Decoy,0,-9.67465,-6.26,-2.06,-5.4805501509182575
CN(C)[C@H]1C(=O)/C(=C(\N)O)C(=O)[C@]2(O)C(=O)C3=C([O-])c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@@H]12,C13719765_decoy,TRY1,Decoy,0,-8.74425,-6.33,-4.12,-4.160152975499164
CN(C)[C@@H]1C(=O)/C(=C(\N)O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@@H]12,C13719769_decoy1,TRY1,Decoy,0,-8.75747,-5.64,,-4.976307868958824
CN(C)[C@H]1C(=O)/C(=C(\N)O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@H]12,C13719774_decoy,TRY1,Decoy,0,-6.97688,-6.16,-1.79,-4.086065686077798
CN(C)[C@@H]1C(=O)/C(=C(\N)O)C(=O)[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@H]12,C13719778_decoy,TRY1,Decoy,0,-8.18758,-6.36,-3.71,-4.060588010600412
O=C([O-])[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C34245011_decoy,TRY1,Decoy,0,-5.62199,-8.9,-1.17,-6.995097229167771
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1Nc2ccccc2C(=O)N1CCCO,C39782137_decoy,TRY1,Decoy,0,-8.58596,-6.16,-3.32,-5.301497656961866
CCCN1C(=O)NC([O-])=C(C(=O)CSc2nc(-c3cccs3)c(-c3cccs3)[nH]2)[C@@H]1[NH3+],C63209390_decoy,TRY1,Decoy,0,-9.59014,-6.9,-2.16,-6.813970247256361
Nc1nc(Br)c([C@H]2CCNC(=O)c3[nH]c(Br)c(Br)c32)[nH]1,C39166404_decoy,TRY1,Decoy,0,-8.69421,-6.33,-1.24,-4.370428969252793
O=C1C[C@@H](c2ccc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C65748013_decoy,TRY1,Decoy,0,-8.1705,-7.95,-1.55,-5.498911479211458
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C65748017_decoy,TRY1,Decoy,0,-8.12051,-7.39,-2.42,-5.244735604011853
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C65748021_decoy,TRY1,Decoy,0,-7.03974,-8.75,-1.61,-5.265872365258965
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(=O)[C@@H]3C(=O)c4c([O-])cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@@H]12,C38337186_decoy,TRY1,Decoy,0,-6.98339,-7.47,-3.31,-4.94875977218345
CN(C)[C@@H]1C(=O)/C(=C(\N)O)C(=O)[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@@H]12,C18202350_decoy,TRY1,Decoy,0,-7.11346,-6.07,-2.72,-3.406034601141945
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(=O)[C@@H]3C(=O)c4c([O-])cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@H]12,C13813244_decoy,TRY1,Decoy,0,-6.70965,-6.36,-2.84,-4.111856608058144
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C04348836_decoy,TRY1,Decoy,0,-8.75408,-9.29,-3.06,-8.301175677530518
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c2O,C04348849_decoy,TRY1,Decoy,0,-8.44026,-9.53,-2.11,-6.902989014132293
O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C04349354_decoy,TRY1,Decoy,0,-9.347,-7.49,-2.56,-6.090336401731336
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12,C04349442_decoy,TRY1,Decoy,0,-8.71964,-7.39,-1.83,-5.32714469894986
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C04349519_decoy,TRY1,Decoy,0,-8.08071,-7.7,-2.48,-5.50166806876083
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C04349659_decoy,TRY1,Decoy,0,-7.48303,-7.53,-1.8,-6.549689510133476
O=C[C@H]1OC(=O)c2cc(O)c(O)c(O)c2-c2c(cc(O)c(O)c2O)C(=O)O[C@H]1[C@H](O)[C@H](O)CO,C05537411_decoy,TRY1,Decoy,0,-9.34152,-5.6,-4.1,-2.0727279594949635
C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08143614_decoy,TRY1,Decoy,0,-8.37765,-9.06,-3.79,-6.226394145085367
C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08214757_decoy,TRY1,Decoy,0,-9.42863,-6.83,-2.86,-6.110080778174874
C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08214758_decoy,TRY1,Decoy,0,-9.5125,-7.42,-2.1,-5.615337950213385
C[C@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@@]5(O)[C@@H]4CC[C@]3(O)C2)[C@@H](O)[C@@H](O)[C@H]1O,C08214789_decoy,TRY1,Decoy,0,-9.25813,-6.27,-2.17,-5.344907638477016
C[C@]1(OC[C@@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970278_decoy,TRY1,Decoy,0,-5.59255,-6.68,-2.74,-4.461617511008332
C[C@]1(OC[C@@]2(C)O[C@@](O)(CO)[C@@](C)(O)[C@]2(C)O)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970297_decoy,TRY1,Decoy,0,-5.59069,-5.74,-2.97,-4.861919387309355
C[C@]1(OC[C@@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970503_decoy,TRY1,Decoy,0,-5.15392,-4.75,-1.75,-3.8950737635210113
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c12,C12153136_decoy,TRY1,Decoy,0,-8.26346,-9.45,-1.43,-7.858793816611032
C[C@@]1(O[C@]2(C)[C@@H](CO)O[C@](C)(O)[C@](C)(O)[C@@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C12358612_decoy,TRY1,Decoy,0,-5.72209,-5.1,-4.53,-4.197984955045959
C[C@@]1(O[C@]2(C)[C@@H](CO)O[C@@](C)(O)[C@](C)(O)[C@@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C12358634_decoy,TRY1,Decoy,0,-5.85391,-4.67,-3.03,-3.395362489613946
CC1(C)O[C@@](O)(CO)[C@](C)(O[C@@]2(C)O[C@@H](CO)[C@@](C)(O)[C@@H](O)[C@@]2(C)O)[C@@](C)(O)[C@@]1(C)O,C12358952_decoy,TRY1,Decoy,0,-4.39825,-6.14,-2.0,-4.133976307560211
O=c1cc(-c2cc(O)c(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c12,C12428286_decoy,TRY1,Decoy,0,-9.24203,-10.25,-2.46,-8.890045681156828
O=c1cc(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C12428583_decoy,TRY1,Decoy,0,-9.02417,-7.62,-3.53,-6.197045269180533
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C13424702_decoy,TRY1,Decoy,0,-8.82839,-9.06,-2.79,-8.080828274166956
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c2O,C13424706_decoy,TRY1,Decoy,0,-8.50087,-8.69,-1.51,-7.851951986542625
O=c1c(O)c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C13424741_decoy,TRY1,Decoy,0,-8.9634,-7.49,-1.95,-7.02280366121462
Nc1nc2c(nc(N/N=C/c3cc(Cl)ccc3O)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16384771_decoy,TRY1,Decoy,0,-8.44708,-8.81,-2.69,-9.35904562477749
Nc1nc2c(nc(N/N=C/c3cc(Cl)ccc3O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16384774_decoy,TRY1,Decoy,0,-8.22885,-8.66,-3.35,-8.037666683329913
Nc1nc2c(nc(N/N=C/c3cc(Cl)ccc3O)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16384777_decoy,TRY1,Decoy,0,-7.62399,-6.88,-1.23,-6.35290425812023
COc1cc([C@@H]2Oc3c(O)cc(CCCO)cc3[C@H]2CO)ccc1O[C@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C31155655_decoy,TRY1,Decoy,0,-8.72668,-8.41,-2.31,-9.065764111637876
O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12,C31158085_decoy,TRY1,Decoy,0,-10.1406,-8.86,-1.7,-8.722039374727846
O=C1c2c(O)cc(O)cc2O[C@@H](c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)[C@@H]1O,C31158681_decoy,TRY1,Decoy,0,-9.76034,-7.62,-3.19,-6.7275259681648505
OC[C@H]1O[C@@H](O[C@@H]2Cc3c(O)cc(O)cc3O[C@@H]2c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C31165288_decoy,TRY1,Decoy,0,-7.68184,-5.98,-1.8,-5.005368288802514
O=c1c(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C33831890_decoy,TRY1,Decoy,0,-9.23056,-8.26,-2.52,-7.955194186815992
O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)ccc12,C35466144_decoy,TRY1,Decoy,0,-8.32391,-9.53,-1.77,-6.808051496750873
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2c1ccc(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c2O,C36532578_decoy,TRY1,Decoy,0,-8.21538,-8.62,-1.9,-7.668863609655028
O=C1/C(=C\c2ccc(O)c(O)c2)Oc2c1ccc(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c2O,C36532582_decoy,TRY1,Decoy,0,-6.95547,-6.53,-2.35,-4.787010072041484
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C13827616_decoy,TRY1,Decoy,0,-9.03567,-8.34,-1.79,-7.749973411947309
O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C31155604_decoy,TRY1,Decoy,0,-8.79317,-8.6,-3.68,-7.535988779626971
O=C1c2c(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O[C@H](c2ccc(O)cc2)[C@H]1O,C34264757_decoy,TRY1,Decoy,0,-9.17482,-8.5,-1.42,-6.915692448466258
O=c1cc(-c2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C39204683_decoy,TRY1,Decoy,0,-9.25092,-8.89,-2.78,-6.003235933519561
COc1c(O)cc([C@H]2CC(=O)c3c(O)cc(O)c([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3O2)cc1O,C39560230_decoy,TRY1,Decoy,0,-8.68855,-6.19,-1.48,-5.251882390252311
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C43465404_decoy,TRY1,Decoy,0,-9.34842,-9.35,-2.84,-8.449157790140903
O=c1c(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C43465436_decoy,TRY1,Decoy,0,-8.60085,-8.77,-2.81,-7.820962073867811
O=c1cc(-c2ccc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C43465449_decoy,TRY1,Decoy,0,-8.00874,-7.8,-2.17,-5.718212960890261
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C43465453_decoy,TRY1,Decoy,0,-7.92919,-8.96,-1.17,-6.65730052952966
C[C@]1(O[C@]2(C)[C@H](CO)O[C@](C)(O)[C@@](C)(O)[C@@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@](C)(O)[C@]1(C)O,C43509292_decoy,TRY1,Decoy,0,-5.66296,-5.88,-2.76,-4.688442751023238
C[C@]1(O[C@]2(C)[C@H](CO)O[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)O[C@@H](CO)[C@](C)(O)[C@](C)(O)[C@@]1(C)O,C43509310_decoy,TRY1,Decoy,0,-5.04259,-5.64,-4.39,-4.46230206320583
C[C@]1(O[C@@]2(C)[C@@](C)(O)[C@@](C)(O)[C@H](O)O[C@]2(C)CO)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970284_decoy,TRY1,Decoy,0,-4.92545,-5.1,-4.12,-3.976015403176559
Nc1nc2c(nc(N/N=C/c3cc(Cl)ccc3O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35183228_decoy,TRY1,Decoy,0,-7.79582,-9.31,-2.8,-10.116576365506468
Nc1nc2[nH]c(SCc3nnc(CSc4nc5c(=O)[nH]c(N)nc5[nH]4)n3N)nc2c(=O)[nH]1,C58834883_decoy,TRY1,Decoy,0,-8.92416,-8.8,-1.42,-7.1035200937989575
O=c1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C05004611_decoy,TRY1,Decoy,0,-7.38235,-8.82,-3.27,-7.807537244599008
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H]([C@H](C)O)[NH2+][C@]12C(=O)Nc1ccccc12,C04090899_decoy,TRY1,Decoy,0,-7.38727,-7.2,-1.68,-9.601415785290962
C[NH+]1CCc2nc3sc(C(=O)NCCc4c[nH]c5ccccc45)c(N)c3cc2C1,C05348998_decoy,TRY1,Decoy,0,-8.97392,-6.0,-2.8,-5.375126374121326
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)n(-c2ccccc2C)c(=O)[nH]c1=O,C06090681_decoy,TRY1,Decoy,0,-7.57667,-7.17,-2.33,-5.775982837183598
[NH3+][C@@H](Cc1c[nH]c2ccccc12)c1nc(C(=O)N[C@H]2CCc3ccccc32)co1,C06476230_decoy,TRY1,Decoy,0,-8.7996,-9.62,-1.48,-10.514786125508712
C[NH+](C)CCNC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccccc3)[C@@H]21,C08254659_decoy,TRY1,Decoy,0,-7.5624,-6.86,-2.32,-7.378629309633955
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)nc(O)n(C(C)C)c1=O,C08970206_decoy,TRY1,Decoy,0,-7.69395,-5.7,-2.04,-4.6028267857964345
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)nc(O)n(C(C)(C)C)c1=O,C09109389_decoy,TRY1,Decoy,0,-7.36168,-5.73,-2.81,-4.59984723872243
NC(=O)c1ccccc1NC(=O)C[NH+]1CCC(O)(c2ccc(F)cc2)CC1,C12113128_decoy,TRY1,Decoy,0,-6.58059,-7.21,-1.45,-11.061005998426303
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C12877794_decoy,TRY1,Decoy,0,-9.58939,-7.38,-0.45,-9.205715849100503
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C12877808_decoy,TRY1,Decoy,0,-7.31843,-5.38,-2.74,-5.457308884023582
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3CC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C02138892_decoy,TRY1,Decoy,0,-7.74915,-6.89,-1.59,-5.747499319479024
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C12885390_decoy,TRY1,Decoy,0,-9.73843,-7.19,-1.44,-7.0789354992277165
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(O)[nH]c(=O)n(-c3ccc(OC)cc3)c2=O)[NH2+]1,C12892330_decoy,TRY1,Decoy,0,-8.09306,-7.16,-1.16,-5.996664727701832
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2c(O)[nH]c(=O)n(-c3ccc(OC)cc3)c2=O)[NH2+]1,C12892344_decoy,TRY1,Decoy,0,-8.04548,-8.42,-0.79,-10.110203547441063
CCCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)[nH]c1=S,C05789975_decoy,TRY1,Decoy,0,-7.38257,-7.81,-2.87,-6.5031491066029785
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H]([C@@H](C)O)[NH2+][C@@]12C(=O)Nc1ccccc12,C16026636_decoy,TRY1,Decoy,0,-7.04802,-6.73,-1.16,-5.856740018010277
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H]([C@@H](C)O)[NH2+][C@@]12C(=O)Nc1ccccc12,C16026639_decoy,TRY1,Decoy,0,-6.25049,-6.23,-1.09,-4.580848499741968
CC1(C)CC(NC(=O)CSc2nnc(C(C)(C)C)n2N)CC(C)(C)[NH2+]1,C20842175_decoy,TRY1,Decoy,0,-8.51923,-4.71,-3.07,-4.659977672273245
C[C@@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680398_decoy,TRY1,Decoy,0,-8.15095,-7.36,-1.03,-7.787405405899497
NC(=O)C[NH+]1CCC(NC(=O)NCCSc2ccc(Cl)cc2)CC1,C32802726_decoy,TRY1,Decoy,0,-8.68944,-6.05,-2.01,-5.561054297592484
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H]([C@H](C)O)[NH2+][C@]12C(=O)Nc1ccccc12,C35877468_decoy,TRY1,Decoy,0,-7.25519,-7.55,-1.75,-11.515250905138888
Cc1ccccc1N1N[NH2+]N[C@@H]1SCCCn1c(=O)[nH]c2ccccc21,C39445044_decoy,TRY1,Decoy,0,-7.7879,-4.83,-1.7,-5.076474038972295
CC1=C(C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](C)ON1,C39671590_decoy,TRY1,Decoy,0,-7.97598,-6.51,-1.68,-5.420708982866361
CC1=C(C(=O)N2C[C@@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](C)ON1,C39671592_decoy,TRY1,Decoy,0,-7.17186,-6.8,-2.34,-5.017732375309799
CC1=C[C@H](C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)NN1C,C39671610_decoy,TRY1,Decoy,0,-8.6828,-8.12,-1.92,-6.248036681901571
CN(Cc1ccccc1)c1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40662350_decoy,TRY1,Decoy,0,-7.94311,-7.45,-1.59,-6.472075810560772
Cc1cccc(Nc2[nH+]cnc(Nc3ccc(Br)cn3)c2N)n1,C40685528_decoy,TRY1,Decoy,0,-8.20693,-7.38,-1.27,-6.567619758724277
Cc1ccnc(Nc2[nH+]cnc(Nc3ccc(Br)cn3)c2N)c1,C40701343_decoy,TRY1,Decoy,0,-7.9081,-7.21,-2.03,-5.318286665609715
C[NH+]1CCN(c2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)CC1,C40726354_decoy,TRY1,Decoy,0,-8.37702,-7.27,-1.77,-5.478597731435474
Nc1c(NCC[NH+]2CCCCC2)ncnc1NC12CC3CC(CC(C3)C1)C2,C40755618_decoy,TRY1,Decoy,0,-8.98286,-7.18,-2.84,-5.896455272777843
Nc1c(NCCN2CCOCC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40778005_decoy,TRY1,Decoy,0,-7.84253,-6.09,-0.88,-5.624001644480095
CC(C)(C[NH3+])c1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40974698_decoy,TRY1,Decoy,0,-8.68547,-5.86,-1.86,-5.901682376750373
CSCC[C@@H](NC(N)=O)C(=O)NCC1([NH+]2CCSCC2)CCCC1,C41423507_decoy,TRY1,Decoy,0,-9.48104,-5.43,-2.84,-6.090815080121668
CC1(C)CC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC(C)(C)[NH2+]1,C42909123_decoy,TRY1,Decoy,0,-8.47462,-5.05,-3.21,-5.445197861775049
CC1CC[NH+]([C@@H](CNC(=O)NNC(=S)NC2CCCC2)C(C)C)CC1,C46255067_decoy,TRY1,Decoy,0,-8.86125,-5.92,-3.56,-5.46890888041708
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)NNC(=S)NC2CCCC2)C1,C46762512_decoy,TRY1,Decoy,0,-8.46747,-6.88,-2.54,-6.741518089760915
C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)NNC(=S)NC2CCCC2)C1,C46762519_decoy,TRY1,Decoy,0,-8.48232,-6.86,-2.75,-6.320261215051445
NC(=O)Cc1ccccc1NC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C45725314_decoy,TRY1,Decoy,0,-8.30859,-6.69,-1.1,-10.174078322098485
NC(=O)CCOc1ccccc1NC(=O)NC1CC[NH+](CC(F)F)CC1,C61774141_decoy,TRY1,Decoy,0,-6.65091,-6.47,-2.35,-6.360492011684691
NC(=O)NCC(=O)NC[C@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl,C63778312_decoy,TRY1,Decoy,0,-6.55483,-7.81,-1.45,-7.780641176168849
COc1ccc2[nH]/c(=N\C(=O)C3CCC(CN4CN[NH2+]N4)CC3)sc2c1,C63795388_decoy,TRY1,Decoy,0,-9.46815,-8.11,-0.83,-7.9125075357794845
CC(C)C[C@@H](NC(N)=O)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C65104236_decoy,TRY1,Decoy,0,-7.57331,-7.8,-1.06,-7.668036984005242
Nc1nc(CCC2=[NH+][C@H]3C[C@@H](c4ccc(F)cc4)CNC(=O)[C@H]3N2)cs1,C65374035_decoy,TRY1,Decoy,0,-7.84673,-6.65,-3.16,-4.712170792816988
C[NH+]1CCN(c2ccccc2NC(=O)NNC(=O)c2ccc(O)cc2)CC1,C65771591_decoy,TRY1,Decoy,0,-7.6216,-8.24,-1.22,-8.214645571203206
C[NH+]1CCN(c2ccccc2NC(=O)NNC(=O)c2ccccc2O)CC1,C65772917_decoy,TRY1,Decoy,0,-7.45685,-6.94,-0.15,-6.754047038018207
Cc1cccc(Nc2ccccc2C(=O)N[C@@H]2CCC[NH+](CC(N)=O)C2)c1C,C66449465_decoy,TRY1,Decoy,0,-8.81816,-7.41,-1.18,-8.610434234288283
C[C@@H]1CNC(=O)N1c1ccc([C@@H](C)[NH2+][C@H](C(N)=O)c2ccc(F)cc2)cc1,C66940572_decoy,TRY1,Decoy,0,-7.69637,-7.44,-1.69,-6.120584467834346
Cc1ccc(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cc1C(N)=O,C67313497_decoy,TRY1,Decoy,0,-9.56646,-6.76,-1.93,-6.058918755351616
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc3c(c2)CCCC(=O)N3)CC1,C67577158_decoy,TRY1,Decoy,0,-9.55043,-7.52,-5.25,-6.558668149535206
Cc1ccc2c(CCNC(=O)NC[C@H](O)C[NH+]3CCC(C)CC3)c[nH]c2c1,C67639158_decoy,TRY1,Decoy,0,-7.93093,-7.23,-1.58,-6.3184255579919
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)NN)cc3N2)cc1C,C01069030_decoy,TRY1,Decoy,0,-7.60111,-8.4,-1.18,-11.949630233218471
O=C(N/N=C/c1c(F)cccc1Cl)c1cc(O)c(O)c(O)c1,C02741880_decoy,TRY1,Decoy,0,-8.39877,-6.07,-0.85,-5.684109061795139
C[C@H]1CCc2c(sc(NC(=S)NC(=O)C(C)(C)C)c2C(N)=O)C1,C06824577_decoy,TRY1,Decoy,0,-8.28774,-5.6,-2.79,-5.34849759297616
Cc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCC3)c(Cl)c1,C06844352_decoy,TRY1,Decoy,0,-8.42362,-7.24,-1.92,-7.099520661207699
NNC(=O)c1cc(Br)ccc1NCCOc1ccc(Cl)cc1,C08703201_decoy,TRY1,Decoy,0,-8.90388,-7.37,-1.02,-7.350483436064755
CCCCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)c1,C08846161_decoy,TRY1,Decoy,0,-7.58142,-5.99,-2.49,-6.820313435389358
CCCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(N)ccc21,C08846185_decoy,TRY1,Decoy,0,-5.99717,-4.9,-0.47,-4.858132826606635
C[C@@]1(Oc2cccc3ccccc23)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915869_decoy,TRY1,Decoy,0,-6.48988,-5.78,-2.24,-4.438416002024143
Cc1sc(NC(=S)NC(=O)/C=C/c2ccc(F)cc2)c(C(N)=O)c1C,C12500603_decoy,TRY1,Decoy,0,-9.09054,-5.68,-2.64,-4.996411331833999
Cc1ccc(N[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1Cl,C12765817_decoy,TRY1,Decoy,0,-8.83304,-7.45,-1.0,-6.7976468023402505
Cc1cc(C)cc(N[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c1,C12536362_decoy,TRY1,Decoy,0,-7.89217,-7.32,-0.67,-6.967966966468217
CCc1ccc2c(CSc3nc(N)cc(N)n3)cc(=O)oc2c1,C06533293_decoy,TRY1,Decoy,0,-7.60878,-8.31,-0.86,-7.5136236913756385
NC(=O)c1c(NC(=S)NC(=O)Cc2ccc(Cl)cc2)sc2c1CCCC2,C14001992_decoy,TRY1,Decoy,0,-10.8577,-6.82,-3.42,-6.360514841649743
CCCCOc1ccccc1C1C(C#N)=C(N)SC(N)=C1C#N,C19868132_decoy,TRY1,Decoy,0,-7.25863,-4.46,-0.84,-4.455779895924127
O=C1NC2=Nc3ccccc3NC(c3ccccc3)=C2[C@@H](c2ccc(O)cc2)N1,C05428289_decoy,TRY1,Decoy,0,-7.48279,-6.34,-0.16,-5.386730998927214
Cc1cc(NC(N)=S)cc(-c2nc3cc(C(C)C)ccc3o2)c1O,C20154584_decoy,TRY1,Decoy,0,-9.8322,-6.9,-1.44,-6.588394108972116
CC[C@@H](C)n1c(=S)[nH]c([O-])c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C20411815_decoy,TRY1,Decoy,0,-7.14264,-7.68,-0.91,-7.123993823419479
CC(C)c1ccc(-c2c3c(nc4nc(N)nc(N)c24)CCCC3=O)cc1,C20673511_decoy,TRY1,Decoy,0,-6.28995,-5.63,-1.59,-3.8768849476183713
NC(=O)N[C@@H](CC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(Cl)cc1,C29958139_decoy,TRY1,Decoy,0,-8.90615,-6.25,-1.67,-6.6683314252352
CC[C@@H](C)[C@H](NC(N)=O)C(=O)N[C@@H](C)C12CC3CC(CC(C3)C1)C2,C32960666_decoy,TRY1,Decoy,0,-7.46399,-6.22,-2.44,-5.858494012133649
O=c1[nH]c2ccc(NC(=S)Nc3ccc(Cl)cc3Cl)cc2[nH]1,C13479199_decoy,TRY1,Decoy,0,-7.93771,-6.14,-1.43,-5.220781425707944
Cc1cc(C)cc(N2C(=S)NC(=O)[C@H]([C@H]3NCCc4c3[nH]c3ccccc43)[C@H]2O)c1,C38570360_decoy,TRY1,Decoy,0,-7.97043,-6.98,-0.74,-4.915358441514944
Oc1ccccc1NC[C@@H](c1ccc(-c2ccccc2O)cc1)N1CCN[C@H](F)C1,C39534062_decoy,TRY1,Decoy,0,-9.09681,-6.0,-2.16,-6.049189354795952
Nc1cc(Br)ccc1S(=O)(=O)Nc1cccc2[nH]ncc12,C40315423_decoy,TRY1,Decoy,0,-6.29858,-7.66,-0.94,-9.088140276886984
CCC[C@](C)([NH3+])C(=O)Nc1cc(Br)ccc1C(=O)[O-],C40486580_decoy,TRY1,Decoy,0,-7.05314,-5.21,-2.5,-5.085392420240371
CCC[C@@](C)([NH3+])C(=O)Nc1cc(Br)ccc1C(=O)[O-],C40486582_decoy,TRY1,Decoy,0,-6.4732,-5.36,-1.65,-4.717951405337336
CC(C)Nc1ncnc(Nc2cc(C(F)(F)F)ccc2Cl)c1N,C40682398_decoy,TRY1,Decoy,0,-6.80752,-6.88,-2.79,-6.944455119251817
Cc1ccnc(Nc2ncnc(Nc3cccc4ccccc34)c2N)c1,C40701320_decoy,TRY1,Decoy,0,-7.45074,-6.39,-3.04,-5.51773742965095
C[C@@H](Nc1ncnc(Nc2ccccc2C(F)(F)F)c1N)c1ccccc1,C40701771_decoy,TRY1,Decoy,0,-6.75993,-6.35,-2.58,-5.624624029638645
Cc1cc(Cl)ccc1Nc1ncnc(NCCc2cccs2)c1N,C40703508_decoy,TRY1,Decoy,0,-8.43946,-5.83,-1.68,-6.083000206493575
Nc1c(Nc2ccc(I)cc2)ncnc1NC1CCCCC1,C40708589_decoy,TRY1,Decoy,0,-8.44127,-7.32,-1.62,-5.757711801516083
C[C@@H](Nc1ncnc(NC23CC4CC(CC(C4)C2)C3)c1N)c1ccccc1,C40755648_decoy,TRY1,Decoy,0,-7.63299,-7.13,-1.79,-5.347545909315054
Cc1nc(Nc2ncnc(Nc3ccccc3F)c2N)sc1C,C40759182_decoy,TRY1,Decoy,0,-8.32252,-5.22,-1.25,-5.0729942325106405
C[C@H](Nc1ncnc(Nc2ccccc2Br)c1N)c1ccccc1,C40760256_decoy,TRY1,Decoy,0,-7.76913,-5.05,-1.81,-4.67287369213852
Nc1c(Nc2ccc(F)cc2)ncnc1Nc1ccccc1Cl,C40781282_decoy,TRY1,Decoy,0,-7.45453,-7.08,-0.58,-6.982879456054376
CC(C)CCNc1ncnc(Nc2ccc(I)cc2)c1N,C40782393_decoy,TRY1,Decoy,0,-7.8674,-4.64,-0.67,-6.397306796905317
NC(=O)NC(=O)c1c(NC(=O)c2ccc(Br)s2)sc2c1CCC2,C44452604_decoy,TRY1,Decoy,0,-10.239,-5.4,-2.39,-6.656735582693019
CC(C)[C@@H](NC(=O)Nc1ccccc1CC(N)=O)c1cccs1,C45724944_decoy,TRY1,Decoy,0,-8.06255,-4.58,-2.06,-4.779580849646681
CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)NNC(=S)NC1CCCC1,C46025272_decoy,TRY1,Decoy,0,-8.39401,-5.75,-0.86,-5.073383326079108
NNc1ncc(Br)cc1C(=O)Nc1cc(Br)ccc1F,C51128984_decoy,TRY1,Decoy,0,-8.7899,-4.55,-1.04,-5.113192065253172
COc1cc(-c2nc(C)c(C)c(NN)n2)cc(Br)c1O,C51169196_decoy,TRY1,Decoy,0,-7.58034,-5.71,-0.93,-9.422091496056296
Cc1[nH]nc(O)c1C(c1ccc(Cl)cc1Cl)c1c(O)n[nH]c1C,C04600038_decoy,TRY1,Decoy,0,-7.56931,-4.34,-0.84,-4.94695592392682
C[C@@H](NC(=O)c1cccc2c3c([nH]c12)CCCC3)c1ccc2[nH]c(=O)[nH]c2c1,C58385925_decoy,TRY1,Decoy,0,-9.2934,-7.91,-0.85,-7.185605914135828
CC(C)c1ccc([C@H]2C(C(N)=O)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1,C58949930_decoy,TRY1,Decoy,0,-6.53052,-6.13,-0.9,-4.767399616895374
Cc1c(Cc2ccccc2)sc(/N=C/c2cccc(O)c2O)c1C(N)=O,C59472723_decoy,TRY1,Decoy,0,-8.1249,-5.91,-1.32,-4.960334713189689
CCCc1[nH]nc(C(=O)N[C@@H](C)c2ccc(Br)cc2)c1N,C50322546_decoy,TRY1,Decoy,0,-8.34852,-5.27,-1.96,-5.455645484372528
NC(=O)NC(=O)CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1,C15291040_decoy,TRY1,Decoy,0,-6.19225,-5.42,-2.44,-4.556411693788395
C[C@]([NH3+])(C(=O)Nc1c(Br)cc(Br)cc1C(=O)[O-])C1CC1,C62825394_decoy,TRY1,Decoy,0,-7.6473,-4.78,-1.48,-5.336981344290714
[NH3+][C@H]1CCC[C@@H](C(=O)Nc2c(Br)cc(Br)cc2C(=O)[O-])C1,C62825428_decoy,TRY1,Decoy,0,-8.22383,-4.92,-1.27,-5.612072919015967
C[C@]([NH3+])(C(=O)Nc1c(Br)cccc1C(=O)[O-])C1CC1,C62826920_decoy,TRY1,Decoy,0,-8.04439,-5.29,-1.55,-5.476856319362208
O=C1c2ccccc2C2=C[C@@H]([NH2+]CCO)Nc3ccc(NCCO)c1c32,C03082546_decoy,TRY1,Decoy,0,-8.07642,-6.77,-1.38,-7.124605046813029
NNC(=O)C(=O)NN=C(C(Cl)(Cl)CO)C(Cl)(Cl)CO,C01626264_decoy,TRY1,Decoy,0,-7.9333,-5.78,-2.41,-9.380111660304207
C[C@@]12C[C@H](O)[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)C[C@@H](O)[C@]34CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C04974276_decoy,TRY1,Decoy,0,-9.89971,-5.61,-2.12,-5.065926045247319
C[C@]12C[C@@H](O)[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)C[C@@H](O)[C@]34CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C04974279_decoy,TRY1,Decoy,0,-8.96801,-6.77,-1.11,-5.217388907259922
O=C(NCCI)N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C05412519_decoy,TRY1,Decoy,0,-6.60626,-4.36,-2.0,-4.689897855898694
Nc1nc2c(nc(N3CCCC3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C05492776_decoy,TRY1,Decoy,0,-7.07602,-8.69,-1.8,-8.773679981636404
Nc1nc2c(nc(N3CCCC3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C05492777_decoy,TRY1,Decoy,0,-7.15483,-7.82,-1.56,-8.377708577626723
CC(=O)c1c(C)cc2cc(O)cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c2c1O,C05520898_decoy,TRY1,Decoy,0,-6.44472,-7.76,-1.16,-6.4261480721301965
OC[C@@H]1O[C@H](Oc2cc(O)cc(/C=C\c3ccc(O)cc3)c2)[C@@H](O)[C@H](O)[C@@H]1O,C05923206_decoy,TRY1,Decoy,0,-7.64034,-7.0,-1.25,-5.150368762065575
Nc1nc2c(nc(N3CCOCC3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C04256216_decoy,TRY1,Decoy,0,-7.2128,-7.9,-0.14,-11.291502924436474
Nc1[nH]c(=O)[nH]c(=O)c1-c1c(-c2ccc3c(c2)OCCO3)[nH]c2[nH]c(=O)[nH]c(=O)c12,C12375215_decoy,TRY1,Decoy,0,-8.12929,-6.42,-0.75,-4.77882128726287
Nc1nc2c(nc(Br)n2[C@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C12378692_decoy,TRY1,Decoy,0,-6.97539,-7.79,-2.15,-7.484178293550423
Nc1nc2c(nc(N3CCOCC3)n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C02124467_decoy,TRY1,Decoy,0,-6.04323,-7.88,-0.99,-11.43925210619476
Nc1ncnc2c1[C@H](I)NN2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C06549191_decoy,TRY1,Decoy,0,-6.89481,-4.83,-0.52,-4.349956775440008
CSc1c(C(N)=O)c2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04824944_decoy,TRY1,Decoy,0,-6.64469,-4.98,-1.25,-4.070601386907036
Nc1nc2c(nc(N3CCOCC3)n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C02024310_decoy,TRY1,Decoy,0,-7.17942,-5.54,-1.55,-4.319130442799264
Nc1ncnc2c1nc(N/N=C/c1ccncc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740485_decoy,TRY1,Decoy,0,-7.90411,-8.02,-1.37,-9.25707593716256
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C13514737_decoy,TRY1,Decoy,0,-6.72526,-7.0,-1.96,-5.521869418115077
O=c1c(-c2ccc(O)cc2)coc2c(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(O)ccc12,C14984446_decoy,TRY1,Decoy,0,-7.7694,-9.16,-1.78,-6.852547579585077
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775379_decoy,TRY1,Decoy,0,-7.56145,-6.71,-1.26,-6.828870232942704
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775384_decoy,TRY1,Decoy,0,-7.45008,-8.67,-1.33,-6.756881858073569
Cc1ccc(C2=NN[C@H]([C@@](C)(O)[C@@](C)(O)[C@@](C)(O)[C@@](C)(O)CO)S2)cc1,C16292182_decoy,TRY1,Decoy,0,-8.74111,-5.9,-1.74,-6.110530349745104
NC(=O)c1nnsc1Sc1c(C(N)=O)nnn1-c1ccccc1N,C08695415_decoy,TRY1,Decoy,0,-7.54189,-5.5,-1.29,-5.29130048829263
O=C1NC(N/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=N/C1=C\c1ccccc1,C16958914_decoy,TRY1,Decoy,0,-6.78393,-7.07,-1.52,-6.857449601526845
O=C1NC(N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=N/C1=C\c1ccccc1,C16958916_decoy,TRY1,Decoy,0,-7.73889,-6.32,-1.58,-5.109724690674055
OC[C@H]1O[C@@H](O)[C@H](/[NH+]=C/c2cc(Br)ccc2O)[C@@H](O)[C@@H]1O,C19878528_decoy,TRY1,Decoy,0,-6.75339,-6.84,-2.23,-7.485826275362669
CC(C)(O)[C@H](O)Cc1cc(O)ccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159739_decoy,TRY1,Decoy,0,-7.10373,-5.29,-2.85,-4.277834863252971
CSc1nc2c(nc(N)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C17194157_decoy,TRY1,Decoy,0,-7.38598,-4.73,-3.13,-4.093868010889547
Nc1n[nH]c(=O)c2c1c(I)cn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C17196548_decoy,TRY1,Decoy,0,-6.52647,-6.06,-1.16,-4.835158145159073
Nc1n[nH]c(=O)c2c1c(Br)cn2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C17196561_decoy,TRY1,Decoy,0,-6.20917,-5.01,-2.11,-3.8451324672123097
CC(=O)c1cc(C)c(O)c(CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1O,C36375128_decoy,TRY1,Decoy,0,-6.74642,-6.94,-2.64,-5.3507930220917705
CC1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H](CO)[C@@H](O)C[C@H]12,C31156630_decoy,TRY1,Decoy,0,-7.57882,-7.65,-3.01,-7.092110902213069
Nc1nc2c(nc(Br)n2[C@@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C02565315_decoy,TRY1,Decoy,0,-6.69847,-8.12,-2.38,-7.726675999744797
NC(=O)CS[C@H]1NN[C@@H]([C@H]2C=C(c3ccc(Cl)cc3)N=N2)N1N,C38999321_decoy,TRY1,Decoy,0,-8.33318,-6.97,-0.94,-7.090456385614655
Nc1[nH]c(=O)[nH]c(=O)c1[C@@H]1C(c2cccs2)=N[C@@H]2NC(=O)N[C@@H](O)[C@H]21,C39272278_decoy,TRY1,Decoy,0,-9.339,-5.29,-2.04,-4.957175670385023
OC[C@@H]1O[C@@H](Nc2ccc(N[C@@H]3C[C@H](O)[C@H](O)[C@H](CO)O3)cc2)C[C@H](O)[C@@H]1O,C04644908_decoy,TRY1,Decoy,0,-6.22999,-6.32,-1.84,-4.675760576243374
Cc1ccnc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)c1,C40701331_decoy,TRY1,Decoy,0,-7.04096,-6.92,-1.56,-4.703891735545964
COc1ccccc1Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40760744_decoy,TRY1,Decoy,0,-6.91771,-5.5,-1.92,-4.43738277149269
Cc1nc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)sc1C,C40760772_decoy,TRY1,Decoy,0,-8.4497,-5.46,-1.96,-4.886635301676218
[NH3+][C@@H](Cc1ccc(O)c(O)c1)c1nc2ncc(Br)cc2[nH]1,C43460963_decoy,TRY1,Decoy,0,-9.00683,-7.97,-1.56,-8.799780285724822
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C43465482_decoy,TRY1,Decoy,0,-6.86963,-8.42,-4.55,-6.598221397035257
C[C@]12C[C@H](O)[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)C[C@@H](O)[C@]34CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43758873_decoy,TRY1,Decoy,0,-8.54878,-6.59,-1.38,-4.662786274521049
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@@H]3C(=O)c4c(O)ccc(N)c4C[C@H]3C[C@H]12,C44699257_decoy,TRY1,Decoy,0,-7.59651,-6.38,-2.98,-5.652633658635731
CC(C)=C[C@@]1(O)C(=O)C(C)(C)[C@@H](O)C(C)(C)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C49180891_decoy,TRY1,Decoy,0,-6.76567,-5.26,-3.35,-4.57620480789226
Cc1[nH]nc(O)c1C(c1cc([N+](=O)[O-])c(O)cc1O)c1c(O)n[nH]c1C,C20131004_decoy,TRY1,Decoy,0,-5.59713,-4.93,-2.49,-4.579832896583045
CC1=C(C(N)=O)[C@H](c2ccc(Br)s2)C(C(N)=O)=C(N)O1,C58949555_decoy,TRY1,Decoy,0,-7.59686,-4.13,-2.55,-4.023899131570794
NC1=NC(=O)NC(=O)[C@H]1[C@@H](c1ccc(F)cc1)c1c(N)[nH]c(=O)[nH]c1=O,C64117745_decoy,TRY1,Decoy,0,-7.33588,-5.38,-1.75,-4.775312882351012
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(Cl)s2)=N[C@@H]2NC(=O)N[C@@H](O)[C@@H]12,C64417726_decoy,TRY1,Decoy,0,-8.64236,-6.82,-1.69,-5.699545752520381
CSc1nc(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(Cl)c(=O)[nH]1,C16952445_decoy,TRY1,Decoy,0,-7.97213,-5.82,-1.49,-5.220050938912917
Nc1nc(N)nc(C[NH+]2CCC([C@H](O)c3ccc(Cl)cc3)CC2)n1,C67401370_decoy,TRY1,Decoy,0,-7.89658,-8.24,-1.65,-6.882437432618794
Nc1nc(Nc2cccc(Cl)c2)nc(-c2cc[nH+]c(NCCCO)c2)n1,C03937626_decoy,TRY1,Decoy,0,-7.9983,-5.71,-2.15,-5.24295338042861
[H]/N=C1\C(=NNc2ccc(Cl)cc2Cl)C(=[NH2+])NN1C(=O)c1ccncc1,C04478174_decoy,TRY1,Decoy,0,-7.49704,-6.44,-1.68,-6.013743453056508
Cc1c(Cl)cccc1-c1ccc(C[NH2+]CCNC(=O)c2nonc2N)o1,C04488489_decoy,TRY1,Decoy,0,-8.56592,-8.39,-4.42,-6.817756486423445
Cc1ccc(Nc2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C05032018_decoy,TRY1,Decoy,0,-7.70347,-6.84,-2.86,-6.156230168482746
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(c3ccc(O)c(O)c3)CCCC2)c1,C03039204_decoy,TRY1,Decoy,0,-8.4912,-6.3,-1.87,-6.2202272212827125
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(c3ccc(O)c(O)c3)CCCC2)c1,C03039206_decoy,TRY1,Decoy,0,-7.85599,-4.78,-2.89,-5.64146723907225
Nc1[nH]nc2nc(NC[C@@H]3CCCO3)c3c(c12)CC[NH+](C1CCCCC1)C3,C08554337_decoy,TRY1,Decoy,0,-8.47669,-7.11,-1.56,-8.33501725561927
Nc1[nH]nc2nc(NC[C@H]3CCCO3)c3c(c12)CC[NH+](C1CCCCC1)C3,C08554338_decoy,TRY1,Decoy,0,-8.56932,-8.24,-1.66,-9.192854126666036
Nc1nonc1C(=[NH2+])N/N=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1,C01899199_decoy,TRY1,Decoy,0,-8.45088,-6.97,-1.5,-7.376528650062382
Nc1nc(NCC[NH+]2CCOCC2)nc(Nc2ccc(F)cc2)c1[N+](=O)[O-],C04306333_decoy,TRY1,Decoy,0,-6.61314,-6.81,-1.91,-6.280344864932636
CNC(=S)/N=C(\Nc1nc(C)cc(C)n1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C14158030_decoy,TRY1,Decoy,0,-7.51089,-5.39,-1.58,-4.676047155341808
CCCn1c(O)nc(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c1=O,C09317831_decoy,TRY1,Decoy,0,-7.37441,-7.21,-1.71,-6.167864184484222
CCCn1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c1=O,C09317827_decoy,TRY1,Decoy,0,-7.57141,-6.47,-2.51,-5.336471117547604
N/C(=[NH+]\N=C\c1cccc(OCc2ccccc2Cl)c1)c1nonc1N,C13841712_decoy,TRY1,Decoy,0,-9.17973,-7.54,-2.64,-7.512954643276096
Cn1cc(C(=O)NNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc21,C26180055_decoy,TRY1,Decoy,0,-7.49873,-6.59,-2.72,-5.849403487693492
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC(=O)NC2CCCC2)cc1,C30499833_decoy,TRY1,Decoy,0,-7.63234,-8.01,-1.96,-7.27314926511961
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NC(=O)NC2CCCC2)cc1,C30499837_decoy,TRY1,Decoy,0,-7.15522,-7.5,-1.32,-6.861181609752396
Nc1c(C(=O)NNC(=O)c2c[nH]c3ccccc3c2=O)c[nH+]c2ccccc12,C32605451_decoy,TRY1,Decoy,0,-7.86871,-8.37,-2.84,-7.411474828724496
Nc1c(C(=O)NNC(=O)c2ccc(Br)o2)c[nH+]c2ccccc12,C32605496_decoy,TRY1,Decoy,0,-8.84053,-8.52,-2.32,-6.850897069375146
CC1(C)CC(NC(=O)c2nc[nH]c2C(=O)NC2CCCCC2)CC(C)(C)[NH2+]1,C33003700_decoy,TRY1,Decoy,0,-8.17451,-6.45,-1.78,-5.828551478352278
Cc1c(C(=O)NN2CC[NH+](C)CC2)oc2c1/C(=N/NC(N)=O)CC(C)(C)C2,C39856254_decoy,TRY1,Decoy,0,-7.75098,-6.69,-0.38,-5.245981510224213
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccccc1C(F)(F)F,C40701883_decoy,TRY1,Decoy,0,-6.62692,-6.78,-3.16,-6.124942101807041
Cc1ccc(-c2ccc(C[NH2+]CCNC(=O)c3nonc3N)o2)cc1Cl,C40744390_decoy,TRY1,Decoy,0,-7.35554,-8.13,-1.85,-7.568748457345524
Cc1ccc2cccc(Nc3ncnc(NCC[NH+]4CCCCC4)c3N)c2n1,C40756237_decoy,TRY1,Decoy,0,-8.10792,-6.44,-2.02,-6.416632651395373
Cc1cccc2sc(Nc3ncnc(NN4CC[NH+](C)CC4)c3N)nc12,C40756923_decoy,TRY1,Decoy,0,-8.31453,-7.16,-2.59,-5.251515328403327
Cc1ccc2nc(Nc3ncnc(NN4CC[NH+](C)CC4)c3N)sc2c1,C40756925_decoy,TRY1,Decoy,0,-8.17538,-7.27,-0.47,-5.375042477545266
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1cccc(Cl)c1Cl,C40778832_decoy,TRY1,Decoy,0,-7.45235,-7.55,-2.3,-9.59470498934897
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1cccc(C(F)(F)F)c1,C40781997_decoy,TRY1,Decoy,0,-6.37211,-6.03,-1.56,-5.066933784533592
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(C(F)(F)F)cc1,C40799937_decoy,TRY1,Decoy,0,-6.11172,-6.15,-1.41,-4.801327506661441
C[C@@H]1CCc2noc(Nc3nc(NCC[NH+](C)C)nc(N)c3[N+](=O)[O-])c2C1,C41301326_decoy,TRY1,Decoy,0,-8.0839,-7.37,0.4,-7.702507468691742
C[C@H]1CCc2noc(Nc3nc(NCC[NH+](C)C)nc(N)c3[N+](=O)[O-])c2C1,C41301329_decoy,TRY1,Decoy,0,-8.05731,-7.12,-0.48,-7.956548734405504
O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)NNC(=S)NC1CCCC1,C43137188_decoy,TRY1,Decoy,0,-7.48193,-5.59,-2.24,-5.448143218246185
O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)NNC(=S)NC1CCCC1,C43137189_decoy,TRY1,Decoy,0,-8.7135,-7.27,-2.63,-6.656318509154356
Cc1c(NC2CCC([NH3+])CC2)c(C#N)c2ccnn2c1NOc1ccccc1,C45253334_decoy,TRY1,Decoy,0,-7.96382,-7.61,-1.84,-5.715295487077138
Nc1[nH+]cc(NCCCO)cc1-c1cncc(Nc2cccc(Cl)c2)n1,C13648432_decoy,TRY1,Decoy,0,-10.8925,-7.46,-0.93,-9.407178403733456
CNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)C[NH+]2CCCCCC2)cc1,C56170923_decoy,TRY1,Decoy,0,-7.69175,-6.85,-4.39,-5.750986866759857
C[NH+]1CCC(NC(=O)NNC(=O)Nc2ccc(Br)cc2)CC1,C56551827_decoy,TRY1,Decoy,0,-8.67983,-7.35,-2.19,-9.080933394471574
NC1=NC(N)=[NH+]CN1c1ccc(OCCOc2ccc([N+](=O)[O-])cc2)cc1,C17039609_decoy,TRY1,Decoy,0,-8.34462,-7.78,-1.81,-10.007146586672713
Nc1nc(N)nc(S[C@H](C(=O)C2=c3ccccc3=[NH+]C2)c2ccccc2)n1,C39795930_decoy,TRY1,Decoy,0,-7.68416,-5.78,-1.07,-5.296585459418569
Nc1nc(N)nc(S[C@@H](C(=O)C2=c3ccccc3=[NH+]C2)c2ccccc2)n1,C39795931_decoy,TRY1,Decoy,0,-7.92926,-5.55,-2.99,-5.311274812156604
Nc1nc(N)nc(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2c2ccccc2)n1,C39943069_decoy,TRY1,Decoy,0,-9.00191,-5.17,-2.34,-5.416060287881058
CC1(C)CC(NC(=O)[C@@H]2N[C@H](C3=CC4=CC=N[C@@H]4C=C3)NO2)CC(C)(C)[NH2+]1,C39958853_decoy,TRY1,Decoy,0,-9.05117,-8.99,-0.92,-9.312182563305589
CC1(C)CC(NC(=O)[C@H]2N[C@H](C3=CC4=CC=N[C@@H]4C=C3)NO2)CC(C)(C)[NH2+]1,C39958854_decoy,TRY1,Decoy,0,-8.64414,-5.35,-1.51,-5.347507808730947
CC1(C)CC(NC(=O)[C@@H]2N[C@@H](C3=CC4=CC=N[C@@H]4C=C3)NO2)CC(C)(C)[NH2+]1,C39958855_decoy,TRY1,Decoy,0,-8.582,-6.5,-1.34,-6.472194824840697
CC1(C)CC(NC(=O)[C@H]2N[C@@H](C3=CC4=CC=N[C@@H]4C=C3)NO2)CC(C)(C)[NH2+]1,C39958856_decoy,TRY1,Decoy,0,-8.45427,-6.23,-1.34,-5.7398614185384815
CC[NH+](CC)[C@H](CNC(=O)NNC(=O)Nc1ccccc1C)c1ccco1,C65482013_decoy,TRY1,Decoy,0,-8.30378,-7.06,-2.62,-5.954292210083617
Cc1nc2ccc(N3N[C@@H](C(C)C)[NH2+][C@H]3c3c[nH]c(=O)[nH]c3=O)cc2s1,C65490341_decoy,TRY1,Decoy,0,-7.40161,-6.08,-1.57,-4.581524589103183
Cc1nc2ccc(N3N[C@@H](C(C)C)[NH2+][C@@H]3c3c[nH]c(=O)[nH]c3=O)cc2s1,C65490344_decoy,TRY1,Decoy,0,-9.52088,-7.37,-1.63,-6.180862199708622
Cc1ccc(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc1C(N)=O,C67314295_decoy,TRY1,Decoy,0,-8.48455,-6.44,-1.25,-6.889047901128048
Cc1ccc(NC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cc1C(N)=O,C67314300_decoy,TRY1,Decoy,0,-7.60968,-7.07,-0.99,-5.840242968540812
CC(C)CCNC(=O)[C@H](c1ccco1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06134605_decoy,TRY1,Decoy,0,-8.25092,-6.17,-2.68,-7.42949639921513
CCOC(=O)CNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06547025_decoy,TRY1,Decoy,0,-7.5052,-6.98,-0.71,-6.672420993620607
C[C@@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)[C@H]([NH3+])CCC(=O)[O-],C09233576_decoy,TRY1,Decoy,0,-8.49917,-5.8,-3.47,-5.948173531939354
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@](C)(CO)[C@@](C)(O)[C@@]1(C)O,C09915658_decoy,TRY1,Decoy,0,-6.68,-6.81,-1.63,-4.721602888526788
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3cc(Cl)ccc23)O[C@](C)(CO)[C@](C)(O)[C@@]1(C)O,C09915665_decoy,TRY1,Decoy,0,-7.77941,-5.32,-1.73,-6.260147087013371
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2)cc1,C12702119_decoy,TRY1,Decoy,0,-8.24476,-5.19,-3.97,-5.598246857078199
NC(=O)c1nsc(C(=O)N(Cc2ccccc2Cl)[C@H](C(=O)NC2CCCC2)c2ccco2)c1N,C12703379_decoy,TRY1,Decoy,0,-9.97411,-7.51,-1.09,-10.900043233228264
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c(CC=C(C)C)c3o2)cc1,C14984439_decoy,TRY1,Decoy,0,-8.66003,-6.36,-3.93,-5.949454748698333
O=c1[nH]c2ccccc2nc1/C(=N\Nc1ccc(I)cc1)[C@H](O)[C@@H](O)CO,C15774854_decoy,TRY1,Decoy,0,-8.49853,-8.36,-0.95,-8.224273529418301
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(I)nc32)[C@H](O)[C@@H]1O,C16052106_decoy,TRY1,Decoy,0,-7.74436,-4.86,-1.36,-4.849469587207415
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Cl)cc(Cl)c3[O-])n2)CC(C)(C)[NH2+]1,C20834431_decoy,TRY1,Decoy,0,-9.44014,-6.17,-2.61,-5.842329858511562
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]4O)ccc(c23)C1,C22056277_decoy,TRY1,Decoy,0,-5.86836,-6.17,-1.93,-3.939961236203288
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@H]4O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]4O)ccc(c23)C1,C22056281_decoy,TRY1,Decoy,0,-7.02928,-7.44,-3.66,-4.703343534905826
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(I)nc32)[C@@H](O)[C@H]1O,C22061455_decoy,TRY1,Decoy,0,-7.72249,-5.64,-1.49,-4.853740698914923
C[C@H]1CC[C@H]2C(C)(C)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]2(C)[C@@]1(O)CCC1=CCOC1=O,C31169014_decoy,TRY1,Decoy,0,-7.4701,-6.25,-3.04,-6.1202873829036974
Cc1coc2c(C)c3oc(=O)c(CCC(=O)N(C)C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(C)c3cc12,C12892791_decoy,TRY1,Decoy,0,-8.85824,-6.54,-3.98,-5.710085050071
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(I)nc32)[C@@H](O)[C@@H]1O,C33525087_decoy,TRY1,Decoy,0,-6.82101,-5.09,-1.13,-4.709614046036954
CC(C)(C)N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1ccc(Cl)s1,C33736104_decoy,TRY1,Decoy,0,-8.51315,-6.11,-1.2,-6.145650022106031
CN(C)c1ccc(O)c2c1C[C@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@H]1C2=O,C35024907_decoy,TRY1,Decoy,0,-8.54671,-5.7,-2.73,-4.687065114221686
CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@@]3(O)C(=O)[C@@H]1C2=O,C35565168_decoy,TRY1,Decoy,0,-8.85387,-5.8,-1.87,-5.273961980911255
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]4O)ccc(c23)C1,C35643818_decoy,TRY1,Decoy,0,-6.45403,-7.94,-2.04,-4.874534376118381
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1,C12711219_decoy,TRY1,Decoy,0,-8.45439,-6.76,-3.8,-7.941881637910728
CN(C)c1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C06135844_decoy,TRY1,Decoy,0,-10.0106,-6.48,-2.34,-6.82617267365513
CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@@H]1C2=O,C36378578_decoy,TRY1,Decoy,0,-7.94204,-5.18,-3.49,-5.130176792059218
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@@]3(O)C(=O)[C@H]1C2=O,C36385342_decoy,TRY1,Decoy,0,-8.81742,-6.42,-1.22,-5.452272088054597
NN1[C@@H](SCC(=O)Nc2ccc(Br)cc2)NN[C@H]1[C@H]1C=C(c2ccc(Cl)cc2)N=N1,C39000501_decoy,TRY1,Decoy,0,-10.5216,-6.65,-1.69,-6.646468684107918
Cc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccc(F)c(Cl)c4)N3N)N=N2)cc1,C39021329_decoy,TRY1,Decoy,0,-10.9065,-9.45,-2.4,-9.516920431467662
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@H]1C2=O,C39273214_decoy,TRY1,Decoy,0,-6.48815,-6.98,-3.83,-6.461624658453007
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@H]1C2=O,C39273215_decoy,TRY1,Decoy,0,-7.38735,-7.26,-3.29,-5.172412354737867
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]4O)ccc(c23)C1,C39937000_decoy,TRY1,Decoy,0,-6.75385,-7.63,-0.9,-5.032744313751548
Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1Nc1ccc(Br)cn1,C40779801_decoy,TRY1,Decoy,0,-7.71294,-6.17,-2.04,-5.087612903841263
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@@H]3[C@@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@@]3(O)C(=O)[C@H]1C2=O,C43764020_decoy,TRY1,Decoy,0,-7.72183,-6.02,-1.26,-4.230905088478147
C[NH+]1CC[C@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]4O)ccc(c23)C1,C44019826_decoy,TRY1,Decoy,0,-6.62679,-7.25,-1.81,-5.36671704985103
C[NH+]1CC[C@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@@H]4O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]4O)ccc(c23)C1,C44019829_decoy,TRY1,Decoy,0,-6.68414,-8.27,-2.0,-5.2179447503849445
CN(C)c1ccc2c(c1O)C(=O)[C@H]1C(=O)[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@H]3C[C@@H]1C2,C44021601_decoy,TRY1,Decoy,0,-7.7109,-7.8,-3.39,-5.527373607753767
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]4O)ccc(c23)C1,C44963095_decoy,TRY1,Decoy,0,-5.46086,-7.07,-1.22,-4.310945793225732
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(Br)cc2)NC(=O)N1,C59385517_decoy,TRY1,Decoy,0,-9.06744,-6.1,-2.04,-6.055467832922006
CC1=C(C(=O)N/N=C/c2cccc(Br)c2)[C@@H](c2ccc(O)cc2O)NC(=O)N1,C59385780_decoy,TRY1,Decoy,0,-8.81328,0.43,-1.93,-2.781744408248349
CC1=C(C(=O)N/N=C/c2cccc(Br)c2)[C@@H](c2ccc(O)cc2O)NC(=O)N1,C59385780_decoy,TRY1,Decoy,0,-8.81328,0.43,-1.96,-2.781744408248349
C[C@]12CC[C@H](O[C@H]3O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]3O)C=C1CC[C@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O,C61389327_decoy,TRY1,Decoy,0,-8.83966,-7.4,-3.7,-5.561008155473758
C[C@]12CC[C@H](O[C@H]3O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]3O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O,C61389338_decoy,TRY1,Decoy,0,-9.21772,-7.33,-2.94,-5.737615469237084
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1Nc2ccccc2C(=O)N1CCCO,C39782136_decoy,TRY1,Decoy,0,-9.49538,-7.89,-2.57,-7.317575417331258
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(C3CCCCC3)cc2)=N[C@@H]2NC(=O)NC(=O)[C@H]12,C63279604_decoy,TRY1,Decoy,0,-7.21563,-5.48,-0.83,-4.585802513112337
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(C3CCCCC3)cc2)=N[C@@H]2NC(=O)NC(=O)[C@@H]12,C63279606_decoy,TRY1,Decoy,0,-9.18744,-6.39,-0.54,-5.975290171407896
Cc1[nH]nc(O)c1[C@@H](C1=C(O)N=N[C@@H]1C)c1cc(Br)c(O)c(Br)c1O,C39344330_decoy,TRY1,Decoy,0,-7.48465,-6.42,-1.36,-5.609539863983643
Cc1[nH]nc(O)c1[C@@H](C1=C(O)N=N[C@H]1C)c1cc(Br)c(O)c(Br)c1O,C39344331_decoy,TRY1,Decoy,0,-7.90276,-5.97,-4.02,-5.797895574789601
CCOC(=O)c1c(C[NH+](C)C)n(C)c2c(O)c(/N=[NH+]/C(N)=O)c3ccc(Br)cc3c12,C12470955_decoy,TRY1,Decoy,0,-6.77381,-5.86,-1.58,-5.253991113897294
C[NH+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c(O[C@H]4O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]4O)ccc(c23)C1,C65739968_decoy,TRY1,Decoy,0,-5.08544,-7.08,-0.38,-4.1789039071782685
CCNC(=O)[C@@H]1O[C@@H](n2cnc3c(N)nc(I)nc32)[C@@H](O)[C@@H]1O,C33525086_decoy,TRY1,Decoy,0,-5.91417,-5.57,-2.13,-4.357103845554904
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@@H](O)[C@@H]1O,C33358918_decoy,TRY1,Decoy,0,-6.75059,-6.53,-3.7,-5.157760078150443
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2-c2ccc(C)cc2)ccc1O,C02374831_decoy,TRY1,Decoy,0,-8.75525,-7.27,-4.4,-8.010676673772345
O=C([O-])[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2O)[C@H](O)[C@H](O)[C@@H]1O,C05222930_decoy,TRY1,Decoy,0,-6.83168,-7.57,-3.76,-4.801554547465548
N#CC(C#N)=C1c2cc(S(N)(=O)=O)cc([N+](=O)[O-])c2-c2c1cc(S(N)(=O)=O)cc2[N+](=O)[O-],C08626851_decoy,TRY1,Decoy,0,-6.94853,-6.28,-3.91,-5.198376854453533
O=C([O-])[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2O)[C@H](O)[C@@H](O)[C@@H]1O,C08952594_decoy,TRY1,Decoy,0,-6.93021,-6.62,-4.57,-5.095094101990203
O=C([O-])[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,C12153664_decoy,TRY1,Decoy,0,-8.04593,-8.7,-3.5,-6.235925913239173
CC(C)n1c(O)c([C@@H]2c3ccc(O)cc3Oc3[nH]c(=O)n(C(C)C)c(=O)c32)c(=O)[nH]c1=O,C13556826_decoy,TRY1,Decoy,0,-8.50658,-6.35,-0.62,-5.526722245969257
O=C(CCSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1ccccc1[N+](=O)[O-],C20906667_decoy,TRY1,Decoy,0,-7.74137,-8.78,-1.7,-9.009785639300214
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]1O,C22066996_decoy,TRY1,Decoy,0,-5.48436,-9.4,-5.1,-6.855678559266419
O=C(Nn1nc2c(n1)C(=NO)c1nn(NC(=O)C(F)(F)F)nc1C2=NO)C(F)(F)F,C22204400_decoy,TRY1,Decoy,0,-6.4818,-7.14,-1.53,-6.273923171145712
NC(=S)N/N=C(/c1nc2ccc([N+](=O)[O-])cc2nc1[O-])[C@@H](O)c1ccc([N+](=O)[O-])cc1,C05317294_decoy,TRY1,Decoy,0,-7.56306,-6.86,-2.74,-7.0670649669661145
CNc1ccccc1C(=O)O[C@@H]1[C@@H]2O[P@@](=O)([O-])OC[C@H]2O[C@@H]1n1cnc2c(=O)[nH]c(N)nc21,C33696591_decoy,TRY1,Decoy,0,-5.67511,-6.28,-1.08,-5.310317573066252
CNc1ccccc1C(=O)O[C@H]1[C@@H]2O[P@@](=O)([O-])OC[C@H]2O[C@@H]1n1cnc2c(=O)[nH]c(N)nc21,C33696592_decoy,TRY1,Decoy,0,-6.8006,-7.98,-1.25,-6.516893701538432
CC[C@H](C)N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)C[C@@]2(C(=O)N=C([O-])NC2=O)[C@@H]2C[NH+](C)CCN32)C1=O,C35435268_decoy,TRY1,Decoy,0,-7.93007,-8.35,-2.6,-6.072350918070336
Cc1cn([C@H]2C[C@@H](N=[N+]=[N-])[C@@H](CO[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)O2)c(=O)[nH]c1=O,C35636387_decoy,TRY1,Decoy,0,-6.27795,-7.17,-2.99,-5.249759673555554
Cc1cc(N([C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)S(=O)(=O)c2ccc(N)cc2)no1,C35653172_decoy,TRY1,Decoy,0,-5.32901,-8.17,-1.6,-6.847355037601865
Cc1cc(N([C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)S(=O)(=O)c2ccc(N)cc2)no1,C35653174_decoy,TRY1,Decoy,0,-6.27918,-7.44,-5.04,-8.81646027257079
CN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36530110_decoy,TRY1,Decoy,0,-6.26411,-5.45,-3.87,-4.836109447176505
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530117_decoy,TRY1,Decoy,0,-7.17247,-5.42,-2.26,-5.3578473867442735
COc1c(O)cc2c(=O)oc3c(OC)c(O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)cc4c(=O)oc1c2c34,C36378703_decoy,TRY1,Decoy,0,-6.62894,-7.5,-2.63,-4.667486223716145
O=C([O-])[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,C13543704_decoy,TRY1,Decoy,0,-8.58314,-8.37,-1.51,-7.78046415005408
COc1c(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,C28537647_decoy,TRY1,Decoy,0,-6.77649,-6.99,-2.62,-5.293272750144311
Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])OP(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1,C38655423_decoy,TRY1,Decoy,0,-7.29318,-6.34,-1.06,-6.416347034275828
C[C@@]1(NC(=O)N[C@H]2CS(=O)(=O)C[C@H]2NC(=O)N[C@@]2(C)CCS(=O)(=O)C2)CCS(=O)(=O)C1,C37531779_decoy,TRY1,Decoy,0,-8.66455,-5.39,-2.2,-5.9102932172170375
O=C(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])NC1=NC(=O)C2=NCN([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)C2=N1,C39795775_decoy,TRY1,Decoy,0,-4.78245,-8.73,-2.66,-5.781835360839399
Nc1nnc2n1N[C@@H]([C@@H](C(=O)c1ccc(F)cc1)c1nn3c(N)nnc3nc1[O-])C(=O)N2,C39944231_decoy,TRY1,Decoy,0,-7.80292,-9.37,-1.68,-8.649426925037703
Nc1nnc2n1N[C@@H]([C@H](C(=O)c1ccc(F)cc1)c1nn3c(N)nnc3nc1[O-])C(=O)N2,C39944232_decoy,TRY1,Decoy,0,-7.51319,-9.06,-1.89,-11.000796360443282
O=C(Cc1ccc([N+](=O)[O-])cc1)NNc1ncnc(NNc2ccccc2)c1[N+](=O)[O-],C40624608_decoy,TRY1,Decoy,0,-5.96161,-8.08,-3.04,-6.4411395743714825
CC(C)(C)NNc1ncnc(NNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1[N+](=O)[O-],C40658659_decoy,TRY1,Decoy,0,-7.20243,-6.07,-3.01,-5.944626119600961
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]1O,C44028959_decoy,TRY1,Decoy,0,-6.50195,-5.95,-2.4,-5.021593303005627
C[C@H]1CCCC(=O)CCC/C=C/c2cc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c2C(=O)O1,C44964262_decoy,TRY1,Decoy,0,-7.00241,-6.72,-3.46,-4.302659638389068
Cn1cnnc1SCc1c(C(=O)N/N=C/c2ccccc2O)nnn1-c1nonc1N,C02605617_decoy,TRY1,Decoy,0,-9.00998,-6.09,-2.15,-6.144918364886046
O=[N+]([O-])c1ccc(O)c(/C=N/Nc2nc(SCc3nc4ccc([N+](=O)[O-])cc4[nH]3)n[nH]2)c1,C21075505_decoy,TRY1,Decoy,0,-8.06571,-6.49,-3.15,-5.965026070441776
CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1,C21364678_decoy,TRY1,Decoy,0,-8.072,-8.74,-3.64,-7.347878305104829
O=C(Nc1ccc(Oc2ccnc3[nH]c(=O)[nH]c23)cc1)Nc1nnc([C@@H]2CCCO2)s1,C49066846_decoy,TRY1,Decoy,0,-7.32943,-7.97,-1.7,-6.088858047889649
O=C1N=C([O-])C2=Nc3ccc(N4CCCCC4)cc3N(C[C@H](O)[C@H](O)[C@H](O)CO)[C@@H]2N1,C16431243_decoy,TRY1,Decoy,0,-9.62015,-6.17,-2.05,-6.447075217274056
CCCN1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@H]2CN(C)CCN32)C1=O,C18098359_decoy,TRY1,Decoy,0,-8.21407,-6.89,-1.52,-7.936380204949123
CCN1CCN2c3ccc(N/C=C4/C(=O)NC(=O)N(C(C)C)C4=O)cc3CC3(C(=O)NC(=O)NC3=O)[C@@H]2C1,C16975690_decoy,TRY1,Decoy,0,-7.41505,-7.91,-2.01,-5.466850111347265
Nc1ccccc1/N=N\c1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(O)c2c1O,C13703916_decoy,TRY1,Decoy,0,-7.37441,-5.59,-1.15,-5.674555415992005
N#Cc1c(CCCNc2ncc([N+](=O)[O-])c(NC3CC3)n2)nn(-c2ccc(F)cc2)c1N,C59333679_decoy,TRY1,Decoy,0,-7.53225,-8.0,-1.89,-6.416784498648841
NC(=S)N1N=C(c2ccc([N+](=O)[O-])cc2)/C(=N/Nc2cccc3c([O-])n[nH]c(=O)c23)C1=O,C59461649_decoy,TRY1,Decoy,0,-8.2824,-8.38,-1.97,-7.61635561394524
COc1cccc(/C=N/NC(=O)c2nonc2C(=O)N/N=C/c2cccc(OC)c2O)c1O,C59503392_decoy,TRY1,Decoy,0,-8.33888,-8.33,-1.65,-8.282789685071256
O=C1O[C@@H]([C@H](O)CO)C(=N\Nc2ccc([N+](=O)[O-])cc2)/C1=N/Nc1ccc([N+](=O)[O-])cc1,C15775027_decoy,TRY1,Decoy,0,-7.38565,-6.48,-2.04,-5.28063082621304
O=C1O[C@H]([C@@H](O)CO)C(=N\Nc2ccc([N+](=O)[O-])cc2)/C1=N/Nc1ccc([N+](=O)[O-])cc1,C15775033_decoy,TRY1,Decoy,0,-7.09097,-7.2,-4.37,-5.6853056585791615
O=C1O[C@@H]([C@H](O)CO)C(=N\NC(=O)c2ccccc2[O-])/C1=N/NC(=O)c1ccccc1O,C15775086_decoy,TRY1,Decoy,0,-9.13553,-5.58,-4.31,-7.485966873593739
O=C1O[C@H]([C@H](O)CO)C(=N\NC(=O)c2ccccc2[O-])/C1=N/NC(=O)c1ccccc1O,C15775090_decoy,TRY1,Decoy,0,-9.40192,-8.79,-1.91,-7.333808950294585
O=C(N/N=C(/c1nc2cc(Cl)ccc2nc1[O-])[C@@H](O)[C@@H](O)CO)c1ccc([N+](=O)[O-])cc1,C15775298_decoy,TRY1,Decoy,0,-9.51827,-7.44,-2.45,-9.365384241707968
CCN1CC(C(=O)NCC(=O)Nc2c[nH]c(=O)[nH]c2=O)=C([O-])c2cc3c(cc21)OCO3,C63493140_decoy,TRY1,Decoy,0,-7.91527,-8.37,-0.77,-6.113996250497506
Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@H](CO[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)O2)c(=O)[nH]c1=O,C34871039_decoy,TRY1,Decoy,0,-5.67811,-6.83,-2.78,-5.005633178247201
Nc1nnc(-c2cccc(Cl)c2Cl)c(N[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)n1,C65743131_decoy,TRY1,Decoy,0,-7.46153,-5.99,-2.89,-5.541997502955791
C[C@H]1CCCC(=O)CCC/C=C/c2cc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c2C(=O)O1,C65749688_decoy,TRY1,Decoy,0,-6.74303,-7.27,-2.26,-4.453223710105207
CC(=O)N1CCN(C(=O)C[C@@H]2c3nc(NC(=O)c4ccnc(Cl)c4)sc3C[C@@H]3[C@](C)(CO)[C@H](O)CC[C@]32C)CC1,C04222390_decoy,TRY1,Decoy,0,-12.7113,-6.29,-2.63,-7.657053111760172
Fc1ccc(NC(=S)N[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3n2nnnc2Oc2ccc(-n3ccnc3)cc2)cc1,C04147886_decoy,TRY1,Decoy,0,-8.47518,-6.96,-1.68,-5.549539469700455
CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)/C=C/c2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)c1C,C03376134_decoy,TRY1,Decoy,0,-8.31974,-6.91,-2.85,-6.61625289771906
O=C(Nc1cccc2ccccc12)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2n1nnnc1Oc1ccc(-n2cncn2)cc1,C04259858_decoy,TRY1,Decoy,0,-7.85455,-9.51,-2.13,-6.607498363583963
CN(C(=O)C(=O)NC[C@@H](c1ccc2c(c1)OCO2)S(=O)(=O)c1cccs1)[C@@H]1CCS(=O)(=O)C1,C08970053_decoy,TRY1,Decoy,0,-9.95977,-8.54,-2.26,-9.342613441516246
O=S1(=O)C[C@@H](S(=O)(=O)N2CCC[C@H]2c2nnc(S(=O)(=O)Cc3ccccc3F)o2)[C@@H](O)C1,C09024075_decoy,TRY1,Decoy,0,-9.0437,-6.93,-2.24,-6.21147671532919
CC(=O)N[C@@H]1[C@@H](OC(=O)c2ccc(Br)o2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C09974844_decoy,TRY1,Decoy,0,-6.5603,-5.14,-1.82,-5.558852224751794
COc1ccc(N2C[C@H](C(=O)Nc3c4c(nn3-c3ccc([N+](=O)[O-])cc3)CS(=O)(=O)C4)CC2=O)cc1,C12032997_decoy,TRY1,Decoy,0,-7.50241,-9.21,-2.18,-6.503636353150293
O=C(Nc1c2c(nn1-c1ccc([N+](=O)[O-])cc1)CS(=O)(=O)C2)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1,C12033004_decoy,TRY1,Decoy,0,-8.85918,-6.5,-1.9,-6.154297991018089
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C/c1cccc([N+](=O)[O-])c1)n2C[C@H](O)COc1ccc(Cl)cc1,C05351442_decoy,TRY1,Decoy,0,-9.91745,-6.49,-3.48,-6.868737833390239
Cc1c(NC(=O)c2c(NC(=O)[C@@H](C)n3nc(C(F)(F)F)c(Br)c3C)cnn2C)cnn1C,C02799743_decoy,TRY1,Decoy,0,-7.1239,-5.61,-1.7,-6.545643227381708
COc1ccccc1NC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)Nc2ccccc2OC)[C@H]1c1cnn(C)c1C,C13960850_decoy,TRY1,Decoy,0,-8.38303,-6.73,-2.59,-6.124171209309092
CCOC(=O)c1c(NC(=O)CSCC(=O)NNc2oc(C)cc(=O)c2C(C)=O)sc2c1CCCC2,C15022103_decoy,TRY1,Decoy,0,-10.5278,-6.66,-2.89,-7.588930553512919
COc1ccc2cc([C@@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccccc4F)CC3)c(=O)[nH]c2c1,C19940437_decoy,TRY1,Decoy,0,-8.98443,-6.66,-2.15,-6.123091693513734
COc1ccc2[nH]c(=O)c([C@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccc(F)cc4)CC3)cc2c1,C19940664_decoy,TRY1,Decoy,0,-9.41295,-8.07,-1.96,-6.690232035554367
Cc1cc2cc([C@@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(C(=O)c4ccco4)CC3)c(=O)[nH]c2cc1C,C19940841_decoy,TRY1,Decoy,0,-9.0266,-6.35,-1.57,-6.256913364795397
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(CCN2CCOCC2)C(=O)Cn2nnc(-c3ccc(C)o3)n2)cc1,C19941054_decoy,TRY1,Decoy,0,-8.5572,-8.07,-0.67,-7.354731958963999
O=c1[nH]c2cc3c(cc2cc1[C@H](c1nnnn1C[C@@H]1CCCO1)N1CCN(Cc2ccccc2)CC1)OCO3,C20081105_decoy,TRY1,Decoy,0,-9.42445,-7.77,-1.93,-6.775098487172295
Cc1cc2cc([C@H](c3nnnn3Cc3ccco3)N3CCN(C(=O)c4ccco4)CC3)c(=O)[nH]c2cc1C,C01381891_decoy,TRY1,Decoy,0,-9.09574,-7.23,-1.88,-6.528988338504552
COc1ccccc1CN(Cc1cc2cc(OC)c(OC)cc2[nH]c1=O)Cc1nnnn1C[C@H]1CCCO1,C20109363_decoy,TRY1,Decoy,0,-8.7173,-7.5,-2.78,-7.387837067256683
CCOc1ccc(N2C[C@@H](C(=O)Nc3nnc([C@@H]4CC(=O)N(c5ccc(OC)cc5)C4)s3)CC2=O)cc1,C20584825_decoy,TRY1,Decoy,0,-10.473,-9.91,-3.7,-8.37388081926014
COc1c(OC)c([C@]2(O)C(=O)N(C)c3ccccc32)c(OC)c(OC)c1[C@@]1(O)C(=O)N(C)c2ccccc21,C17175839_decoy,TRY1,Decoy,0,-6.67213,-6.52,-3.11,-7.470594202933557
Cc1cc2c(cc1S(=O)(=O)N1CCC(C(=O)N(Cc3ccco3)C[C@H]3CCCO3)CC1)OCC(=O)N2,C32958682_decoy,TRY1,Decoy,0,-7.53425,-8.81,-2.55,-6.3072737630876
CCCN1CCN(C(=O)[C@@H]2CCCN(C(=O)c3nnc(C(=O)Nc4ccc5c(c4)OCO5)s3)C2)CC1,C33024771_decoy,TRY1,Decoy,0,-10.1343,-8.57,-1.57,-8.366450245547691
CCOc1cc2[nH]c(=O)n(CC3CCC(C(=O)NCCCN4CCOCC4)CC3)c(=O)c2cc1OCC,C20616870_decoy,TRY1,Decoy,0,-9.68787,-7.06,-3.36,-6.603945685369507
O=C1/C(=C\c2c(NCCOCCO)nc3ccccn3c2=O)SC(=S)N1[C@@H]1CCS(=O)(=O)C1,C33724333_decoy,TRY1,Decoy,0,-8.21454,-6.21,-2.56,-5.352008456548768
COc1cc([C@@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CC[NH+](C)C)cc(OC)c1OC,C35057349_decoy,TRY1,Decoy,0,-8.69901,-5.39,-3.49,-5.714551623652512
CC(=O)OC[C@H]1O[C@@H](OC2=CC(=O)c3c(O)cccc3C2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C33931861_decoy,TRY1,Decoy,0,-5.97107,-6.8,-1.91,-5.047074610928034
CC(=O)OC[C@@H]1O[C@@H](OC2=CC(=O)c3c(O)cccc3C2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C33931862_decoy,TRY1,Decoy,0,-6.32868,-7.7,-2.68,-6.019571856730074
COc1ccccc1-n1nc(-c2c(C)nc3scc(CC(=O)NCCN4CCOCC4)n3c2=O)cc1C,C35912045_decoy,TRY1,Decoy,0,-7.25093,-6.34,-2.26,-5.539225704914225
COCC(=O)N(Cc1ccco1)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1,C36505557_decoy,TRY1,Decoy,0,-8.09312,-7.56,-3.5,-6.621493797143375
COCC(=O)N(Cc1ccco1)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)c(OC)c1,C36505647_decoy,TRY1,Decoy,0,-9.0093,-7.42,-2.63,-7.1742165410806535
Cc1ccc(-c2nnn(CC(=O)N(Cc3cccs3)[C@@H](C(=O)NC[C@H]3CCCO3)c3ccco3)n2)o1,C12716757_decoy,TRY1,Decoy,0,-8.79041,-6.44,-3.41,-7.021097883970904
CCOc1cc(/C=N/NC(=O)C(=O)NCc2ccc3c(c2)OCO3)ccc1OCC(=O)N1CCOCC1,C08452410_decoy,TRY1,Decoy,0,-9.1549,-6.2,-2.12,-5.762105174040382
CC(C)S(=O)(=O)c1ccc(NS(=O)(=O)[O-])c(N2CC[NH2+][C@H](S(=O)(=O)Oc3ccccc3)C2)c1,C39483064_decoy,TRY1,Decoy,0,-9.29308,-6.25,-2.0,-5.835660275204021
CCn1c(S[C@H](C)C(=O)Nc2nnc(C3CC3)s2)nnc1[C@H](C)NC(=O)Cc1ccc(OC)cc1,C39763405_decoy,TRY1,Decoy,0,-10.3595,-7.5,-4.37,-6.915621926381702
COc1cc([C@@H]2c3c(-c4cc(C)ccc4O)n[nH]c3C(=O)N2[C@@H]2CCS(=O)(=O)C2)cc(OC)c1OC,C38701924_decoy,TRY1,Decoy,0,-7.73991,-6.63,-3.07,-7.133583944821378
C[C@@]1(CCC2CC2)CN(C2CCC2)C(=O)[C@@H](C2=NS(=O)(=O)c3cc([N-]S(C)(=O)=O)ccc3N2)C1=O,C45245174_decoy,TRY1,Decoy,0,-9.01837,-4.92,-1.52,-5.395015308820889
COc1ccc(CCn2c([O-])c([C@H]3c4c(cc5c(c4OC)OCO5)CC[NH+]3C)c(=O)[nH]c2=O)cc1OC,C20113652_decoy,TRY1,Decoy,0,-7.21499,-5.8,-5.24,-6.228524904723432
O=c1[nH]c2cc3c(cc2cc1CN(Cc1ccc2c(c1)OCO2)Cc1nnnn1Cc1ccc(F)cc1)OCCO3,C01373934_decoy,TRY1,Decoy,0,-9.26614,-9.45,-1.54,-2.848881334453284
O=c1[nH]c2cc3c(cc2cc1CN(Cc1cccnc1)Cc1nnnn1CCc1ccccc1)OCCO3,C01373982_decoy,TRY1,Decoy,0,-9.2814,-7.24,-2.57,-7.201244805986343
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1ccc(F)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C01374815_decoy,TRY1,Decoy,0,-8.78521,-6.9,-2.98,-6.767525435266867
CCCc1nnc2sc(-c3cc(NC(=O)CN4CCOCC4)cc(NC(=O)CN4CCOCC4)c3)nn12,C57335418_decoy,TRY1,Decoy,0,-10.2361,-6.48,-3.01,-6.657548218780943
COc1ccc(CN(Cc2cc3cc4c(cc3[nH]c2=O)OCCO4)Cc2nnnn2C[C@H]2CCCO2)cc1,C57640443_decoy,TRY1,Decoy,0,-10.0626,-7.58,-1.69,-8.01530762391342
COCc1c(Br)c(C)n(CC(=O)N/N=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)c(=O)c1C#N,C59639795_decoy,TRY1,Decoy,0,-6.72579,-5.96,-2.19,-5.631695104906587
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(C)cc3)c(OC)c2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C15936105_decoy,TRY1,Decoy,0,-8.40586,-7.52,-2.5,-5.8302208809786205
CC(=O)N[C@H]1[C@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C62725241_decoy,TRY1,Decoy,0,-6.23135,-6.59,-2.48,-5.18527319091383
CC(=O)N[C@@H]1[C@@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C62725243_decoy,TRY1,Decoy,0,-7.33888,-6.17,-2.06,-5.830882395252406
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(C)cc3)c(OC)c2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077763_decoy,TRY1,Decoy,0,-7.88137,-6.99,-3.37,-6.186705334977525
COc1cc(C2=NN=C3OC(N)=C(C#N)[C@H](c4cc(OC)c(OC(C)=O)c(OC)c4)[C@H]32)cc(OC)c1OC,C08410178_decoy,TRY1,Decoy,0,-7.58871,-6.12,-3.12,-5.844604618678689
C/C(=N\NC(N)=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C04565804_decoy,TRY1,Decoy,0,-8.0677,-6.48,-2.32,-4.958697271039634
Nc1nc(N)nc(CNc2c(Br)cc(Br)cc2Br)n1,C01607505_decoy,TRY1,Decoy,0,-8.32744,-6.29,-1.07,-9.358862961401757
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC=C2C3=C/C(=N\O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]21C,C09186530_decoy,TRY1,Decoy,0,-10.5977,-6.46,-3.3,-6.557053123262309
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC=C2C3=C/C(=N\O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@@]21C,C09186531_decoy,TRY1,Decoy,0,-10.0063,-7.79,-1.75,-6.239086605593386
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC=C2C3=C/C(=N\O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]21C,C09186532_decoy,TRY1,Decoy,0,-9.9912,-7.71,-2.12,-6.999921347063486
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915617_decoy,TRY1,Decoy,0,-7.12942,-6.36,-3.52,-4.919528592364751
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915618_decoy,TRY1,Decoy,0,-6.93204,-6.15,-3.64,-4.758107175672088
C[C@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915650_decoy,TRY1,Decoy,0,-7.39451,-6.68,-3.46,-4.87471740132984
C[C@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915651_decoy,TRY1,Decoy,0,-7.41884,-5.66,-3.86,-4.664907775266296
C[C@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@]1(C)O,C09915652_decoy,TRY1,Decoy,0,-7.60326,-5.62,-1.35,-4.890546848130978
C[C@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@]1(C)O,C09915653_decoy,TRY1,Decoy,0,-8.00905,-5.85,-1.22,-5.0593867239495625
C[C@@]1(Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915686_decoy,TRY1,Decoy,0,-8.7029,-6.81,-1.25,-5.732655610620991
C[C@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915768_decoy,TRY1,Decoy,0,-7.4308,-5.57,-3.46,-4.562466861202787
C[C@@]1(Oc2c[nH]c3ccc(Br)cc23)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915772_decoy,TRY1,Decoy,0,-6.28511,-5.63,-2.76,-4.046815509234893
C[C@@]1(Oc2c[nH]c3ccc(Br)cc23)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915773_decoy,TRY1,Decoy,0,-6.52862,-6.06,-2.15,-4.775855591147016
C[C@@]1(Oc2c[nH]c3ccc(I)cc23)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970345_decoy,TRY1,Decoy,0,-7.58288,-6.61,-2.89,-4.809643664751012
C[C@@]1(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970508_decoy,TRY1,Decoy,0,-8.22367,-5.69,-1.48,-5.014449726129285
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC=C2C3=C/C(=N\O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]21C,C08789542_decoy,TRY1,Decoy,0,-9.8233,-8.0,-2.72,-6.343086471566895
CCC(C)(C)NC(=O)[C@H](c1ccc2ncccc2c1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06077471_decoy,TRY1,Decoy,0,-8.25032,-6.06,-1.45,-7.314528264349288
O=C(Oc1cc(O)c2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](O)C2)c1cc(O)c(O)c(O)c1,C14642868_decoy,TRY1,Decoy,0,-10.9356,-10.13,-1.12,-8.638879811493457
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@@H]1CC=C2C3=C/C(=N\O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@]21C,C15958603_decoy,TRY1,Decoy,0,-11.0243,-8.48,-1.87,-7.123881885298895
C/C(=N\NC(N)=O)[C@@]12OC(C)(C)O[C@@H]1C[C@@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C25664845_decoy,TRY1,Decoy,0,-8.43359,-6.83,-2.11,-5.254378090961615
Nc1ccc(/N=N/c2c(Br)cc(S(N)(=O)=O)cc2Br)c(N)n1,C17426438_decoy,TRY1,Decoy,0,-7.95214,-7.25,-1.64,-9.084294100346147
N#CC1=C(N)N(c2ccc(S(N)(=O)=O)cc2)C2=C(C(=O)CCC2)[C@@H]1c1ccc2[nH]ccc2c1,C31820827_decoy,TRY1,Decoy,0,-8.07184,-9.42,-1.22,-16.641068177169387
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC=C2C3=C/C(=N\O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]21C,C33957520_decoy,TRY1,Decoy,0,-10.3345,-7.23,-2.86,-7.485858680168695
O=C(NC1CCCCC1)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1ccccc1Cl,C36545179_decoy,TRY1,Decoy,0,-6.49269,-6.73,-2.26,-6.188251261071038
C/C(=N\NC(N)=O)[C@@]12OC(C)(C)O[C@@H]1C[C@@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,C37246032_decoy,TRY1,Decoy,0,-8.23218,-7.13,-2.9,-5.833195036905649
CN(C)c1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C06135935_decoy,TRY1,Decoy,0,-8.91223,-6.04,-1.41,-6.512591250796101
Cc1[nH]c2ccccc2c1-c1cc(-c2cc(-c3c(C)[nH]c4ccccc34)nc(N)n2)nc(N)n1,C01588368_decoy,TRY1,Decoy,0,-10.0004,-9.58,-2.56,-8.181413220770043
C[C@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C04228274_decoy,TRY1,Decoy,0,-10.7075,-9.11,-1.78,-6.8839313776733055
CCc1ccc(Nc2sc3c(-c4ccc(Cl)cc4)c(C#N)c(N)nc3c2C(N)=O)cc1,C39895245_decoy,TRY1,Decoy,0,-9.60558,-6.19,-2.58,-5.200117630914829
NC(=O)c1c(Nc2nc(NC3CCCCCC3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026421_decoy,TRY1,Decoy,0,-9.40678,-7.64,-2.84,-8.37402916439619
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@H](O)CC[C@@]4(C)[C@H]3CC[C@@]12C,C43742929_decoy,TRY1,Decoy,0,-10.7921,-5.93,-2.69,-6.694292115116485
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC=C2C3=C/C(=N\O)[C@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@]21C,C43743677_decoy,TRY1,Decoy,0,-9.90882,-7.98,-2.37,-7.404719542025084
C/C(=N\NC(N)=O)[C@]12OC(C)(C)O[C@@H]1C[C@@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@]4(C)[C@H]3CC[C@@]12C,C43760903_decoy,TRY1,Decoy,0,-8.20216,-8.88,-2.2,-8.308438049226698
CC(C)CC[C@@H](O)[C@@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C44607968_decoy,TRY1,Decoy,0,-9.46331,-7.72,-4.08,-7.014964131999066
C[C@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C45485195_decoy,TRY1,Decoy,0,-10.3423,-8.25,-2.11,-6.808218620811195
C[C@@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C45485197_decoy,TRY1,Decoy,0,-9.04231,-8.31,-1.61,-6.456728828541061
Cc1[nH]nc(O)c1C(c1cc(Br)c(O)c(Br)c1O)c1c(O)n[nH]c1C,C08984262_decoy,TRY1,Decoy,0,-7.52306,-5.15,-1.99,-5.192547217217072
N#Cc1c(N)nc2sc(C(=O)c3ccc(Cl)c(Cl)c3)c(N)c2c1-c1ccc(O)cc1,C20840832_decoy,TRY1,Decoy,0,-8.96118,-7.67,-2.63,-6.031995425259659
N#Cc1c(N)nc2sc(C(=O)c3cccc(Br)c3)c(N)c2c1-c1ccc(O)cc1,C20029179_decoy,TRY1,Decoy,0,-8.16021,-6.94,-2.38,-5.327723050823914
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(Br)cc2)NC(=S)N1,C59384231_decoy,TRY1,Decoy,0,-10.3869,-6.63,-2.42,-5.726474322909547
CC1=C(C(=O)N/N=C/c2ccc(Cl)cc2Cl)[C@H](c2ccc(O)cc2O)NC(=S)N1,C59385007_decoy,TRY1,Decoy,0,-10.4318,-5.67,-1.95,-7.145712870401072
CC(C)(O)CC[C@H](O)[C@@](C)(O)[C@@H]1CC=C2C3=C/C(=N/O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@]21C,C15958604_decoy,TRY1,Decoy,0,-10.8614,-6.37,-2.31,-6.359639436189739
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC=C2C3=C/C(=N/O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@]21C,C15958605_decoy,TRY1,Decoy,0,-11.655,-6.81,-2.99,-7.125189177200731
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@@H]1CC=C2C3=C/C(=N/O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@]21C,C15958606_decoy,TRY1,Decoy,0,-11.6371,-8.17,-2.49,-7.83506032838122
Cc1[nH]nc(O)c1[C@H](C1=C(O)N=N[C@@H]1C)c1cc(Br)c(O)c(Br)c1O,C39344332_decoy,TRY1,Decoy,0,-8.09968,-4.5,-1.78,-4.820998066401691
Cc1cc(Br)cc(Br)c1OCc1nc(N)nc(C)c1C(=O)NN,C66134455_decoy,TRY1,Decoy,0,-7.54282,-6.58,-1.44,-8.018836154404326
Nc1cc(Nc2cc(N)c3c(c2)C(=O)c2ccccc2C3=O)cc2c1C(=O)c1ccccc1C2=O,C03848528_decoy,TRY1,Decoy,0,-8.50732,-7.94,-3.51,-5.116010241610805
Nc1ccc(Nc2ccc(N)c3c2C(=O)c2ccccc2C3=O)c2c1C(=O)c1ccccc1C2=O,C03861401_decoy,TRY1,Decoy,0,-7.27046,-8.64,-2.27,-5.580213853843657
CC(C)[C@H](Sc1nnc(-c2ccc(Cl)cc2Cl)n1N)C(=O)NC(N)=O,C04313925_decoy,TRY1,Decoy,0,-8.943,-5.79,-1.67,-7.485599852042991
CC(C)[C@@H](Sc1nnc(-c2ccc(Cl)cc2Cl)n1N)C(=O)NC(N)=O,C04313926_decoy,TRY1,Decoy,0,-8.53908,-4.89,-2.39,-5.1915048478160895
Cc1c(O)cc(O)c(C2(c3c(O)cc(O)c(C)c3O)OC(=O)c3ccccc32)c1O,C04428282_decoy,TRY1,Decoy,0,-7.82718,-6.33,-3.44,-5.391073858470048
CC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@H]1c1ccc(Br)cc1,C05020240_decoy,TRY1,Decoy,0,-8.27147,-5.53,-1.87,-4.36754533304955
COc1ccc(Nc2cc(NCCO)c(N)c3c2C(=O)c2ccccc2C3=O)cc1,C05451910_decoy,TRY1,Decoy,0,-8.30014,-6.2,-1.35,-5.730314786881763
Nc1ccccc1NC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)Nc1ccccc1N,C01582541_decoy,TRY1,Decoy,0,-7.45741,-7.14,-0.72,-7.574993520886496
CC(C)(C)c1cc(O)c2o/c(=N\c3ccc(S(N)(=O)=O)cc3)c(C(N)=O)cc2c1,C04777324_decoy,TRY1,Decoy,0,-7.23087,-7.23,-4.41,-5.3144961523879095
C[C@@H](CCC(=O)NN)[C@@H]1CC[C@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C08497412_decoy,TRY1,Decoy,0,-10.0624,-7.1,-1.75,-9.690096517360034
C[C@@H](CCC(=O)NN)[C@H]1CC[C@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C,C08497416_decoy,TRY1,Decoy,0,-9.20473,-7.62,-2.11,-8.638289935147903
C[C@H](CCC(=O)NN)[C@@H]1CC[C@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C08534894_decoy,TRY1,Decoy,0,-9.26884,-6.49,-3.15,-5.879655922686291
C[C@H](CCC(=O)NN)[C@H]1CC[C@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C,C08534895_decoy,TRY1,Decoy,0,-9.27613,-7.4,-1.32,-5.845465272102934
C[C@]12CC/C(=N/NC(N)=O)C=C1CC[C@@H]1[C@H]3CC/C(=N\NC(N)=S)[C@@]3(C)CC[C@@H]12,C12660108_decoy,TRY1,Decoy,0,-8.83584,-6.81,-2.39,-5.403999250146095
C[C@]12CC/C(=N/NC(N)=O)C=C1CC[C@@H]1[C@H]2CC[C@]2(C)/C(=N/NC(N)=O)CC[C@H]12,C12660238_decoy,TRY1,Decoy,0,-8.64091,-5.64,-2.63,-4.926071110066731
C[C@@H](CCC(=O)[O-])[C@@H]1CC[C@@H]2[C@@H]3[C@@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@@H]1C[C@]31N[NH2+]1,C22057660_decoy,TRY1,Decoy,0,-7.15062,-5.18,-1.73,-4.647910205609635
C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@H]3[C@@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@@H]1C[C@@]31N[NH2+]1,C22057671_decoy,TRY1,Decoy,0,-9.1415,-7.19,-4.4,-5.710775572605629
C[C@@H](CCC(=O)[O-])[C@@H]1CC[C@H]2[C@@H]3[C@@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@@H]1C[C@@]31N[NH2+]1,C35644087_decoy,TRY1,Decoy,0,-7.38611,-4.88,-3.8,-4.4919304679099366
C[C@@H](CCC(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@H](O)[C@]12C)[C@@]1(C)CC[C@@H](O)C[C@@H]1C[C@]31N[NH2+]1,C35644094_decoy,TRY1,Decoy,0,-9.10664,-7.06,-3.09,-6.327528066235909
C[C@@]12CC[C@H]3[C@H](CCC4=C/C(=N\NC(N)=O)CC[C@]43C)[C@H]1CC/C2=N\NC(N)=O,C35882746_decoy,TRY1,Decoy,0,-7.74259,-5.58,-1.94,-4.344330545594903
Cc1ccc(N2C(=O)[C@@H]([C@H]3NCCc4c3[nH]c3ccccc43)[C@@H](O)N[C@H]2O)c(C)c1,C39037696_decoy,TRY1,Decoy,0,-7.22542,-5.58,-1.4,-4.502842624631106
Cc1ccc(-c2c(C#N)c(N)nc3sc(C(=O)Nc4cc(C)on4)c(N)c23)cc1,C39426156_decoy,TRY1,Decoy,0,-7.58333,-6.13,-2.08,-4.510391037337248
Cc1ccc(Nc2sc3c(-c4ccc(C)cc4)c(C#N)c(N)nc3c2C(N)=O)cc1,C39895235_decoy,TRY1,Decoy,0,-9.15658,-5.9,-2.36,-5.6119470438619405
C[C@H](Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N)c1ccccc1,C40760412_decoy,TRY1,Decoy,0,-8.26791,-7.34,-2.34,-6.212974347657913
CC(=O)Nc1ccc(Nc2ncnc(Nc3ccc(Br)cn3)c2N)cc1,C40779915_decoy,TRY1,Decoy,0,-8.16459,-6.31,-2.97,-5.202435376569992
Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Br)cc3)c2N)cc1,C40782045_decoy,TRY1,Decoy,0,-7.51813,-5.89,-1.13,-4.892861100120504
Nc1c(NNC(=O)c2ccc(F)cc2)ncnc1Nc1ccc(Br)cc1,C40782263_decoy,TRY1,Decoy,0,-8.08081,-5.8,-3.67,-5.128335546324448
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1ccc(F)cc1,C40782466_decoy,TRY1,Decoy,0,-9.17302,-5.87,-1.62,-6.294509745316539
Nc1cc(N)nc(SCc2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)n1,C31819177_decoy,TRY1,Decoy,0,-8.39601,-7.51,-1.63,-5.846739746390625
C[C@H](Sc1nc(N)cc(N)n1)c1nc2scc(-c3cccs3)c2c(=O)[nH]1,C43734921_decoy,TRY1,Decoy,0,-9.73622,-6.87,-1.07,-7.3122639185526355
C[C@@]12CC[C@@H]3[C@H](CCC4=C/C(=N\NC(N)=O)CC[C@]43C)[C@H]1CC/C2=N\NC(N)=S,C43737327_decoy,TRY1,Decoy,0,-10.1964,-7.87,-2.94,-7.422243715348174
C[C@@H](CCC(=O)[O-])[C@@H]1CC[C@H]2[C@@H]3[C@@H](C[C@H](O)[C@]21C)[C@]1(C)CC[C@@H](O)C[C@@H]1C[C@@]31N[NH2+]1,C44020054_decoy,TRY1,Decoy,0,-7.88967,-7.27,-2.45,-5.801597116356941
Cc1ccc(-c2c(C)sc3nc(CSc4nc(N)cc(N)n4)[nH]c(=O)c23)cc1,C31819195_decoy,TRY1,Decoy,0,-8.95516,-7.8,-1.17,-7.125212590998318
Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2cc(O)c(O)c(Cl)c2)c1Cl,C19635145_decoy,TRY1,Decoy,0,-9.64061,-5.34,-1.66,-6.265143029861304
Nc1cc(S(N)(=O)=O)ccc1Nc1cc(Br)ccc1Br,C49118392_decoy,TRY1,Decoy,0,-8.41054,-5.61,-0.37,-4.497118207396544
Nc1cc(Nc2cc(Br)ccc2Br)cc(S(N)(=O)=O)c1,C49118432_decoy,TRY1,Decoy,0,-7.80763,-5.48,-0.92,-5.1592529185015525
Cc1ncc(CO)c(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1O,C21730062_decoy,TRY1,Decoy,0,-11.0175,-6.46,-2.22,-6.36627704824409
Cc1cc(C)c(-c2csc(NC(=O)CSc3nc(N)cc(N)n3)n2)c(C)c1,C31818628_decoy,TRY1,Decoy,0,-9.82556,-8.17,-1.23,-6.513298550552054
N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)c(Cl)c3)c2[C@@H]1c1ccc(O)c(O)c1,C00985566_decoy,TRY1,Decoy,0,-6.98859,-5.33,-1.66,-3.96399946473869
C[C@H](OC(=O)c1ccc(Cl)cc1N)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C07302536_decoy,TRY1,Decoy,0,-10.6117,-7.39,-2.97,-8.116266089996403
COc1cc([C@H]2NC(=S)NC(C)=C2C(=O)N/N=C/c2ccccc2O)ccc1O,C05296329_decoy,TRY1,Decoy,0,-9.37333,-6.37,-0.71,-5.74582336613308
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@@H](c2ccccc2Cl)NC(=S)N1,C59384884_decoy,TRY1,Decoy,0,-8.23481,-6.39,-3.55,-5.446117325723264
COc1ccccc1/C=N/NC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(O)cc1O,C59384994_decoy,TRY1,Decoy,0,-9.19066,-7.89,-0.85,-8.030495289179925
CC1=C(C(=O)N/N=C/c2ccc(Cl)cc2)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59385011_decoy,TRY1,Decoy,0,-8.34721,-7.25,-1.54,-5.682950252643612
CC1=C(C(=O)N/N=C/c2ccccc2F)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59385017_decoy,TRY1,Decoy,0,-9.10966,-7.11,-1.88,-5.978993690357836
CC1=C(C(=O)N/N=C/c2ccccc2Cl)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59385023_decoy,TRY1,Decoy,0,-10.7641,-7.27,-1.13,-6.772010471532364
CC1=C(C(=O)N/N=C/c2ccc(F)cc2)[C@H](c2ccc(O)cc2O)NC(=S)N1,C59385033_decoy,TRY1,Decoy,0,-9.27595,-6.26,-1.93,-5.2500707093138415
CC1=C(C(=O)N/N=C/c2ccc(F)cc2)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59385034_decoy,TRY1,Decoy,0,-9.45505,-6.2,-1.2,-6.337313964555778
Nc1ccc(Oc2cc(Oc3ccc(N)cc3)cc(Oc3ccc(N)cc3)c2)cc1,C67176068_decoy,TRY1,Decoy,0,-9.53551,-8.07,-1.73,-10.367245318898988
CCOc1ccc2nc(NC(=O)c3sc4nc(N)c(C#N)cc4c3N)sc2c1,C67350723_decoy,TRY1,Decoy,0,-10.4682,-6.01,-1.9,-7.716703925428796
C[C@H](C(=O)NCC[NH+]1CCOCC1)[C@H]1CC[C@@]2(C)Cc3sc(NC(=O)C4CC4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840758_decoy,TRY1,Decoy,0,-8.85291,-6.27,-2.65,-5.891839307439399
COCCNC(=O)[C@@H](C)[C@@H]1CC[C@]2(C)Cc3sc(NC(=O)C[NH+](C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840955_decoy,TRY1,Decoy,0,-10.0808,-6.91,-2.66,-7.468453446911552
C[C@]1(CO)[C@H]2Cc3sc(-c4ccccc4)nc3[C@@H](CC(=O)NCC[NH+]3CCOCC3)[C@]2(C)CC[C@H]1O,C04222533_decoy,TRY1,Decoy,0,-10.1762,-7.49,-2.22,-7.935077284073718
OCC[NH+](CCO)C[C@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C00626537_decoy,TRY1,Decoy,0,-8.71352,-5.58,-1.57,-6.658376976237227
Cc1ccc(C2=NN(C(=O)C[NH2+][C@H](C)c3ccc(S(N)(=O)=O)cc3)[C@@H](c3cccs3)C2)o1,C09466635_decoy,TRY1,Decoy,0,-8.7402,-7.95,-1.9,-7.41461252306899
Cc1ccc(SCCCC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](Cc2ccccc2)C3)cc1,C09472914_decoy,TRY1,Decoy,0,-10.056,-7.06,-3.19,-6.594800198261134
C[C@H](c1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1-c1ccc(F)cc1)[NH+](C)C,C09512641_decoy,TRY1,Decoy,0,-11.699,-6.09,-2.88,-7.152115359571322
NC(=O)c1c(NC(=O)CCSc2ccc(Cl)cc2)sc2c1CC[NH+](Cc1ccccc1)C2,C09630264_decoy,TRY1,Decoy,0,-10.1155,-8.44,-1.76,-7.44094331312968
Cc1sc2nc(C[NH+]3CCC(C)CC3)nc(N[C@@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C,C09647498_decoy,TRY1,Decoy,0,-9.27256,-6.54,-2.07,-6.347064452501984
CCOc1cc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)cc(Br)c1OCC(N)=O,C09712601_decoy,TRY1,Decoy,0,-10.0132,-6.38,-4.14,-6.245258469832655
CC(C)Sc1ccc(CC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](Cc2ccccc2)C3)cc1,C12071264_decoy,TRY1,Decoy,0,-9.08584,-7.63,-2.5,-6.9309844170442885
CCc1nc2cc(N)cc(C(=O)NC[C@H](c3ccc(F)cc3)[NH+]3CCCC3)c2n1CCCOC,C12246170_decoy,TRY1,Decoy,0,-8.50254,-6.66,-2.25,-6.757994445934985
Cc1c(Cl)cccc1NC(=O)CNC(=O)C[NH+](C)CC(=O)Nc1c(Cl)cccc1Cl,C17286800_decoy,TRY1,Decoy,0,-8.02296,-7.48,-1.3,-6.298071642980391
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccc(Br)cc2)c(=O)[nH]c1=O,C21581280_decoy,TRY1,Decoy,0,-8.437,-6.31,-2.73,-5.990974161690121
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C[NH+]3CCN(CCO)CC3)c2C(=O)Nc2ccc(Cl)cc2)C1,C22635342_decoy,TRY1,Decoy,0,-8.84181,-8.11,-1.39,-7.23132787825128
CC[C@H](CO)[NH2+]C[C@@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C26571038_decoy,TRY1,Decoy,0,-8.83765,-6.27,-0.78,-6.4272774110096575
CC[C@@H](CO)[NH2+]C[C@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C26571041_decoy,TRY1,Decoy,0,-8.89828,-4.64,-1.51,-5.1629455048897865
CC[C@H](CO)[NH2+]C[C@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C26571044_decoy,TRY1,Decoy,0,-8.72314,-4.76,-1.13,-5.5536948244104005
CCc1cc2c(=O)c(-c3nc4ccccc4s3)c(CC)oc2c(C[NH+](CCO)CCO)c1O,C28120702_decoy,TRY1,Decoy,0,-8.99697,-7.87,-2.77,-9.003827615375844
O=c1cc(NCCC[NH2+]Cc2cc(Br)cc(Br)c2)[nH]c2sccc12,C28351212_decoy,TRY1,Decoy,0,-9.01793,-6.58,-1.82,-5.847391035849446
O=c1cc(NCCC[NH2+]Cc2cc(Br)cc(Br)c2)[nH]c2ccsc12,C28359759_decoy,TRY1,Decoy,0,-9.29365,-6.99,-2.14,-6.1313103365057176
COc1cccc([C@H](C[NH2+]C[C@@H](O)COCC2=CC[C@@H]3C[C@H]2C3(C)C)c2c[nH]c3ccccc23)c1OC,C33766834_decoy,TRY1,Decoy,0,-8.97859,-7.96,-2.17,-10.31745004086875
COc1cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)cc(I)c1OCC(N)=O,C36612890_decoy,TRY1,Decoy,0,-9.29976,-5.15,-2.28,-6.009042856460075
OC[C@H]([NH2+]Cc1ccc(/N=C/c2cc(Br)ccc2O)cc1)C12CC3CC(CC(C3)C1)C2,C38172970_decoy,TRY1,Decoy,0,-10.4184,-8.05,-2.58,-7.292913390468953
OC[C@@H]([NH2+]Cc1ccc(/N=C/c2cc(Br)ccc2O)cc1)C12CC3CC(CC(C3)C1)C2,C38172971_decoy,TRY1,Decoy,0,-10.2898,-7.31,-1.07,-7.598065457429275
O=C(/C=C/[C@H]1CN(C[C@H](O)C[NH2+]CCc2c[nH]c3ccccc23)c2ccccc21)c1cccs1,C39330702_decoy,TRY1,Decoy,0,-9.8056,-6.3,-2.49,-6.496552666219517
O=C(/C=C/[C@H]1CN(C[C@H](O)C[NH2+]CCc2c[nH]c3ccc(F)cc23)c2ccccc21)c1cccs1,C39331065_decoy,TRY1,Decoy,0,-8.53966,-7.37,-3.93,-6.905054765407765
Oc1ccccc1[C@@H]1CN([C@H](CNBr)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531037_decoy,TRY1,Decoy,0,-9.74073,-6.4,-1.76,-6.245071780940375
Oc1ccccc1[C@@H]1CN([C@@H](CNBr)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531038_decoy,TRY1,Decoy,0,-8.05487,-6.26,-3.41,-5.204914479147612
Oc1ccccc1[C@@H]1CN([C@H](CNI)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531047_decoy,TRY1,Decoy,0,-9.53437,-7.57,-2.37,-8.96724630438661
Oc1ccccc1-c1ccc([C@H](CNI)N2CC[NH2+][C@H](Cc3ccccc3)C2)cc1,C39533949_decoy,TRY1,Decoy,0,-7.60576,-5.98,-2.79,-5.466171230854266
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39631453_decoy,TRY1,Decoy,0,-9.66159,-7.25,-2.58,-7.687212520108112
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39631798_decoy,TRY1,Decoy,0,-11.0927,-7.45,-3.63,-8.572325171133857
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676486_decoy,TRY1,Decoy,0,-9.66842,-7.37,-1.07,-7.171596134999297
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676488_decoy,TRY1,Decoy,0,-11.5108,-7.48,-2.02,-9.419720096443182
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cc(C(F)(F)F)ccc1Cl,C40682579_decoy,TRY1,Decoy,0,-7.97668,-7.88,-2.47,-6.982664434326104
COc1ccc(CCNc2ncnc(N3CC[NH+](Cc4ccc5c(c4)OCO5)CC3)c2N)cc1OC,C40683997_decoy,TRY1,Decoy,0,-9.71318,-6.48,-3.28,-6.547992796057637
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1c(Cl)cccc1Cl,C40720457_decoy,TRY1,Decoy,0,-9.04801,-5.37,-2.41,-5.304781340836903
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1c(F)cccc1Cl,C40720473_decoy,TRY1,Decoy,0,-7.90464,-5.81,-4.41,-5.464344371422249
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(Cl)c(C(F)(F)F)c1,C40777932_decoy,TRY1,Decoy,0,-7.51411,-6.47,-2.41,-6.4040634389363085
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH2+]C(C)(C)C)cc1OC(F)F,C43066194_decoy,TRY1,Decoy,0,-8.45158,-6.2,-3.06,-6.157090829355527
CC(C)C[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)cs1,C43227046_decoy,TRY1,Decoy,0,-11.4307,-7.67,-3.25,-7.2770080544661475
CC(C)C[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)cs1,C43227047_decoy,TRY1,Decoy,0,-10.6462,-8.44,-3.52,-7.435359054553405
CC(C)(C)c1cc([C@H]2CSC[C@@H](C(=O)NCCc3ccccc3Cl)[NH2+]2)cc(C(C)(C)C)c1O,C44167200_decoy,TRY1,Decoy,0,-9.67813,-6.12,-2.45,-6.784713304124023
Cc1ccc(SCc2nn(C)c(Sc3ccc(Br)cc3)c2C[C@H]([NH3+])CO)cc1,C44465457_decoy,TRY1,Decoy,0,-9.53428,-5.34,-2.73,-5.912125763942076
Cc1ccc(SCc2nn(C)c(Sc3ccc(Br)cc3)c2C[C@@H]([NH3+])CO)cc1,C44465459_decoy,TRY1,Decoy,0,-9.72719,-5.86,-2.33,-7.116694772730318
COc1ccc(N2CC[NH+](CCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]43)CC2)cc1,C59875664_decoy,TRY1,Decoy,0,-10.6369,-6.34,-1.84,-6.739068408759997
O=C(/C=C1/CS[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)N1)NCC[C@@H]1C=c2ccccc2=[NH+]1,C63282158_decoy,TRY1,Decoy,0,-9.72831,-6.39,-3.27,-6.187175289938334
Cc1ccc(NC(=O)CS[C@@H]2N/C(=C\C(=O)NCCC3=c4ccccc4=[NH+]C3)CS2)cc1,C63687974_decoy,TRY1,Decoy,0,-9.24077,-9.4,-0.79,-7.975713794411439
COc1ccc2c(c1)=C(CCNC(=O)c1ccccc1NC(=O)[C@@H]1NSc3ccccc31)C[NH+]=2,C64540123_decoy,TRY1,Decoy,0,-7.93271,-6.31,-1.45,-6.460804967870705
COc1cccc2c1C(=O)c1c(O)c([C@H](CC(=O)[O-])O[C@H]3C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O3)c(CO)c(O)c1C2=O,C05574726_decoy,TRY1,Decoy,0,-6.41887,-8.02,-2.07,-5.35138865956898
NC(=O)c1c(NC(=O)CCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)sc2c1CCCC2,C06073459_decoy,TRY1,Decoy,0,-11.0331,-8.26,-3.25,-8.386893537457777
COc1cc([C@@H](C(=O)NC(C)(C)C)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)ccc1O,C06074824_decoy,TRY1,Decoy,0,-10.9407,-5.22,-1.28,-7.973864749475751
CC(C)(C)NC(=O)[C@H](c1cccs1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06075116_decoy,TRY1,Decoy,0,-7.58336,-7.29,-1.2,-9.17964349110263
C/C(COc1ccc(Cl)cc1Cl)=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975185_decoy,TRY1,Decoy,0,-8.48003,-8.0,-2.89,-8.263872592923576
C/C(COc1ccc(Cl)cc1Cl)=N/Nc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975186_decoy,TRY1,Decoy,0,-8.69137,-8.11,-1.62,-7.62271792799673
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C12467443_decoy,TRY1,Decoy,0,-6.43592,-7.08,-1.38,-7.268554641514116
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1C,C12473214_decoy,TRY1,Decoy,0,-8.19472,-6.1,-1.28,-6.035308200463816
C[C@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc2c(c1)OCCO2,C12715204_decoy,TRY1,Decoy,0,-8.66793,-7.49,-1.29,-8.835407686743096
C[C@@H](C(=O)NC[C@@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc2c(c1)OCCO2,C12715208_decoy,TRY1,Decoy,0,-8.45519,-7.2,-0.99,-6.656850074036288
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(C)o2)c1,C12715532_decoy,TRY1,Decoy,0,-8.28629,-4.96,-0.87,-6.342013377357941
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccc(C)o2)c1,C12715536_decoy,TRY1,Decoy,0,-7.46121,-7.77,-0.45,-9.242783900815024
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1,C12716052_decoy,TRY1,Decoy,0,-7.51841,-6.67,-1.78,-7.820135151899119
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c(=O)oc2c1C,C12896793_decoy,TRY1,Decoy,0,-8.37797,-6.51,-4.08,-5.794755084785601
NC(=O)c1nsc(C(=O)N(c2ccc(Cl)cc2)[C@@H](C(=O)NC2CCCC2)c2ccncc2)c1N,C06444844_decoy,TRY1,Decoy,0,-7.10369,-4.73,-1.74,-4.933855167691484
NC(=O)c1nsc(C(=O)N(c2ccc3c(c2)OCCO3)[C@H](C(=O)NC2CCCC2)c2ccncc2)c1N,C06445383_decoy,TRY1,Decoy,0,-7.41515,-5.6,-1.47,-5.861974394846787
NC(=O)c1nsc(C(=O)N(c2ccc3c(c2)OCCO3)[C@@H](C(=O)NC2CCCC2)c2ccncc2)c1N,C06445390_decoy,TRY1,Decoy,0,-7.65339,-8.09,-1.95,-12.475508664908354
O=C(CSc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1)Nc1ccc2c(c1)C(=O)NC2=O,C21080388_decoy,TRY1,Decoy,0,-9.50742,-8.84,-3.1,-7.618378032633648
Nn1c(N/N=C/c2cc(Br)ccc2O)nnc1SCC(=O)Nc1nccs1,C21319398_decoy,TRY1,Decoy,0,-10.0689,-8.3,-1.72,-7.840646359422572
NC(=O)c1c(NC(=O)CCC(=O)Nc2sc3c(c2C(N)=O)CCCCC3)sc2c1CCCCC2,C02748904_decoy,TRY1,Decoy,0,-10.6266,-7.88,-1.53,-7.4610151446790836
CC(C)=CCc1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31155261_decoy,TRY1,Decoy,0,-7.70918,-7.99,-2.51,-6.091452223457941
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCN1CCN(C(=O)/C(C#N)=C/c2ccc(O)c(O)c2)CC1,C17259465_decoy,TRY1,Decoy,0,-8.81845,-7.37,-3.87,-6.695368784424896
COC1=C(Br)[C@@H]([O-])[C@]2(C=C1Br)CC(C(=O)NCCCCC[NH+]=C(N)N)=NO2,C14854572_decoy,TRY1,Decoy,0,-10.6391,-8.1,-1.3,-16.152310086694925
COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1[C@@H](NC(C)=O)CC2,C04245665_decoy,TRY1,Decoy,0,-9.45228,-5.14,-4.13,-6.375427637670851
NC(=O)c1ccccc1NC(=O)[C@@H]1S/C(=N\c2cccc(Cl)c2)C(C(=O)NCc2ccco2)=C1N,C12619261_decoy,TRY1,Decoy,0,-8.69562,-6.63,-3.84,-6.219151398365694
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3cc(Br)ccc3O)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33751006_decoy,TRY1,Decoy,0,-7.59341,-4.97,-1.42,-5.422180509517208
O=C(Cc1c[nH]c2ccccc12)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C37009784_decoy,TRY1,Decoy,0,-6.73118,-6.75,-2.72,-5.958046875362689
O=C(Cc1c[nH]c2ccccc12)OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C37009790_decoy,TRY1,Decoy,0,-6.65308,-7.57,-2.86,-5.927220775957532
Cc1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)o1,C12715061_decoy,TRY1,Decoy,0,-8.59009,-5.44,-2.17,-6.283327438992417
O=C(O[C@H]1C=C(CO)[C@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@]12O)c1ccc(O)cc1,C35455251_decoy,TRY1,Decoy,0,-6.86909,-6.95,-2.3,-6.066173260683642
COc1c(O)cc(C(=O)O[C@]2(Oc3ccc(O)cc3)O[C@@H](CO)[C@@](C)(O)[C@](C)(O)[C@H]2C)cc1O,C38337973_decoy,TRY1,Decoy,0,-8.83439,-5.75,-2.9,-5.760979061522948
CC(=O)Nc1ccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39006804_decoy,TRY1,Decoy,0,-8.99804,-8.19,-2.7,-7.062600584691314
CC(=O)Nc1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39006805_decoy,TRY1,Decoy,0,-9.54011,-10.17,-3.34,-12.839890732359232
CC(=O)Nc1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39006806_decoy,TRY1,Decoy,0,-8.38231,-9.82,-1.5,-7.567296428146943
CC(=O)Nc1ccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39006807_decoy,TRY1,Decoy,0,-9.95756,-6.2,-2.25,-5.810259282479265
CC(=O)Nc1ccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39012078_decoy,TRY1,Decoy,0,-10.6009,-6.75,-2.86,-7.128746286977197
CC(=O)Nc1ccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39012081_decoy,TRY1,Decoy,0,-10.0973,-10.16,-2.79,-10.892214828913383
Cc1cccc(C(C)C)c1NC(=O)CS[C@@H]1NN[C@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C39015650_decoy,TRY1,Decoy,0,-8.47945,-9.66,-2.06,-7.528695811691318
Cc1cccc(C(C)C)c1NC(=O)CS[C@H]1NN[C@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C39015652_decoy,TRY1,Decoy,0,-10.609,-9.33,-2.91,-7.824221340789363
Cc1cccc(C(C)C)c1NC(=O)CS[C@@H]1NN[C@@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C39015653_decoy,TRY1,Decoy,0,-10.0058,-7.54,-3.45,-6.94935187561953
Cc1cccc(C(C)C)c1NC(=O)CS[C@H]1NN[C@@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C39015654_decoy,TRY1,Decoy,0,-8.85651,-10.2,-2.41,-9.7873637461799
CC1=C[C@H]([C@@H]2NN[C@H](SCC(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2N)N=N1,C39591896_decoy,TRY1,Decoy,0,-7.1999,-7.29,-2.49,-7.50755268083097
CC1=C[C@@H]([C@@H]2NN[C@H](SCC(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2N)N=N1,C39591898_decoy,TRY1,Decoy,0,-8.31401,-8.3,-1.85,-7.140621389444135
CC1=C[C@H]([C@H]2NN[C@H](SCC(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2N)N=N1,C39591900_decoy,TRY1,Decoy,0,-7.46743,-6.85,-1.68,-6.776378538084835
CC1=C[C@@H]([C@H]2NN[C@H](SCC(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)N2N)N=N1,C39591902_decoy,TRY1,Decoy,0,-7.56686,-8.47,-2.23,-9.824302906378753
COc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(F)c(Cl)c4)N3N)N=N2)cc1,C38990390_decoy,TRY1,Decoy,0,-10.4616,-7.61,-3.71,-8.451537674959418
Cc1c(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)oc2c1/C(=N/NC(N)=S)CCC2,C40824623_decoy,TRY1,Decoy,0,-10.4518,-6.75,-1.38,-8.128240681776914
NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C1=C[C@@H](Oc2ccc3c(c2)OCO3)[C@H](O)[C@H](O)C1,C03840240_decoy,TRY1,Decoy,0,-9.13144,-8.32,-0.19,-6.455814705937005
CC(C)CN1C(=O)NC([O-])=C(C(=O)CSc2nc(-c3ccc(Br)cc3)c[nH]2)[C@H]1[NH3+],C63906290_decoy,TRY1,Decoy,0,-8.3058,-6.29,-1.57,-5.699683006766407
COc1ccc(Cn2c(O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c(=O)[nH]c2=O)cc1,C05907823_decoy,TRY1,Decoy,0,-7.48269,-7.43,-1.12,-6.321780117661309
CC[C@H]([NH2+]CC(=O)Nc1sccc1C(N)=O)c1ccc(Br)cc1,C08130104_decoy,TRY1,Decoy,0,-9.1864,-6.03,-0.88,-7.110001869567783
CC[C@@H]([NH2+]CC(=O)Nc1sccc1C(N)=O)c1ccc(Br)cc1,C08130107_decoy,TRY1,Decoy,0,-9.71855,-6.17,-0.96,-7.280557115509966
O=C(NCC[NH+]1CCCCC1)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccccc3)[C@@H]21,C08254638_decoy,TRY1,Decoy,0,-8.82509,-4.96,-1.89,-5.444390717484823
COc1ccc(Cn2c(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c(=O)[nH]c2=O)cc1,C05907816_decoy,TRY1,Decoy,0,-6.93034,-7.66,-1.86,-6.159255432129945
Cc1cccc2c1NC(=O)[C@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08790490_decoy,TRY1,Decoy,0,-9.62104,-6.24,-4.0,-6.052981474054766
Cc1cccc2c1NC(=O)[C@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08790492_decoy,TRY1,Decoy,0,-7.97246,-6.21,-1.31,-6.664520871832473
Cc1cccc2c1NC(=O)[C@@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08790494_decoy,TRY1,Decoy,0,-7.45807,-5.93,-1.33,-4.828051590460336
NC(=O)CC[C@H]1[NH2+][C@@]2(C(=O)Nc3ccc(Cl)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]21,C08790991_decoy,TRY1,Decoy,0,-9.27268,-7.48,-3.08,-8.833446252514191
NC(=O)CC[C@@H]1[NH2+][C@]2(C(=O)Nc3ccc(Cl)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C08790992_decoy,TRY1,Decoy,0,-10.0062,-7.48,-2.54,-7.559062496273973
NC(=O)CC[C@H]1[NH2+][C@]2(C(=O)Nc3ccc(Cl)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]21,C08790993_decoy,TRY1,Decoy,0,-10.4117,-8.49,-0.91,-9.27341924153183
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(C(=O)Nc2ccccc2)CC1,C12745246_decoy,TRY1,Decoy,0,-7.30704,-6.35,-1.26,-5.5755933827614
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(C(=O)Nc2ccccc2)CC1,C12745251_decoy,TRY1,Decoy,0,-7.42556,-8.99,0.01,-7.562777541885177
NC(=O)CC[C@@H]1[NH2+][C@@]2(C(=O)Nc3ccc(Cl)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C12885125_decoy,TRY1,Decoy,0,-8.68019,-6.32,-3.23,-6.018132447753277
C=CC[NH+](CC(=O)Nc1cc(C(N)=O)cc(C(N)=O)c1)Cc1ccc(Br)s1,C12985747_decoy,TRY1,Decoy,0,-7.65942,-7.01,-1.55,-7.923618882120253
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccccc3)C[NH+]12)NC1CC1,C15708348_decoy,TRY1,Decoy,0,-7.2297,-6.39,-2.71,-5.7236711720778
O=C(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1[NH+]1CCCCC1)Nc1ccc(F)cc1F,C20465717_decoy,TRY1,Decoy,0,-6.42266,-6.04,-0.17,-5.011080575716681
NC(=O)C[C@@H]([NH3+])C(=O)Nc1cc(Cl)cc(Br)c1OC(F)F,C37628104_decoy,TRY1,Decoy,0,-7.98932,-5.07,-3.42,-5.495965134756392
NC(=O)C[C@H]([NH3+])C(=O)Nc1cc(Cl)cc(Br)c1OC(F)F,C37628106_decoy,TRY1,Decoy,0,-8.55071,-6.15,-1.5,-10.35642105055896
O=S(=O)(Oc1ccccc1)c1ccc([C@H](CNO)N2CC[NH2+][C@H](O)C2)cc1,C39534298_decoy,TRY1,Decoy,0,-9.2319,-6.21,-2.39,-5.914150366800217
[NH3+][C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(Br)ccc1Br,C40463978_decoy,TRY1,Decoy,0,-7.74705,-7.41,-1.07,-6.933848632276906
CC(=O)Nc1ccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40760876_decoy,TRY1,Decoy,0,-7.65797,-6.79,-3.32,-4.918858037651724
CC1(C)CC(NC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)CC(C)(C)[NH2+]1,C42910336_decoy,TRY1,Decoy,0,-8.12388,-5.99,-2.67,-5.701507521880028
NC(=O)C[C@@H]([NH3+])c1cc(Br)c(OCc2ccccc2Cl)c(Br)c1,C44254346_decoy,TRY1,Decoy,0,-10.223,-6.14,-3.68,-6.026081998307205
NC(=O)C[C@H]([NH3+])c1cc(Br)c(OCc2ccccc2Cl)c(Br)c1,C44254349_decoy,TRY1,Decoy,0,-10.9816,-6.09,-1.22,-6.997499814612109
COC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(CC[NH3+])c2O)c(C)c1O,C44396561_decoy,TRY1,Decoy,0,-10.2845,-6.65,-2.15,-6.432042230654057
CC1(C)CC(NC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)CC(C)(C)[NH2+]1,C45037282_decoy,TRY1,Decoy,0,-7.01156,-7.76,-1.3,-5.920715311458883
Cc1cc(C)c(NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(C)c1,C45645205_decoy,TRY1,Decoy,0,-7.92941,-7.45,-2.18,-6.907461345168952
CC1CC[NH+](Cc2ccccc2CNC(=O)Nc2ccccc2CC(N)=O)CC1,C46011107_decoy,TRY1,Decoy,0,-8.9077,-7.61,-2.31,-8.961083888887805
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)CC(=O)Nc1c(Cl)cccc1Cl,C15038051_decoy,TRY1,Decoy,0,-7.6203,-7.67,-1.92,-7.944399563902113
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)CC(=O)Nc1c(Cl)cccc1Cl,C15038048_decoy,TRY1,Decoy,0,-7.47898,-5.78,-0.79,-5.664358173538644
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccsc1,C47998623_decoy,TRY1,Decoy,0,-9.17539,-5.64,-2.27,-6.081061009816801
CCC[C@@H](C)NC(=O)[C@H]1CCC[NH+](CCC(=O)Nc2sccc2C(N)=O)C1,C51052615_decoy,TRY1,Decoy,0,-7.0861,-6.32,-2.3,-6.452098233499859
C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C54946034_decoy,TRY1,Decoy,0,-8.39826,-5.45,-1.61,-5.242068209910078
CCN(CC)c1ccc2cc(C(N)=O)/c(=[NH+]/c3ccc(S(N)(=O)=O)cc3)oc2c1,C59170358_decoy,TRY1,Decoy,0,-8.71714,-4.71,-1.14,-6.083574643556185
CCC[C@@H](NC(N)=O)C(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C64291124_decoy,TRY1,Decoy,0,-7.72805,-6.63,-2.22,-7.718602093944363
CC1CC[NH+]([C@@H](C)CNC(=O)NCc2ccc(NC(=O)NC(C)C)cc2)CC1,C65479587_decoy,TRY1,Decoy,0,-8.07265,-7.04,-3.79,-5.976690109704289
COCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115485_decoy,TRY1,Decoy,0,-6.90462,-5.79,-2.19,-5.539228691664643
CC[C@H](C)[NH+](C)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1,C66196300_decoy,TRY1,Decoy,0,-8.31844,-4.85,-3.2,-5.469037954417081
CCCC[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)s1)C(=O)Nc1cc(C)on1,C66609033_decoy,TRY1,Decoy,0,-8.27376,-6.31,-2.47,-5.771421579193705
CCCC[C@@H]([NH2+]Cc1ccc(S(N)(=O)=O)s1)C(=O)Nc1cc(C)on1,C66609035_decoy,TRY1,Decoy,0,-7.95238,-6.49,-1.78,-5.805409623742264
CCCNC(=O)C[NH+]1CCC(NC(=O)NNC(=O)CCC2CCCCC2)CC1,C67059590_decoy,TRY1,Decoy,0,-8.75907,-6.47,-4.32,-5.974084455140658
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67544020_decoy,TRY1,Decoy,0,-7.8956,-7.12,-2.87,-5.871780258337986
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)NC[C@@H](O)C[NH+]1CCC(C)CC1,C67544021_decoy,TRY1,Decoy,0,-7.9216,-5.49,-1.55,-5.515273899635513
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)CC1,C67551393_decoy,TRY1,Decoy,0,-7.95657,-6.95,-1.1,-5.85567312725368
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)CC1,C67551394_decoy,TRY1,Decoy,0,-7.90884,-8.02,-2.17,-6.275266755813815
CC1CC[NH+](C[C@H](O)CNC(=O)NCCCNC(=O)c2ccccc2F)CC1,C67634731_decoy,TRY1,Decoy,0,-8.29553,-7.33,-1.71,-5.8409716830658285
C[NH+]1CCc2c(sc(NC(=O)Nc3ccc(Cl)cc3)c2C(N)=O)C1,C05019547_decoy,TRY1,Decoy,0,-8.78416,-6.72,-1.28,-5.593777395158897
CCNc1[nH+]c2c(O)nsc2c2c1[C@@H](c1cccnc1)C(C#N)=C(N)O2,C06721857_decoy,TRY1,Decoy,0,-8.31351,-4.96,-3.66,-5.311557839047775
Nc1n[nH]c2nc(Nc3ccccc3)c3c(c12)CC[NH+](C1CCCCC1)C3,C05207650_decoy,TRY1,Decoy,0,-7.95078,-8.31,-0.09,-7.030438691385214
CC1(C)CC(NC[C@@H](O)COc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC(C)(C)[NH2+]1,C19884578_decoy,TRY1,Decoy,0,-9.0037,-5.69,-2.57,-5.961733439873833
CC1(C)CC(NC[C@H](O)COc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC(C)(C)[NH2+]1,C19884580_decoy,TRY1,Decoy,0,-9.01903,-5.44,-1.46,-5.9708814920315225
NC(=S)NN=C1[C@H]2CCC[C@@H]1[C@@H](c1ccccc1)[NH2+][C@@H]2c1ccccc1,C20509927_decoy,TRY1,Decoy,0,-7.95263,-5.25,-1.04,-5.22856912947432
NC(=S)NN=C1[C@H]2CCC[C@@H]1[C@H](c1ccccc1)[NH2+][C@H]2c1ccccc1,C39431519_decoy,TRY1,Decoy,0,-8.1448,-6.82,0.6,-5.454863720949367
CC(C)(C)[NH2+]C[C@H](O)c1cc(Br)c(N)c(Br)c1,C39932965_decoy,TRY1,Decoy,0,-8.40699,-4.08,-0.63,-4.510662723503868
CC(C)(C)[NH2+]C[C@@H](O)c1cc(Br)c(N)c(Br)c1,C39932966_decoy,TRY1,Decoy,0,-8.77655,-5.76,-1.72,-8.15209487768036
NC(=O)CC1(C[C@@H]([NH3+])c2cc(Br)ccc2Br)CCCC1,C40224640_decoy,TRY1,Decoy,0,-9.47172,-4.97,-4.3,-5.886571698172826
NC(=O)CC1(C[C@H]([NH3+])c2cc(Br)ccc2Br)CCCC1,C40224641_decoy,TRY1,Decoy,0,-8.98391,-4.12,-1.43,-5.162788779410383
NC(=O)CC1(C[C@@H]([NH3+])c2cc(Br)sc2Br)CCCC1,C40224972_decoy,TRY1,Decoy,0,-9.93817,-4.17,-1.86,-5.557515254274457
[NH3+][C@H](Cc1ccc(O)c(O)c1)c1nc2cc(Br)ccc2s1,C40225928_decoy,TRY1,Decoy,0,-9.3482,-5.39,-2.23,-4.9290641710027
CC(C)([NH3+])c1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40428683_decoy,TRY1,Decoy,0,-7.15873,-6.98,-1.52,-6.650341471973998
CC1(C)CC(Nc2ncnc(-n3nnc4ccccc43)c2N)CC(C)(C)[NH2+]1,C40760970_decoy,TRY1,Decoy,0,-7.20917,-5.49,-1.9,-4.340749724365788
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccccc1,C40777734_decoy,TRY1,Decoy,0,-7.43365,-7.35,-1.33,-6.458606924739085
Cc1cccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c1,C40777750_decoy,TRY1,Decoy,0,-7.69476,-7.15,-2.29,-7.122490822608072
Cc1ccc2nc(Nc3nc[nH+]c(NN(c4ccccc4)c4ccccc4)c3N)sc2c1,C40777808_decoy,TRY1,Decoy,0,-8.76251,-8.28,-2.02,-8.774375407870156
[NH3+][C@H](CCO)c1cc(I)cc(I)c1O,C44233704_decoy,TRY1,Decoy,0,-8.32588,-3.99,-0.93,-4.626182708852407
[NH3+][C@@H](CCO)c1cc(I)cc(I)c1O,C44233707_decoy,TRY1,Decoy,0,-9.47596,-4.18,-0.86,-5.080061035966071
[NH3+][C@H](CCO)c1cc(I)c(O)c(I)c1,C44236225_decoy,TRY1,Decoy,0,-9.39666,-4.65,-2.11,-5.462199307033974
[NH3+][C@@H](CCO)c1cc(I)c(O)c(I)c1,C44236229_decoy,TRY1,Decoy,0,-9.41745,-4.35,-0.44,-5.355686941827541
NC(=O)C[C@@H]([NH3+])c1ccc(-c2ccc(-c3ccc(Br)s3)s2)s1,C44252132_decoy,TRY1,Decoy,0,-11.8554,-6.73,-1.64,-6.684432325412883
CCOc1c(Br)cc(Br)cc1[C@H]([NH3+])CC(N)=O,C44253664_decoy,TRY1,Decoy,0,-8.26349,-4.5,-0.9,-5.15138866014831
CCOc1c(Br)cc(Br)cc1[C@@H]([NH3+])CC(N)=O,C44253667_decoy,TRY1,Decoy,0,-9.15674,-5.34,-2.02,-9.140459108539616
NC(=O)C[C@@H]([NH3+])c1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)o1,C44253997_decoy,TRY1,Decoy,0,-8.63223,-6.12,-1.85,-7.682195183295836
NC(=O)C[C@H]([NH3+])c1cccn1-c1c(Cl)cc(C(F)(F)F)cc1Cl,C44254451_decoy,TRY1,Decoy,0,-6.83524,-6.59,-0.86,-7.672294131989454
Cn1nc(C(F)(F)F)c([C@H]([NH3+])CC(N)=O)c1Sc1ccc(F)cc1,C44255341_decoy,TRY1,Decoy,0,-7.50522,-5.72,-3.51,-5.588546213156892
[NH3+][C@H](CO)Cc1cc(I)cc(I)c1O,C44466740_decoy,TRY1,Decoy,0,-9.97308,-6.12,-1.06,-10.42648638223043
[NH3+][C@H](CO)Cc1cc(I)c(O)c(I)c1,C44467826_decoy,TRY1,Decoy,0,-10.3986,-5.42,-1.79,-10.333988131435031
[NH3+][C@@H](CO)Cc1cc(I)c(O)c(I)c1,C44467830_decoy,TRY1,Decoy,0,-9.18566,-3.87,-1.6,-4.745656226492327
Cc1cc([C@H](N)C[NH3+])c(C)n1-c1c(Cl)cc(C(F)(F)F)cc1Cl,C44470172_decoy,TRY1,Decoy,0,-8.75731,-5.52,-1.9,-5.443130886542824
Cc1cc([C@@H](N)C[NH3+])c(C)n1-c1c(Cl)cc(C(F)(F)F)cc1Cl,C44470174_decoy,TRY1,Decoy,0,-8.8472,-5.48,-1.69,-5.740393668338481
N[C@H](C[NH3+])c1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1,C44471191_decoy,TRY1,Decoy,0,-4.03935,-5.64,-2.7,-4.279293128563012
CC(C)=CCC[C@@H](C)c1c2c([nH+]c3sc(C(N)=O)c(N)c13)CCCCCC2,C49069292_decoy,TRY1,Decoy,0,-8.50114,-7.6,0.17,-10.784532109429644
CCc1ccc(-c2c3c([nH+]c4sc(C(N)=O)c(N)c24)CCCCCC3)o1,C49069532_decoy,TRY1,Decoy,0,-8.06813,-8.31,-0.52,-9.229865023358444
[NH3+][C@@H](Cc1ccc(Cl)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094357_decoy,TRY1,Decoy,0,-6.87115,-4.57,-0.85,-4.108990173141506
[NH3+][C@H](Cc1ccc(Cl)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094358_decoy,TRY1,Decoy,0,-8.66496,-6.99,-0.5,-7.17367769644616
[NH3+][C@@H](Cc1ccccc1Cl)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094431_decoy,TRY1,Decoy,0,-8.08624,-4.53,-0.97,-5.164326313482727
[NH3+][C@@H](Cc1cccc(Cl)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52944635_decoy,TRY1,Decoy,0,-8.88673,-5.47,-1.33,-5.091093639641622
CCOc1ccc(Cl)cc1-c1cc(N)[nH+]c(Nc2ccc(CO)cc2)c1,C28523378_decoy,TRY1,Decoy,0,-9.59871,-7.46,-2.4,-8.016028390820631
C[NH+](C)[C@@H](CNC(=O)Nc1ccccc1SCC(N)=O)c1ccco1,C58896774_decoy,TRY1,Decoy,0,-8.85481,-6.02,-4.75,-7.612415547940972
C[NH+](C)[C@H](CNC(=O)Nc1ccccc1SCC(N)=O)c1ccco1,C58896775_decoy,TRY1,Decoy,0,-8.40485,-6.22,-1.42,-7.600860623597351
C[C@H](NC(=O)NC(=O)C[NH+]1CCC(CC(N)=O)CC1)[C@@H]1C[C@H]2CC[C@@H]1C2,C61332621_decoy,TRY1,Decoy,0,-8.79042,-7.55,-2.03,-6.045414470405325
CC(C)(CC(N)=O)C[C@@H]([NH3+])c1cc(Br)ccc1Br,C61825131_decoy,TRY1,Decoy,0,-9.26913,-5.12,-3.4,-8.351199117585622
CC(C)(CC(N)=O)C[C@H]([NH3+])c1cc(Br)sc1Br,C61825464_decoy,TRY1,Decoy,0,-9.26931,-5.24,-0.47,-5.4907045409417625
C[C@H](CC(N)=O)C[C@H]([NH3+])c1cc(Br)ccc1Br,C61829599_decoy,TRY1,Decoy,0,-7.86394,-5.99,-2.28,-7.019108590395446
C[C@H](CC(N)=O)C[C@@H]([NH3+])c1cc(Br)ccc1Br,C61829601_decoy,TRY1,Decoy,0,-8.64469,-4.97,-1.72,-5.807667035231716
C[C@H](CC(N)=O)C[C@H]([NH3+])c1cc(Br)sc1Br,C61830403_decoy,TRY1,Decoy,0,-8.03607,-5.65,-1.89,-7.206997119236234
COc1ccc2[nH]/c(=N\C(=O)C3(N4CN[NH2+]N4)CCCCC3)sc2c1,C63817971_decoy,TRY1,Decoy,0,-7.48616,-5.61,-2.26,-4.800512727957554
CCOc1cc(CNn2nnnc2N)cc(Br)c1OCC(=O)NC1CCCCC1,C00679653_decoy,TRY1,Decoy,0,-8.2447,-6.96,-1.4,-7.861920378513649
CC1(C)NC(=O)N(C[C@@H](O)COc2cccc(OC[C@H](O)CN3C(=O)NC(C)(C)C3=O)c2)C1=O,C08836829_decoy,TRY1,Decoy,0,-6.96212,-6.57,-2.54,-5.989447617622573
NC(=O)c1c(NC(=O)COC(=O)C(O)(c2ccccc2)c2ccccc2)sc2c1CCCC2,C09180353_decoy,TRY1,Decoy,0,-8.99841,-8.44,-2.52,-8.497470895603954
NC(=O)c1ccsc1NC(=O)COC(=O)CSc1nnc(NC2CCCCC2)s1,C09388169_decoy,TRY1,Decoy,0,-9.92648,-7.34,-2.02,-7.158142145119265
COc1cccc(/C=N/NC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)c1OCC(N)=O,C10000761_decoy,TRY1,Decoy,0,-9.68624,-5.84,-3.95,-7.117912677163194
COc1cc(C(=O)Nc2nc(-c3ccc(CNC(C)=O)s3)cs2)cc(Cl)c1OCC(N)=O,C10818059_decoy,TRY1,Decoy,0,-10.4728,-8.69,-2.6,-7.929772714634992
Cc1cc(C)nc(N/C(=N/C(=S)NC[C@H]2CCCO2)NCCc2c[nH]c3ccc(F)cc23)n1,C14158832_decoy,TRY1,Decoy,0,-10.2367,-6.6,-2.68,-6.558128260885702
CSCC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C15545205_decoy,TRY1,Decoy,0,-8.90627,-8.61,-1.12,-8.936113282232872
CC1(C)NC(=O)N(C[C@H](O)COc2cccc(OC[C@H](O)CN3C(=O)NC(C)(C)C3=O)c2)C1=O,C13382318_decoy,TRY1,Decoy,0,-7.76179,-6.43,-1.88,-6.265215458117923
CC(C)(C)C(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2cccc(Br)c2)n1,C20832020_decoy,TRY1,Decoy,0,-8.10865,-7.07,-3.34,-7.193629287729637
C=CCSc1nnc(NC(=O)CSc2nnc(N/N=C/c3ccc(C)cc3)n2N)s1,C20917460_decoy,TRY1,Decoy,0,-8.92194,-8.31,-2.1,-8.117520735698847
Cc1ccc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)c(Br)c1,C20920564_decoy,TRY1,Decoy,0,-8.69855,-9.2,-1.64,-7.912943865755512
CCOc1ccc(NC(=O)CCSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)cc1,C20921288_decoy,TRY1,Decoy,0,-9.18128,-8.46,-1.52,-7.3044539531501265
COc1ccccc1/C=N/Nc1nc(SCC(=O)NNC(=O)c2ccc(Cl)cc2)n[nH]1,C20923530_decoy,TRY1,Decoy,0,-8.66957,-7.38,-1.1,-7.778830749364646
CCCCn1c(N)c(N(CCOC)C(=O)CSc2nc3ccc(OC)cc3[nH]2)c(=O)[nH]c1=O,C08759264_decoy,TRY1,Decoy,0,-7.84726,-7.13,-2.39,-7.293342237013409
COc1ccc(/C=N/Nc2nc(SCC(=O)Nc3cc(Cl)ccc3OC)n[nH]2)cc1O,C21078602_decoy,TRY1,Decoy,0,-9.93539,-7.83,-3.98,-7.870665775257688
COc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3ccccc3[N+](=O)[O-])n[nH]2)c1O,C21079951_decoy,TRY1,Decoy,0,-7.99908,-8.24,-2.13,-8.780254172879793
C[C@@H](OC(=O)c1ccccc1N/C=C/C(=O)C(F)(F)F)C(=O)Nc1sccc1C(N)=O,C21602225_decoy,TRY1,Decoy,0,-7.19694,-7.28,-0.92,-7.977489311495593
C[C@H](Sc1nnc(CCC(N)=O)n1C[C@H]1CCCO1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C28945828_decoy,TRY1,Decoy,0,-9.79233,-7.83,-3.07,-8.072547334523431
N#Cc1c(CCCNC(=O)CNC(=O)c2ccc(F)cc2F)nn(-c2ccc(F)cc2)c1N,C31118478_decoy,TRY1,Decoy,0,-7.51538,-7.91,-3.45,-5.994951038110055
CC(=O)N[C@H](CC(=O)NCCCc1nn(-c2ccc(F)cc2)c(N)c1C#N)c1cccs1,C31118488_decoy,TRY1,Decoy,0,-9.82123,-8.07,-1.85,-7.37716132695886
COCCN(CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1nc2ccccc2c(=O)[nH]1,C12569628_decoy,TRY1,Decoy,0,-10.2975,-5.86,-2.24,-6.822954568617631
CCCn1c(N)c(C(=O)COC(=O)CCNS(=O)(=O)c2ccccc2F)c(=O)[nH]c1=O,C13023223_decoy,TRY1,Decoy,0,-8.30116,-6.14,-3.73,-5.602509983845416
CCOCC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(Cl)cc34)C2)S1,C39252399_decoy,TRY1,Decoy,0,-10.3639,-5.85,-1.27,-7.407166799148682
COc1ccccc1NC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1cccc(C)c1,C39361723_decoy,TRY1,Decoy,0,-8.58336,-8.35,-3.51,-7.748355002460731
Cc1cccc(N2C(SCC(=O)NC[C@@H]3CCCO3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361753_decoy,TRY1,Decoy,0,-8.45763,-7.67,-2.73,-9.44836383142259
C=CCN1[C@@H](SCC(=O)NCCc2c[nH]c3ccccc23)NN[C@@H]1[C@@H]1CCS(=O)(=O)C1,C39450474_decoy,TRY1,Decoy,0,-9.05424,-7.29,-3.6,-6.798485539480859
CCCOc1ccccc1Cn1c(S[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39915879_decoy,TRY1,Decoy,0,-7.29505,-7.48,-2.38,-7.898520897575653
Cc1ccc(OCCCn2c(S[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)nc3ccccc32)cc1,C39916017_decoy,TRY1,Decoy,0,-7.62006,-7.0,-0.98,-5.607781377574645
NC(=O)CCn1c(SCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)nnc1-c1ccco1,C45798567_decoy,TRY1,Decoy,0,-8.92632,-8.32,-3.03,-9.854655247537986
Cc1ccccc1OC[C@H](O)Cn1c(N/N=C/c2ccccc2O)nc2c1c(=O)[nH]c(=O)n2C,C08973257_decoy,TRY1,Decoy,0,-8.44598,-8.35,-1.87,-8.483982194256662
CCOC(=O)C1=C(CSc2nnc(SCC(N)=O)s2)NC(=O)N[C@H]1c1ccco1,C27590422_decoy,TRY1,Decoy,0,-9.39924,-6.21,-1.98,-7.265554523654059
CC(=O)Nc1cccc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc([N+](=O)[O-])c3)n2)c1,C58992767_decoy,TRY1,Decoy,0,-8.23626,-6.75,-5.17,-5.6813178188784175
CC(=O)Nc1cccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc([N+](=O)[O-])cc3)n2)c1,C58993276_decoy,TRY1,Decoy,0,-8.60051,-6.3,-4.5,-6.533641545291476
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(C)C)s3)n[nH]2)ccc1O,C58995289_decoy,TRY1,Decoy,0,-9.29542,-8.41,-3.58,-7.229659202839915
S=C(Nc1ccc(Oc2ccc(NC(=S)Nc3cccnc3)cc2)cc1)Nc1cccnc1,C59115137_decoy,TRY1,Decoy,0,-9.96548,-6.43,-3.99,-6.880398088200575
O=C(C[NH2+]CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1,C59447237_decoy,TRY1,Decoy,0,-8.02732,-7.24,-3.59,-6.6055249860017815
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccc(OC)cc3OC)n2N)cn1,C59830105_decoy,TRY1,Decoy,0,-9.02289,-7.77,-3.12,-7.078411234279548
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccc(OC)c(OC)c3)n2N)cn1,C59830122_decoy,TRY1,Decoy,0,-9.6929,-6.08,-3.28,-6.734134479088524
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3nc4ccccc4s3)n2N)cn1,C59830140_decoy,TRY1,Decoy,0,-9.41045,-7.82,-2.23,-6.926315754170022
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3cc(OC)ccc3OC)n2N)cn1,C59830168_decoy,TRY1,Decoy,0,-10.4662,-6.13,-3.69,-6.606446011766482
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2ccc3c(c2)OCO3)n[nH]1,C59887709_decoy,TRY1,Decoy,0,-9.27318,-7.89,-1.62,-6.666252999523314
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NCc2ccc(Cl)c(Cl)c2)n[nH]1,C59887799_decoy,TRY1,Decoy,0,-10.7529,-8.52,-3.83,-7.693821069660278
CC[C@]1(c2ccc(NC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]43)cc2)CCC(=O)NC1=O,C59989182_decoy,TRY1,Decoy,0,-9.07313,-7.87,-2.72,-5.952536266859479
COc1cccc([C@@H]2[NH2+][C@@](CCSC)(C(=O)[O-])[C@H]3C(=O)N(c4ccc(NC(C)=O)cc4)C(=O)[C@H]23)c1O,C15305314_decoy,TRY1,Decoy,0,-8.26745,-5.64,-1.62,-5.641204385114773
COc1cccc([C@H]2[NH2+][C@@](CCSC)(C(=O)[O-])[C@H]3C(=O)N(c4ccc(NC(C)=O)cc4)C(=O)[C@H]23)c1O,C15305319_decoy,TRY1,Decoy,0,-9.3934,-7.68,-2.21,-6.737299209648028
Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)NCC3(NC(=O)OC(C)(C)C)CCCCCC3)nc21,C60324152_decoy,TRY1,Decoy,0,-9.11286,-8.01,-3.04,-7.1812925221541954
CC1=N[C@@H](SCc2c(C(=O)NCCCc3[nH]nc(N)c3C#N)oc3ccccc23)SC1,C39936560_decoy,TRY1,Decoy,0,-10.7703,-7.76,-3.61,-8.629668415099577
NC(=O)[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)CSc1nc(COc2ccc(Cl)cc2)n[nH]1,C40014109_decoy,TRY1,Decoy,0,-11.5674,-7.45,-4.01,-7.106004627317802
CC[C@H](C)[C@H](NC(=O)N1CC(O)=Nc2ccccc21)C(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C63384483_decoy,TRY1,Decoy,0,-6.21696,-9.08,-1.47,-7.827202433436405
Nc1nonc1C(=[NH2+])N/N=C/c1cc(Br)ccc1O,C03157929_decoy,TRY1,Decoy,0,-8.11935,-7.47,-0.61,-7.109605510430237
Cn1c(N)c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c(=O)[nH]c1=O,C06559731_decoy,TRY1,Decoy,0,-6.91582,-5.62,-0.85,-4.108877442415712
NNC(=O)[C@H]1[C@H]2C[C@H]3Cc4[nH]c5ccccc5c4C[NH+]3C[C@H]2CC[C@H]1O,C12407107_decoy,TRY1,Decoy,0,-6.57064,-8.12,-0.82,-4.696567278771049
OCCC[NH2+][C@@H](c1ccccc1)c1ccc(O)c(O)c1O,C20188231_decoy,TRY1,Decoy,0,-7.64183,-5.68,-0.45,-5.34990760976084
C[C@@H](O)C[NH2+][C@@H](c1ccccc1)c1ccc(O)c(O)c1O,C35601714_decoy,TRY1,Decoy,0,-7.58229,-6.44,-0.2,-5.649098664576111
C[C@@H](CO)[NH2+][C@@H](c1ccccc1)c1ccc(O)c(O)c1O,C35602751_decoy,TRY1,Decoy,0,-8.27824,-6.73,-1.11,-8.162132201389603
C[C@H](CO)[NH2+][C@H](c1ccccc1)c1ccc(O)c(O)c1O,C35602757_decoy,TRY1,Decoy,0,-6.40196,-5.78,-2.05,-5.333799763200674
Cc1cc(O)oc2c/c(=[NH+]\C(=O)[C@@H]([NH3+])CCC[NH3+])ccc1-2,C35977139_decoy,TRY1,Decoy,0,-8.983,-5.64,-0.73,-7.433823908347886
C[C@H](NC(=O)[C@@H]1C[C@H](O)C[NH2+]1)c1ccc2[nH]c(=O)[nH]c2c1,C37000897_decoy,TRY1,Decoy,0,-7.89202,-7.34,-0.94,-6.643694409443091
C[C@@H](NC(=O)[C@H]1C[C@H](O)C[NH2+]1)c1ccc2[nH]c(=O)[nH]c2c1,C37000900_decoy,TRY1,Decoy,0,-6.2019,-5.21,-2.75,-3.973563024784657
CC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC[C@H](C(N)=O)C2)C1,C37157740_decoy,TRY1,Decoy,0,-7.35055,-4.57,-0.31,-4.602766993591735
CC(C)(C)[C@@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC(C(N)=O)CC2)C1,C37158194_decoy,TRY1,Decoy,0,-8.00727,-3.89,-2.4,-4.051102093495197
CC(C)(C)[C@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2CCC(C(N)=O)CC2)C1,C37158200_decoy,TRY1,Decoy,0,-7.07866,-5.02,-3.62,-5.199901403338529
CCC(C)(C)[C@@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC[C@@H]2C(N)=O)C1,C37158860_decoy,TRY1,Decoy,0,-7.26677,-3.9,-2.17,-4.336071392260224
NC(=O)CCCNc1c(C(N)=S)c[nH+]c2ccccc12,C37660498_decoy,TRY1,Decoy,0,-6.67922,-5.28,-2.63,-4.524326161171998
CC(C)C[C@@H]([NH3+])C(=O)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1,C37000879_decoy,TRY1,Decoy,0,-6.93542,-5.91,-0.74,-5.314769644785545
NC(=O)C[C@H]([NH3+])C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C40806206_decoy,TRY1,Decoy,0,-7.8958,-6.47,-3.21,-10.122810445694872
CCC[C@@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2C[C@H](C(N)=O)CC[C@@H]2C)C1,C42428241_decoy,TRY1,Decoy,0,-7.79757,-4.67,-0.76,-4.874505374366801
CCC[C@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2CCC(CC(N)=O)CC2)C1,C42428415_decoy,TRY1,Decoy,0,-7.34973,-4.96,-2.24,-4.721560210050011
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)cc1)[NH+](CCO)CCO,C42945618_decoy,TRY1,Decoy,0,-7.74987,-4.2,-4.1,-4.712611568690537
NC(=O)CC1CC[NH+]([C@@H](C[NH3+])c2ccc(Cl)cc2)CC1,C42946562_decoy,TRY1,Decoy,0,-8.28634,-5.01,-1.78,-5.78314429128914
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(F)c1,C42974835_decoy,TRY1,Decoy,0,-8.2899,-7.11,-1.81,-9.51392294640554
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1cccnc1,C43352807_decoy,TRY1,Decoy,0,-8.20322,-6.64,-0.85,-7.973109371481818
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(C)o1,C43367723_decoy,TRY1,Decoy,0,-7.78135,-6.49,-2.34,-7.09402581077043
CC(C)(C)c1cc([C@@H]([NH3+])CC(N)=O)c(O)c(C(C)(C)C)c1,C44251765_decoy,TRY1,Decoy,0,-7.69139,-6.93,-1.8,-9.578088902593503
CC[C@H]([NH3+])Cc1cc(C(C)(C)C)cc(C[C@@H]([NH3+])CC)c1O,C44404348_decoy,TRY1,Decoy,0,-8.24032,-4.32,-1.23,-5.260765809719183
C[C@@H]([NH3+])CCc1ccccc1-c1ccccc1CC[C@@H](C)[NH3+],C44411539_decoy,TRY1,Decoy,0,-8.30643,-6.15,-2.87,-8.928197401177066
C[C@@H]([NH3+])Cc1c2ccccc2c(C[C@@H](C)[NH3+])c2ccccc12,C44463407_decoy,TRY1,Decoy,0,-6.21687,-5.17,-2.6,-4.189574459487107
C[C@@H]([NH3+])CC1=C[C@H](C(=O)c2ccccc2C[C@@H](C)[NH3+])CC=C1,C44463450_decoy,TRY1,Decoy,0,-9.22097,-6.27,-2.14,-9.342940119192694
Nc1ncc(I)cc1C[C@@H]([NH3+])CO,C44466348_decoy,TRY1,Decoy,0,-8.55581,-3.98,-1.99,-4.1893276426718815
C[C@@H](CO)[C@H]([NH3+])[C@@H](C[C@H]([NH3+])CO)c1ccc(Cl)cc1,C44466625_decoy,TRY1,Decoy,0,-10.3495,-6.2,-1.42,-10.5347759050365
Nc1c(I)c[nH+]cc1C[C@H]([NH3+])CO,C44468215_decoy,TRY1,Decoy,0,-8.16335,-3.94,-1.85,-4.1213413247407065
[NH3+]C[C@H]([NH3+])C1CCC(c2ccc(Br)cc2)CC1,C44477274_decoy,TRY1,Decoy,0,-10.7413,-5.88,-1.25,-9.064235382282789
C[NH+]1CCC[C@H](CNc2cc(N)cc(S(N)(=O)=O)c2)C1,C44535743_decoy,TRY1,Decoy,0,-7.39613,-4.54,-3.1,-4.291577716051279
C[C@H]([NH3+])c1ccc(NC(=O)N[C@H]2CC[NH+](C3CC3)C2)cc1,C44679779_decoy,TRY1,Decoy,0,-8.55979,-7.15,-1.63,-9.597010462259524
Nc1cc(N[C@@H]2CC[NH+]3CCC[C@H]23)cc(S(N)(=O)=O)c1,C49564672_decoy,TRY1,Decoy,0,-7.54649,-4.88,-2.13,-4.526166766213661
Nc1cc(N)nc(SCc2ccc(C#CC[NH3+])s2)n1,C43690560_decoy,TRY1,Decoy,0,-8.97872,-6.87,-1.07,-6.784245719176369
Nc1cc(N)nc(SCc2sccc2C#CC[NH3+])n1,C43690562_decoy,TRY1,Decoy,0,-10.2057,-7.15,-1.09,-11.02974814085318
CC(C)[NH2+][C@@](C)(CCCC[NH+]1CCC[NH+](C)CC1)C(N)=O,C45380369_decoy,TRY1,Decoy,0,-7.43943,-4.76,-2.34,-4.742782558096407
C[NH+]1CCC[NH+](CCCC[C@](C)([NH2+]C2CC2)C(N)=O)CC1,C45380375_decoy,TRY1,Decoy,0,-7.68438,-4.36,-1.76,-4.947320889531783
[NH3+]CC[NH2+]C[C@@H](O)COc1cccc(Br)c1,C50523368_decoy,TRY1,Decoy,0,-7.8838,-4.72,-0.63,-6.203907006679043
[NH3+]CCC[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl,C51356009_decoy,TRY1,Decoy,0,-8.547,-5.72,-1.31,-9.301227164288823
COc1cc(C[C@@H](C[NH3+])c2ccc(Cl)cc2)cc(N)c1O,C57989489_decoy,TRY1,Decoy,0,-8.65096,-6.2,-1.53,-8.363825885165037
NC1=[NH+]c2nc3ccccc3n2[C@H](c2cccc(O)c2O)N1,C07125921_decoy,TRY1,Decoy,0,-8.51907,-6.11,-1.45,-4.043073093186084
CC[NH2+][C@](C)(CCC[NH+]1CC[C@H]([NH+]2CCCC2)C1)C(N)=O,C62969224_decoy,TRY1,Decoy,0,-7.66118,-5.82,-1.55,-5.611618354483697
C[NH2+][C@](C)(CCC[NH+]1CC[C@H]([NH+]2CCCCC2)C1)C(N)=O,C62982706_decoy,TRY1,Decoy,0,-7.8861,-5.8,-1.04,-5.246254301273708
CCS[C@@H]1NN[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63761354_decoy,TRY1,Decoy,0,-6.74812,-4.95,-1.49,-4.27678056970157
CCS[C@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63761357_decoy,TRY1,Decoy,0,-8.01282,-5.0,-0.92,-4.547400998628584
C=CC/[NH+]=C(/N)NC[C@@H](O)C[NH+]1CCc2ccccc2C1,C66245387_decoy,TRY1,Decoy,0,-7.8701,-6.08,-0.88,-5.319738853892763
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccc(O)cc2O)CC1,C67122525_decoy,TRY1,Decoy,0,-7.20631,-6.68,-1.64,-6.443327010220576
Nc1cc(N)c(C=C2C(=O)NC(=O)NC2=O)cc1C=C1C(=O)NC(=O)NC1=O,C04235292_decoy,TRY1,Decoy,0,-6.89199,-7.87,-2.58,-8.158927340022853
OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]12,C04268261_decoy,TRY1,Decoy,0,-7.52114,-6.39,-1.85,-6.138473200363775
CC(C)CNc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C04334886_decoy,TRY1,Decoy,0,-6.56391,-7.09,-0.84,-8.063743544014391
Nc1nc(N)c2nc(SC34CC5CC(CC(C5)C3)C4)c(N)nc2n1,C01563396_decoy,TRY1,Decoy,0,-8.31741,-9.11,-1.04,-11.533590760087224
CNc1ncnc2c1c(C(N)=S)cn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04972460_decoy,TRY1,Decoy,0,-6.0957,-6.22,-1.15,-6.107409217310858
NC(=O)OC[C@@H]1O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@H](O)[C@@H]1O,C05103347_decoy,TRY1,Decoy,0,-6.5184,-8.07,-1.74,-8.475197516469901
O=c1[nH]c2ccccc2nc1N/N=C/[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C05286490_decoy,TRY1,Decoy,0,-8.34112,-6.37,-2.61,-5.789564988948672
Cc1c(C#N)c(N)n([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=S)c1C#N,C05540506_decoy,TRY1,Decoy,0,-6.50244,-4.87,-3.32,-3.3732101677766275
OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]12,C05566520_decoy,TRY1,Decoy,0,-8.38229,-6.04,-1.76,-5.551556897473529
O=C1N[C@@H]2NC(=O)N(CCCN3C(=O)N[C@@H]4NC(=O)N[C@@H]43)[C@@H]2N1,C08816593_decoy,TRY1,Decoy,0,-5.30485,-7.15,-1.0,-6.877156845648219
C[C@]1(Oc2ccc(N)cc2)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@]1(C)O,C09915634_decoy,TRY1,Decoy,0,-7.0811,-6.01,-2.27,-4.544781520888137
C[C@]1(Oc2ccc(N)cc2)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915902_decoy,TRY1,Decoy,0,-5.75557,-8.28,-4.0,-7.133808030998249
CC(C)=NNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004235_decoy,TRY1,Decoy,0,-6.973,-7.66,-1.07,-7.323434792520973
C[C@@]1(O)[C@@](C)(O)[C@](C)(n2cnc3c(N)nc(N)nc32)O[C@]1(C)CO,C12358655_decoy,TRY1,Decoy,0,-6.2201,-6.54,-2.11,-4.284056855090617
C[C@]1(O)[C@@](C)(O)[C@](C)(n2cnc3c(N)nc(N)nc32)O[C@]1(C)CO,C12358656_decoy,TRY1,Decoy,0,-6.51415,-4.91,-1.58,-3.516566410169655
C[C@]1(O)[C@@](C)(O)[C@@](C)(CO)O[C@@]1(C)n1cnc2c(N)nc(N)nc21,C12358657_decoy,TRY1,Decoy,0,-6.57182,-6.67,-0.98,-8.159569015699534
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COS(N)(=O)=O)[C@@H](O)[C@@H]1O,C12502832_decoy,TRY1,Decoy,0,-7.77017,-8.36,-0.48,-13.127066881079609
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(N)(N)=O)[C@@H](O)[C@@H]1O,C05389922_decoy,TRY1,Decoy,0,-6.09564,-7.65,-3.87,-7.025840932659537
Nc1ncnc2c1c1c(=O)[nH]c(=O)[nH]c1n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05390314_decoy,TRY1,Decoy,0,-4.74236,-6.49,-3.73,-4.013489614042247
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(N)(=O)=O)[C@@H](O)[C@@H]1O,C04964018_decoy,TRY1,Decoy,0,-6.9046,-7.74,-0.78,-7.248643767261784
NC(=O)c1c(N)n([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2ncnc(N)c12,C05011531_decoy,TRY1,Decoy,0,-6.33362,-6.33,-1.42,-4.8967892856231
Nc1nc(N)c(CCCOc2ccc([N+](=O)[O-])cc2Cl)c(N)n1,C04771697_decoy,TRY1,Decoy,0,-7.78487,-8.27,-1.46,-8.665836015519902
Nc1ncnc2c1c1c(N)ncnc1n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04774651_decoy,TRY1,Decoy,0,-6.05331,-5.77,-0.67,-4.330117945644029
OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H]12,C13407189_decoy,TRY1,Decoy,0,-7.09959,-6.52,-1.98,-5.649415528079267
OCC1=C[C@H](O)[C@@H]2C=CO[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C13407258_decoy,TRY1,Decoy,0,-5.74659,-5.18,-1.3,-4.168918264091234
CN(C)c1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C15225668_decoy,TRY1,Decoy,0,-7.30809,-7.94,-2.54,-9.01186223495558
CC1=C(C)[C@@](C)(NC(=O)N[C@@]2(C)NC(=O)NC(C)=C2C)NC(=O)N1,C16916108_decoy,TRY1,Decoy,0,-7.9957,-6.78,-1.05,-5.941087200341083
COc1nc(O)c(N)c(N[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)n1,C16953131_decoy,TRY1,Decoy,0,-6.43095,-7.38,-1.05,-6.961955906634417
O=C(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1,C08376405_decoy,TRY1,Decoy,0,-7.49594,-8.79,-4.47,-7.801421534082084
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nncc2ccccc12,C22047808_decoy,TRY1,Decoy,0,-7.99098,-7.23,-1.05,-7.678915889080764
NS(=O)(=O)c1ccc(N[C@]2(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C25665824_decoy,TRY1,Decoy,0,-5.91194,-4.48,-2.07,-4.070063570760688
Nc1ncnc2c1c1c(N)[nH]nc1n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C17430627_decoy,TRY1,Decoy,0,-6.09868,-4.89,-0.84,-3.272847733104126
CSc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(N)c(=O)[nH]1,C17191017_decoy,TRY1,Decoy,0,-5.84709,-4.95,-3.0,-3.9897765564083008
Nc1nc(=S)c2[nH]c(=S)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2[nH]1,C17378506_decoy,TRY1,Decoy,0,-5.83759,-5.87,-3.04,-5.034780957360269
N[C@@H]1NC(=O)N([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)C=C1Br,C33727943_decoy,TRY1,Decoy,0,-7.91832,-6.0,-1.04,-7.762324154111265
Cn1c(N)nc2c([nH]c(=O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1=S,C16919953_decoy,TRY1,Decoy,0,-6.6242,-5.19,-0.53,-5.779537396933565
NS(=O)(=O)c1ccc(N[C@]2(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C37246051_decoy,TRY1,Decoy,0,-5.56185,-5.77,-1.34,-4.306486657880123
CC(=O)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C31158975_decoy,TRY1,Decoy,0,-7.19836,-4.99,-2.99,-4.304409978645239
CCc1cc(CC)c(/C=N/NC(N)=O)c(CC)c1/C=N/NC(N)=O,C00042581_decoy,TRY1,Decoy,0,-6.0557,-4.55,-2.24,-4.466589509115558
O=C1N[C@H]2NC(=O)N(CCCN3C(=O)N[C@@H]4NC(=O)N[C@@H]43)[C@@H]2N1,C33664059_decoy,TRY1,Decoy,0,-7.49943,-7.56,-1.18,-9.59218017947956
OCC1=C[C@H](O)[C@H]2C=CO[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]12,C43726335_decoy,TRY1,Decoy,0,-6.80911,-6.62,-2.9,-5.470920121288441
Cc1ncc(CO[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(CO)c1O,C44608684_decoy,TRY1,Decoy,0,-5.80825,-6.18,-1.21,-4.597116652315554
[N-]=[N+]=N[C@H]1O[C@@H](CO)[C@@H](O[C@@H]2C[C@H](O)[C@H](O)[C@H](CO)O2)[C@@H](O)[C@H]1O,C48045966_decoy,TRY1,Decoy,0,-4.4067,-4.98,-2.83,-3.689843556270575
Cn1c(=O)c2[nH]c(C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO)nc2n(C)c1=O,C48546453_decoy,TRY1,Decoy,0,-7.24088,-5.32,-1.3,-4.648421533910756
[H]/N=C1/C(=O)c2c(COC(N)=O)c3n(c2C(=O)[C@H]1C)C[C@H]([NH3+])[C@H]3O,C49772311_decoy,TRY1,Decoy,0,-7.11645,-6.06,-0.87,-4.978758869304
C[C@H](Sc1nnc(S[C@H](C)C(=O)NN)s1)C(=O)NN,C13756060_decoy,TRY1,Decoy,0,-8.36256,-6.55,-0.66,-9.550278681496458
Cc1ccsc1[C@H]1C(C(N)=O)=C(N)Oc2[nH]c(=O)[nH]c(=O)c21,C58950408_decoy,TRY1,Decoy,0,-5.98151,-5.5,-2.44,-4.3123784962914335
N#Cc1ccc([C@@H]2C(C(N)=O)=C(N)Oc3[nH]c(=O)[nH]c(=O)c32)cc1,C58950424_decoy,TRY1,Decoy,0,-5.97914,-5.45,-1.91,-3.7381016988310174
CCC([C@H]1C([O-])=NC(=S)[NH+]=C1N)[C@H]1C([O-])=NC(=S)[NH+]=C1N,C63598722_decoy,TRY1,Decoy,0,-4.20948,-4.39,-2.77,-3.359665163895148
COc1nc(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(Cl)c(=O)[nH]1,C16952436_decoy,TRY1,Decoy,0,-6.7757,-6.92,-2.38,-6.764826006661
CC[NH+](CC)Cc1cc([C@](O)(CC)[C@@](O)(CC)c2ccc(O)c(C[NH+](CC)CC)c2)ccc1O,C04783044_decoy,TRY1,Decoy,0,-8.91985,-6.48,-3.37,-10.418638928396028
CC[NH+](CC)Cc1cc([C@@](O)(CC)[C@](O)(CC)c2ccc(O)c(C[NH+](CC)CC)c2)ccc1O,C04783047_decoy,TRY1,Decoy,0,-9.0548,-7.09,-4.1,-8.715189760771636
COCCNC(=O)[C@@H](c1ccc(O)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06904979_decoy,TRY1,Decoy,0,-7.48558,-7.2,-3.12,-8.06199313040183
C[C@H]([NH2+]C[C@@H](O)COc1ccc(OC[C@H](O)C[NH2+][C@@H](C)c2ccccc2)cc1)c1ccccc1,C09075854_decoy,TRY1,Decoy,0,-8.7681,-6.96,-3.17,-6.554316528535047
Nc1nc2c(nc(SC/C=C/c3ccccc3)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C09109508_decoy,TRY1,Decoy,0,-8.02553,-7.97,-2.0,-7.816545599024709
Nc1ncnc2c1nc(N/N=C/c1cccc([N+](=O)[O-])c1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975167_decoy,TRY1,Decoy,0,-7.01709,-8.94,-2.58,-7.218219008435326
Nc1ncnc2c1nc(N/N=C/c1cccc([N+](=O)[O-])c1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975169_decoy,TRY1,Decoy,0,-7.46977,-8.74,-2.67,-8.256174829176496
CN(C)c1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C09975179_decoy,TRY1,Decoy,0,-7.15258,-8.23,-1.48,-7.302194626898882
CC/C(Cc1ccccc1)=N\Nc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975192_decoy,TRY1,Decoy,0,-7.71275,-7.86,-1.59,-7.718390862066737
CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C10004113_decoy,TRY1,Decoy,0,-7.2786,-7.93,-1.39,-7.918086933302519
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CS[C@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,C12504521_decoy,TRY1,Decoy,0,-5.68828,-7.17,-2.1,-4.835699671527777
O[C@@H](C[NH2+]C1CCC([NH2+]C[C@H](O)COCc2ccc(Cl)cc2)CC1)COCc1ccc(Cl)cc1,C12540250_decoy,TRY1,Decoy,0,-9.62031,-6.39,-2.11,-8.89999993455962
COc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C12660304_decoy,TRY1,Decoy,0,-9.00084,-8.48,-2.31,-10.24156886206191
O=C1NC(=O)C(=CNc2ccc(Oc3ccc(NC=C4C(=O)NC(=O)NC4=O)cc3)cc2)C(=O)N1,C03026304_decoy,TRY1,Decoy,0,-8.21562,-9.62,-2.06,-7.393499894582185
CC[NH+](CC)Cc1cc([C@](O)(CC)[C@](O)(CC)c2ccc(O)c(C[NH+](CC)CC)c2)ccc1O,C17299970_decoy,TRY1,Decoy,0,-10.1181,-7.11,-3.51,-10.681657347999764
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@H]2O[C@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]2O)c2ccccc12,C22061118_decoy,TRY1,Decoy,0,-6.64088,-5.72,-2.75,-4.702904522604039
c1cc(Nc2ccc3[nH]ccc3c2)c2sc(-c3ccc(C[NH2+]CCN4CC[NH2+]CC4)cc3)cc2n1,C22932307_decoy,TRY1,Decoy,0,-10.8299,-8.01,-2.34,-6.996972991469417
CCCCC[C@@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NC(CO)CO)[C@H](O)C[C@@H]1O,C27639009_decoy,TRY1,Decoy,0,-9.69072,-6.37,-2.89,-6.712984718353961
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NC(CO)CO)[C@H](O)C[C@H]1O,C27639026_decoy,TRY1,Decoy,0,-10.3288,-6.48,-2.82,-8.4930321537213
O=C(c1ccc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O)[C@@H](O)Cc1ccc(O)cc1,C31156803_decoy,TRY1,Decoy,0,-6.12415,-8.07,-2.73,-5.812255684945895
O=C(OCc1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]1(O)C=CCC[C@H]1O,C31165584_decoy,TRY1,Decoy,0,-7.20449,-6.42,-1.7,-6.8859499701081
CC(=O)c1ccc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,C31415451_decoy,TRY1,Decoy,0,-7.18935,-8.65,-2.51,-7.136881879433465
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C33758757_decoy,TRY1,Decoy,0,-6.91239,-9.21,-3.11,-8.36598367870878
O=C(/C=C\c1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C34859045_decoy,TRY1,Decoy,0,-7.3883,-7.61,-3.4,-7.7607035847943
COc1cc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)ccc1O,C35183232_decoy,TRY1,Decoy,0,-8.02314,-9.23,-0.88,-11.330650037553658
CC(C)CC[C@]1(O)C(=O)C(C)(C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]1O,C35464793_decoy,TRY1,Decoy,0,-7.09107,-5.35,-2.37,-5.435691241303857
COc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)ccc1O,C08740518_decoy,TRY1,Decoy,0,-7.96852,-8.42,-1.51,-8.595322628309724
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCCCCNC(=O)/C(C#N)=C\c1ccc(O)c(O)c1,C17259427_decoy,TRY1,Decoy,0,-8.95919,-7.28,-4.0,-7.795045584590332
CC(C)(O)[C@@H](O)CC[C@@H](CO)[C@H]1CC[C@]2(C)C3=C(C[C@H](O)[C@@]12C)[C@@]1(C)C[C@H](O)[C@H](O)C(C)(C)[C@@H]1CC3,C35271621_decoy,TRY1,Decoy,0,-10.0561,-6.82,-1.81,-6.239991504742423
CC[NH+](CC)C[C@H]1[C@@H](C(=O)N/N=C/C2[NH+]=c3ccccc3=[NH+]2)N=NN1c1nonc1N,C39205136_decoy,TRY1,Decoy,0,-7.37438,-8.33,-2.17,-7.878428956118144
O=C(N/N=C/c1ccc(/C=N/NC(=O)c2ccc(O)cc2O)cc1)c1ccc(O)cc1O,C02854266_decoy,TRY1,Decoy,0,-8.53411,-5.84,-4.91,-7.626318630782459
O=C(N/N=C(\[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C40151235_decoy,TRY1,Decoy,0,-7.79062,-8.01,-1.53,-8.014524922586892
O=C(N/N=C(\[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C40151237_decoy,TRY1,Decoy,0,-7.17902,-7.57,-1.14,-6.954144608190999
O=C(N/N=C(\[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C40151239_decoy,TRY1,Decoy,0,-7.47911,-5.57,-1.58,-5.942201023941179
O=C(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)c1ccc(O)cc1,C40151308_decoy,TRY1,Decoy,0,-8.55882,-8.34,-1.85,-8.355549218026702
Cc1ccc(C(=O)N/N=C(\[C@@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)cc1,C40151343_decoy,TRY1,Decoy,0,-9.49938,-7.86,-1.83,-7.379812655897632
Cc1ccc(C(=O)N/N=C(\[C@@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@@H](O)[C@H](O)CO)cc1,C40151346_decoy,TRY1,Decoy,0,-8.74701,-7.92,-3.71,-7.024233468677236
COc1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C43729982_decoy,TRY1,Decoy,0,-8.34327,-9.4,-0.6,-11.379509500301149
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NC(CO)CO)[C@@H](O)C[C@@H]1O,C43771997_decoy,TRY1,Decoy,0,-10.5565,-5.72,-2.78,-10.771720087417483
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C44021884_decoy,TRY1,Decoy,0,-6.04537,-6.91,-1.9,-5.966690398885891
O[C@@H](C[NH2+]CC[NH2+]C[C@H](O)COCc1ccccc1Cl)COCc1ccccc1Cl,C22790035_decoy,TRY1,Decoy,0,-7.86169,-5.78,-2.16,-6.321399420392453
Nc1ncnc2c1nc(N/N=C/c1cccc([N+](=O)[O-])c1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C08964851_decoy,TRY1,Decoy,0,-7.29355,-8.77,-2.03,-8.939694181834279
C[C@H]([NH2+]C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH2+][C@@H](C)c2ccccc2)cc1)c1ccccc1,C13659930_decoy,TRY1,Decoy,0,-9.12173,-6.61,-3.94,-6.399234650989709
[NH3+][C@H](COc1cncc(/C=C/c2cc[nH+]c(NC3CC3)c2)c1)CC1=c2ccccc2=[NH+]C1,C52627566_decoy,TRY1,Decoy,0,-11.1531,-6.22,-2.55,-6.23899734927242
CCCC[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]CCCC)c1Cl,C59382696_decoy,TRY1,Decoy,0,-9.00398,-5.27,-2.87,-6.182826678494312
NC(=O)CN(CC(N)=O)S(=O)(=O)c1c(Br)cc(N)cc1Br,C61807265_decoy,TRY1,Decoy,0,-7.0674,-5.01,-2.44,-4.651513710655092
NC(=O)CN(CC(N)=O)S(=O)(=O)c1c(N)cc(Br)cc1Br,C61807273_decoy,TRY1,Decoy,0,-8.54587,-4.72,-2.12,-5.365769822707432
O=C(CS[C@@H]1N[C@@H](c2ccco2)Nc2cc(=O)[nH]n21)NCC1[NH+]=c2ccccc2=[NH+]1,C63648743_decoy,TRY1,Decoy,0,-8.32008,-7.69,-2.12,-6.475355353686679
Cc1ccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c(C)c1,C64098040_decoy,TRY1,Decoy,0,-9.10259,-6.71,-2.75,-5.71994928891688
O=C1c2c(O)cccc2-c2nn(CC[NH2+]CCO)c3ccc(NCC[NH2+]CCO)c1c23,C01583637_decoy,TRY1,Decoy,0,-9.93691,-5.35,-3.88,-7.2431262587411025
O=C(OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)cc1Cl,C12661066_decoy,TRY1,Decoy,0,-7.69849,-7.99,-2.45,-7.896497153579042
Nc1nc(SCCNC(=O)CCc2ccc(O)cc2)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05733414_decoy,TRY1,Decoy,0,-10.2869,-7.93,-2.36,-7.918592501112268
COc1cc(C[C@@H](CO)[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)Cc2ccc(O)c(OC)c2)ccc1O,C14694395_decoy,TRY1,Decoy,0,-9.00989,-7.72,-3.02,-8.23513316501054
OCC(CO)(CO)[NH2+]C[C@H](O)COc1ccc(OC[C@@H](O)C[NH2+]C(CO)(CO)CO)cc1,C15636671_decoy,TRY1,Decoy,0,-7.7274,-5.2,-2.91,-7.810738394397521
OCC(CO)(CO)[NH2+]C[C@@H](O)COc1ccc(OC[C@H](O)C[NH2+]C(CO)(CO)CO)cc1,C15636673_decoy,TRY1,Decoy,0,-7.73879,-5.97,-3.32,-5.372674307533317
OCC(CO)(CO)[NH2+]C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH2+]C(CO)(CO)CO)cc1,C15636675_decoy,TRY1,Decoy,0,-8.8777,-5.87,-2.87,-6.297577642540068
C[C@@H](O)C[C@@H](O)N(C(=S)N([C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O,C16576241_decoy,TRY1,Decoy,0,-6.94152,-4.4,-1.9,-5.488584524273509
C[C@H](O)C[C@@H](O)N(C(=S)N([C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O,C16576242_decoy,TRY1,Decoy,0,-8.27457,-3.8,-3.31,-5.57738128803314
C[C@@H](O)C[C@H](O)N(C(=S)N([C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O,C16576244_decoy,TRY1,Decoy,0,-8.35226,-4.62,-1.93,-6.2630074891896514
C[C@H](O)C[C@H](O)N(C(=S)N([C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O,C16576245_decoy,TRY1,Decoy,0,-7.09864,-4.59,-4.49,-5.5957379604799335
OC[C@H]1O[C@@H](OC[C@@H](O)[C@@H](O)[C@@H](O)c2cnn(-c3ccccc3)n2)[C@H](O)[C@@H](O)[C@@H]1O,C16951658_decoy,TRY1,Decoy,0,-6.59041,-7.13,-2.3,-6.308317312286171
CC(=O)N[C@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O,C22064717_decoy,TRY1,Decoy,0,-4.33312,-5.67,-2.4,-3.947983244424853
CC(=O)N[C@@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O,C22064721_decoy,TRY1,Decoy,0,-5.49601,-5.61,-3.42,-4.340102449781894
CC(=O)N[C@@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C22064729_decoy,TRY1,Decoy,0,-5.81898,-6.02,-3.2,-5.070367354697765
CC(C)CC(=O)O[C@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@@H](O)[C@@](O)(CO)[C@@H]12,C31158075_decoy,TRY1,Decoy,0,-8.40235,-6.64,-2.2,-7.827290243780467
CC(C)=CCC[C@](C)(O)[C@H](O)C[C@@H](O)/C(C)=C/COC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C31161878_decoy,TRY1,Decoy,0,-9.98563,-6.56,-3.33,-7.709074213037296
CC[C@@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)C,C31164867_decoy,TRY1,Decoy,0,-6.56661,-6.53,-4.54,-6.519248654566541
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C31166720_decoy,TRY1,Decoy,0,-6.67472,-7.67,-1.22,-5.572872472680494
COc1cc(C[C@@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C31167921_decoy,TRY1,Decoy,0,-9.63393,-7.59,-3.94,-7.92202973263533
CO[S@](=O)(=S)CCNC(=O)[C@@H]([NH3+])CCCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21,C33696508_decoy1,TRY1,Decoy,0,-9.8475,-5.24,,-5.587269225484913
CC(=O)N[C@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]1O,C33752197_decoy,TRY1,Decoy,0,-4.79555,-5.49,-3.1,-4.283238413954229
OC[C@@H](O)[C@@H]1O[C@@H](Nc2cccc(N[C@H]3O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]3O)c2)[C@H](O)[C@@H]1O,C18163172_decoy,TRY1,Decoy,0,-4.9211,-6.3,-2.37,-4.52674202148922
C[C@H](O)C[C@H](O)N(C(=S)N([C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O,C35188396_decoy,TRY1,Decoy,0,-7.90049,-5.15,-1.81,-8.698877316923282
C[C@@H](O)C[C@@H](O)N(C(=S)N([C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O,C35188402_decoy,TRY1,Decoy,0,-7.75422,-4.64,-3.54,-6.270153781893752
COc1cc(C[C@H](CO)[C@@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)Cc2ccc(O)c(OC)c2)ccc1O,C35455239_decoy,TRY1,Decoy,0,-8.4023,-6.59,-2.48,-6.4727355858257205
CC(C)=CCC[C@](C)(O)[C@@H](O)C[C@H](O)/C(C)=C/COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C35457510_decoy,TRY1,Decoy,0,-9.15441,-5.62,-3.49,-6.314441453430581
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O,C35458207_decoy,TRY1,Decoy,0,-8.56192,-10.01,-3.88,-8.047740563900799
OC[C@H]1CCCOCCCCC[C@@H](O[C@H]([C@H](O)CO)[C@@H](O)c2cnn(-c3ccccc3)n2)[C@@H](O)[C@@H](O)[C@H]1O,C37263631_decoy,TRY1,Decoy,0,-8.20266,-8.39,-2.1,-7.136056211540694
CC(C)CC(=O)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C31159308_decoy,TRY1,Decoy,0,-8.95632,-9.21,-3.11,-8.769116153903315
OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O,C31154941_decoy,TRY1,Decoy,0,-6.13415,-7.6,-3.38,-5.682937226735058
N#C/C(=C\c1cc(O)c(O)c(O)c1)C(=O)NCCCNC(=O)/C(C#N)=C/c1cc(O)c(O)c(O)c1,C05538355_decoy,TRY1,Decoy,0,-11.3412,-10.88,-4.09,-11.701141972343558
CC(C)[C@H](O)C[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C36378963_decoy,TRY1,Decoy,0,-5.84914,-4.72,-3.5,-4.397014515982601
CC(C)[C@@H](O)C[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C36378967_decoy,TRY1,Decoy,0,-5.40307,-5.37,-2.44,-5.038105748651639
CC(C)[C@H](O)C[C@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C36378969_decoy,TRY1,Decoy,0,-6.4323,-6.67,-2.74,-5.504554544376948
CC(C)[C@@H](O)C[C@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C36378971_decoy,TRY1,Decoy,0,-6.76607,-6.68,-2.76,-6.314596882628226
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193622_decoy,TRY1,Decoy,0,-5.80051,-6.73,-2.99,-5.382372725766912
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193643_decoy,TRY1,Decoy,0,-7.64928,-5.34,-2.07,-5.168513270025429
C[C@@H](O)C[C@@H](O)N(C(=S)N([C@H](O)C[C@@H](C)O)[C@@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O,C35188398_decoy,TRY1,Decoy,0,-7.13108,-5.07,-1.86,-5.635293506905486
C[C@H](O)C[C@@H](O)N(C(=S)N([C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O)[C@H](O)C[C@@H](C)O,C35188400_decoy,TRY1,Decoy,0,-7.49151,-3.49,-3.64,-5.008317280095825
[NH3+]CCCCCNC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C43763990_decoy,TRY1,Decoy,0,-9.68017,-5.58,-4.01,-6.327855423588942
CCCCCCO[C@@H]1O[C@@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168880_decoy,TRY1,Decoy,0,-6.06487,-6.96,-4.81,-5.216109083001427
CCCCCCO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168885_decoy,TRY1,Decoy,0,-4.81612,-5.34,-3.2,-4.595714995516206
CCCCCCO[C@@H]1O[C@@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168890_decoy,TRY1,Decoy,0,-7.33107,-6.74,-4.37,-6.228424243863013
Nc1nccc(Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc2)n1,C52627706_decoy,TRY1,Decoy,0,-8.30224,-9.62,-2.72,-7.219993092978368
C[C@H](O)C[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]C[C@@H](C)O)c1Cl,C59382699_decoy,TRY1,Decoy,0,-8.81794,-5.68,-3.06,-6.55585807085337
C[C@H](O)C[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]C[C@H](C)O)c1Cl,C59382701_decoy,TRY1,Decoy,0,-7.72754,-6.8,-2.7,-6.628971132592633
CCC[NH+](CCC)C[C@@H]1[C@@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NNN1c1nonc1N,C63426949_decoy,TRY1,Decoy,0,-8.46597,-7.89,-1.38,-8.289209362520904
CCc1ccc(N2C(=O)Nc3ccccc3[C@]2(O)C(=O)NCC[NH+](CC)CC)cc1,C03665914_decoy,TRY1,Decoy,0,-7.96011,-5.93,-1.14,-7.4767179974317886
CCc1ccc(N2C(=O)Nc3ccccc3[C@@]2(O)C(=O)NCC[NH+](CC)CC)cc1,C03665913_decoy,TRY1,Decoy,0,-7.22976,-5.94,-2.53,-6.799850467227168
CC[NH+](CC)CCNC(=O)[C@@]1(O)c2ccccc2NC(=O)N1c1ccc(C)c(C)c1,C03665917_decoy,TRY1,Decoy,0,-7.82871,-6.51,-1.14,-7.18693749785126
Cc1cccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)n2)c1,C01068107_decoy,TRY1,Decoy,0,-8.47493,-8.23,-1.54,-6.184960102322822
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4ccccc4F)CC3)n2)cc1C,C04740291_decoy,TRY1,Decoy,0,-8.40764,-5.74,-2.17,-5.064885163881565
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccc(-c3ccc(F)c(Cl)c3)o2)cc1,C07539806_decoy,TRY1,Decoy,0,-8.20729,-6.52,-3.98,-5.449732240055977
C[NH+]1CCc2c(sc(NC(=O)CCCSc3ccc(F)cc3)c2C(N)=O)C1,C09474778_decoy,TRY1,Decoy,0,-9.57206,-6.44,-2.15,-6.368467502084716
C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](C[NH2+]CCc4c[nH]c5ccc(O)cc45)[C@H]3C[C@H]12,C12661773_decoy,TRY1,Decoy,0,-8.30949,-8.6,-1.51,-6.475362617490356
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(F)c(F)c4F)c3)cc12,C14961627_decoy,TRY1,Decoy,0,-8.99471,-9.4,-1.5,-8.177134828736337
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(F)c(Cl)c4)c3)cc12,C14961663_decoy,TRY1,Decoy,0,-10.7815,-8.03,-2.51,-8.433989439285414
C[C@@H](C(=O)Nc1cccc(Br)c1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C15044935_decoy,TRY1,Decoy,0,-8.60533,-7.98,-1.78,-6.839199472688839
Cc1c(CNCC[NH2+]CCO)c2ccccc2n1Cc1ccc(Cl)cc1Cl,C20477656_decoy,TRY1,Decoy,0,-8.40408,-5.11,-1.38,-5.055452899298681
CCOc1c(Br)cc(C[NH2+]CCNC[C@H](C)O)cc1Br,C20477758_decoy,TRY1,Decoy,0,-8.48371,-5.29,-2.28,-5.26154098536508
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccccc1O)N2,C20707743_decoy,TRY1,Decoy,0,-8.07753,-6.99,-2.15,-6.499692189186917
CC[C@H](C)NC(=O)CSc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccccc1Cl,C04686310_decoy,TRY1,Decoy,0,-8.72278,-7.41,-2.74,-8.200385548926544
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(c2cccc(Cl)c2)CC1,C22010358_decoy,TRY1,Decoy,0,-8.46952,-6.5,-2.43,-5.072096767197576
CCOc1c(Br)cc(Br)cc1CNCC[NH2+]C[C@@H](C)O,C22074853_decoy,TRY1,Decoy,0,-9.06982,-4.21,-3.6,-5.156311060649066
O=c1c(-c2ccc(F)cc2)c(C(F)(F)F)oc2c(C[NH2+]CCCO)c(O)ccc12,C23127142_decoy,TRY1,Decoy,0,-7.3955,-6.9,-3.71,-5.652583358852177
NC(=O)COc1c(Br)cc(C[NH2+]C2CCCCC2)cc1Br,C36612926_decoy,TRY1,Decoy,0,-8.83508,-4.77,-1.71,-6.096051494344766
C[C@@H]([NH2+]Cc1ccc(S(N)(=O)=O)cc1)c1ccc(I)cc1,C37199371_decoy,TRY1,Decoy,0,-9.5245,-5.19,-3.11,-5.816274781942548
C[C@@H]([NH2+]Cc1ccc(I)o1)c1ccc(S(N)(=O)=O)cc1,C37278061_decoy,TRY1,Decoy,0,-9.17291,-4.9,-3.22,-5.12852694993052
C[NH+](C)CCNc1nc(-c2cccc(F)c2)c2c(N)n(Cc3ccccc3)nc2n1,C37361092_decoy,TRY1,Decoy,0,-7.92502,-6.8,-1.38,-6.009694430224396
Cc1cccc(-c2nc(NCC[NH+](C)C)nc3nn(-c4cccc(F)c4)c(N)c23)c1,C37375929_decoy,TRY1,Decoy,0,-7.61588,-6.69,-0.46,-6.473148338716048
Nc1c2c(-c3ccsc3)nc(NCC[NH+]3CCCC3)nc2nn1-c1ccccc1,C37376332_decoy,TRY1,Decoy,0,-8.79528,-5.81,-2.09,-5.287766845686696
CN1C=C(C[NH2+]CCSc2cn[nH]n2)[C@@H](c2ccc(Oc3ccccc3)cc2)N1,C39358091_decoy,TRY1,Decoy,0,-8.91628,-7.53,-1.52,-7.631115872980805
O=C(NCCc1c[nH]c2ccccc12)[C@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C39597544_decoy,TRY1,Decoy,0,-8.01739,-6.79,-1.75,-6.547918494691621
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)[C@@H]4CSc5ccccc54)CC34CC[NH2+]CC4)c2c1,C39656133_decoy,TRY1,Decoy,0,-8.46403,-9.35,-4.01,-10.152205500207948
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)[C@H]4CSc5ccccc54)CC34CC[NH2+]CC4)c2c1,C39656137_decoy,TRY1,Decoy,0,-9.6422,-6.79,-2.75,-6.952956155197606
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39674118_decoy,TRY1,Decoy,0,-8.96786,-6.5,-2.51,-6.318519184755316
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39674119_decoy,TRY1,Decoy,0,-7.75177,-8.79,-1.65,-7.458856185052637
Cc1cccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)c1,C39676373_decoy,TRY1,Decoy,0,-9.06008,-8.57,-1.53,-6.57526943391004
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4ccc(Cl)cc4)CC34CC[NH2+]CC4)c[nH]c12,C39684104_decoy,TRY1,Decoy,0,-8.84735,-7.42,-2.92,-6.697150662139377
C=CC[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@@H]1c1ccc(C)c(C)c1,C39744820_decoy,TRY1,Decoy,0,-8.89347,-6.7,-1.58,-6.467773627088823
O=C(C[NH+]1CCC[C@@H]1[C@@H]1Nc2ccccc2S1)NCCc1c[nH]c2ccccc12,C39982699_decoy,TRY1,Decoy,0,-8.14471,-7.03,-0.89,-5.948365241573654
CC(C)Oc1c(Br)cc(Br)cc1C[NH2+]CCNCCO,C40719648_decoy,TRY1,Decoy,0,-8.63305,-3.85,-0.86,-5.210706272230976
Cn1nc(C(F)(F)F)c(C[C@@H]([NH3+])CO)c1Sc1ccc(Br)cc1,C44465463_decoy,TRY1,Decoy,0,-7.0932,-4.9,-1.9,-4.862098158392081
C[C@H]([NH2+]CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1ccc(Cl)cc1Cl,C08531614_decoy,TRY1,Decoy,0,-8.54058,-8.88,-2.01,-8.549809822155543
C[C@H]([NH2+]C1CCN(CC(N)=O)CC1)c1ccc(Br)cc1Br,C41650374_decoy,TRY1,Decoy,0,-9.30175,-5.23,-2.33,-5.210739963977251
C[C@@H]([NH2+]C1CCN(CC(N)=O)CC1)c1ccc(Br)cc1Br,C41650378_decoy,TRY1,Decoy,0,-9.60685,-6.65,-1.57,-7.328761819407128
CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)cc1,C44031590_decoy,TRY1,Decoy,0,-9.24812,-6.06,-2.3,-6.400380994070163
C[C@]12CC3CC([NH2+]Cc4cc(Br)ccc4OCC(N)=O)(C1)C[C@@](C)(C3)C2,C20873031_decoy,TRY1,Decoy,0,-8.64637,-6.81,-4.94,-6.821619023143502
CC1(C)CC(NC(=O)CSc2nc(-c3cccc(Cl)c3)n[nH]2)CC(C)(C)[NH2+]1,C59793862_decoy,TRY1,Decoy,0,-8.76394,-5.47,-2.11,-5.162203328495633
O=C(CNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)Nc1ccc(Cl)cc1,C54649206_decoy,TRY1,Decoy,0,-7.7916,-8.0,-1.01,-6.775336779334592
O=C(CNC(=O)c1cccs1)NNC1=c2cc(Br)ccc2=[NH+]C1=O,C18246813_decoy,TRY1,Decoy,0,-8.25848,-7.45,-1.13,-6.994643569199307
O=C(CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1)NC[C@@H](O)c1ccccc1,C63271541_decoy,TRY1,Decoy,0,-8.21477,-8.38,-1.38,-6.930315026699002
CC(C)[C@H](C(=O)N[C@@H](C)CC1=c2ccccc2=[NH+]C1)N1NNc2ccccc2C1=O,C63279751_decoy,TRY1,Decoy,0,-7.78274,-6.96,-1.62,-7.380196622053971
CC1=C(CC(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)[C@@H](C)N(c2ccc(F)cc2)N1,C64109127_decoy,TRY1,Decoy,0,-8.26808,-8.18,-0.69,-6.4278646626047
CC1=C(CC(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)[C@H](C)N(c2ccc(F)cc2)N1,C64109128_decoy,TRY1,Decoy,0,-9.42419,-8.93,-1.07,-7.003990073317796
CCC[NH+]1c2ccccc2N[C@@H]1CCc1ccccc1[N-]S(=O)(=O)c1c[nH+]c[nH]1,C64518860_decoy,TRY1,Decoy,0,-7.89037,-6.56,-3.67,-6.293415246950695
CCC[NH+]1c2ccccc2N[C@@H]1CCc1cccc([N-]S(=O)(=O)c2c[nH+]c[nH]2)c1,C64518869_decoy,TRY1,Decoy,0,-7.8136,-6.59,-1.74,-6.209221959441427
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C04095900_decoy,TRY1,Decoy,0,-9.25884,-7.69,-3.08,-5.827382704959381
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C04097822_decoy,TRY1,Decoy,0,-9.92962,-7.66,-2.1,-6.852211593875835
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C08632662_decoy,TRY1,Decoy,0,-10.0623,-7.48,-2.98,-6.77794307623417
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C08632667_decoy,TRY1,Decoy,0,-10.0433,-8.85,-2.46,-6.787543147518436
CCc1nc(N)sc1C(=O)N/N=C\c1cc(Br)c(O)c(Br)c1O,C08798084_decoy,TRY1,Decoy,0,-9.85877,-7.77,-0.19,-10.24635821927034
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C08877382_decoy,TRY1,Decoy,0,-10.7425,-8.75,-1.45,-6.860938750912808
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C,C08877385_decoy,TRY1,Decoy,0,-10.3376,-8.41,-2.27,-6.910308455538698
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C08877390_decoy,TRY1,Decoy,0,-9.26522,-6.41,-2.94,-5.280844659616192
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C,C08877391_decoy,TRY1,Decoy,0,-9.54213,-7.04,-2.31,-5.741364018252598
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C08951974_decoy,TRY1,Decoy,0,-9.91369,-6.18,-2.03,-5.871092716458871
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C08952404_decoy,TRY1,Decoy,0,-10.4738,-7.36,-2.58,-6.142518285254974
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@H](C(=O)Nc2cccc(Cl)c2Cl)CC(=O)N3)CC1,C12391413_decoy,TRY1,Decoy,0,-8.53001,-8.07,-1.92,-7.4026269012425665
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C12653547_decoy,TRY1,Decoy,0,-9.29524,-6.32,-1.22,-5.566809675182216
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C,C12868290_decoy,TRY1,Decoy,0,-9.52559,-7.07,-1.52,-6.0797339938277055
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,C12868300_decoy,TRY1,Decoy,0,-9.04843,-7.53,-2.7,-5.740741164498396
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C12869814_decoy,TRY1,Decoy,0,-9.86531,-8.34,-2.32,-6.284787578799428
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C12869827_decoy,TRY1,Decoy,0,-9.66441,-8.22,-2.52,-6.425319484021304
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C13298459_decoy,TRY1,Decoy,0,-10.9258,-6.47,-1.53,-6.748471822321482
Oc1nc(Nc2ccc(Cl)cc2)nc(O)c1-c1c(O)nc(Nc2ccc(Cl)cc2)nc1O,C16857129_decoy,TRY1,Decoy,0,-9.50082,-6.62,-2.76,-7.394828188167091
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C16953369_decoy,TRY1,Decoy,0,-10.7152,-6.28,-1.19,-6.2215970494943456
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C17147377_decoy1,TRY1,Decoy,0,-9.55792,-8.39,,-6.354582686585227
Cc1c(Cl)cccc1NC(=O)[C@@H]1CC(=O)Nc2nc(N3CCC(C(N)=O)CC3)[nH]c(=O)c21,C22610526_decoy,TRY1,Decoy,0,-9.46514,-7.2,-1.13,-6.61766070966299
N#CC1=C(N)NC(SCC(=O)c2ccc(Br)cc2)=C(C(N)=O)C12CCCCC2,C14671718_decoy,TRY1,Decoy,0,-10.2399,-6.26,-2.12,-7.096572425158321
C=CC(C)(C)c1c(O)cc(O)c2c(=O)c(O)c(-c3cc(O)c4c(c3CC=C(C)C)C[C@@H](O)C(C)(C)O4)oc12,C31167948_decoy,TRY1,Decoy,0,-7.97424,-7.93,-4.44,-6.81098430188582
C=CC(C)(C)c1c(O)cc(O)c2c(=O)c(O)c(-c3cc(O)c4c(c3CC=C(C)C)C[C@H](O)C(C)(C)O4)oc12,C31167951_decoy,TRY1,Decoy,0,-8.38915,-5.96,-2.72,-6.091683290932628
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C32911498_decoy,TRY1,Decoy,0,-9.6677,-6.4,-2.28,-7.024268421222907
C[C@H]([C@H](O)CCC(C)(C)O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C35024622_decoy,TRY1,Decoy,0,-11.0491,-8.06,-2.42,-6.826034444751032
C[C@@H]([C@H](O)CCC(C)(C)O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C35024624_decoy,TRY1,Decoy,0,-10.9287,-5.19,-2.5,-5.85977858084526
C[C@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C35024627_decoy,TRY1,Decoy,0,-10.5318,-6.63,-2.19,-6.209098281142532
C[C@@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C35024630_decoy,TRY1,Decoy,0,-10.8979,-5.89,-2.54,-6.226359766030262
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@@]12C,C35493962_decoy,TRY1,Decoy,0,-10.5768,-8.96,-4.3,-7.089450091299131
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)c1ccccc1Cl,C36543470_decoy,TRY1,Decoy,0,-8.96029,-6.27,-3.64,-6.701252482641202
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C36384899_decoy,TRY1,Decoy,0,-10.5077,-6.21,-1.72,-5.947943749404182
CC1=C(Nc2c(C)cc(O)cc2O)C(=O)C=c2oc3c(c21)C(C)=C(Nc1c(C)cc(O)cc1O)C(=O)C=3,C01611596_decoy,TRY1,Decoy,0,-10.2562,-8.63,-2.11,-9.656509294910396
CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3c(c(C(=O)/C=C\c4ccccc4)c2O)OC(C)(C)C=C3)c1O,C13704080_decoy,TRY1,Decoy,0,-8.61391,-8.41,-1.7,-7.433928981629544
CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3c(c(C(=O)/C=C/c4ccccc4)c2O)OC(C)(C)C=C3)c1O,C03874886_decoy,TRY1,Decoy,0,-9.69857,-8.38,-2.66,-8.059454939910738
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C04165864_decoy,TRY1,Decoy,0,-10.8178,-9.41,-3.87,-7.034335641059866
C[C@H]1c2cc(O)c(O)cc2CCN1c1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O,C39264992_decoy,TRY1,Decoy,0,-8.69899,-6.32,-3.29,-6.684830975716473
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C43721953_decoy,TRY1,Decoy,0,-10.9475,-6.27,-1.52,-7.418057197922466
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C43735718_decoy,TRY1,Decoy,0,-9.71998,-7.78,-1.74,-6.200570972705682
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@H](O)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C43742930_decoy,TRY1,Decoy,0,-10.9694,-6.96,-1.93,-7.137845276713779
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C43743096_decoy,TRY1,Decoy,0,-10.8506,-8.39,-1.64,-7.4017763447578
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C44184656_decoy,TRY1,Decoy,0,-10.9444,-6.47,-1.84,-6.204262134686215
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C44681135_decoy,TRY1,Decoy,0,-10.2984,-7.3,-1.82,-6.711768688312255
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C44830918_decoy,TRY1,Decoy,0,-9.91434,-7.85,-1.38,-6.55900259470916
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@H](CC(N)=O)[C@H]3C(=O)N(c4ccc(C(N)=O)cc4)C(=O)[C@H]31)C(=O)N2,C15958455_decoy,TRY1,Decoy,0,-8.11414,-5.73,-1.54,-5.270917817833894
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C01280287_decoy,TRY1,Decoy,0,-9.9528,-7.47,-3.41,-6.773348768659632
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C01280290_decoy,TRY1,Decoy,0,-10.1309,-6.84,-2.06,-6.366017950854227
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@@H](c2ccc(Br)cc2)NC(=S)N1,C59384232_decoy,TRY1,Decoy,0,-9.47725,-6.65,-1.42,-6.628199309514523
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C17147377_decoy2,TRY1,Decoy,0,-8.78436,-7.13,,-6.073511416164151
CC[C@@H](c1nnnn1C1CCCC1)[NH+](CCCO)Cc1cc2cc(C)ccc2[nH]c1=O,C04847571_decoy,TRY1,Decoy,0,-7.57828,-7.49,-3.01,-6.324881155467851
Cc1ccc2cc(C[NH+](CCCO)[C@@H](c3nnnn3C(C)(C)C)C(C)C)c(=O)[nH]c2c1,C04848018_decoy,TRY1,Decoy,0,-7.5005,-6.8,-1.87,-9.127324337903538
CCC[C@H](c1nnnn1C(C)(C)C)[NH+](CCO)Cc1cc2ccc(C)cc2[nH]c1=O,C04848027_decoy,TRY1,Decoy,0,-7.11742,-6.15,-2.11,-7.106064859331041
CCOC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)CC[NH+]1CCCC(C)(C)C1,C02247473_decoy,TRY1,Decoy,0,-9.10653,-7.29,-2.53,-6.700281033465037
Cc1ccc(C(=O)N/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)NCCC[NH+](C)C)cc1,C05257394_decoy,TRY1,Decoy,0,-8.46292,-7.26,-3.83,-7.515437650308911
Cc1cccc(C)c1NC(=O)C[NH+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl,C06639241_decoy,TRY1,Decoy,0,-7.04577,-6.73,-1.61,-5.5515936537020325
O=C1NC(c2ccccc2)=[NH+][C@@]1(Nc1nc2ccc([N+](=O)[O-])cc2s1)C(F)(F)F,C02863580_decoy,TRY1,Decoy,0,-8.40927,-6.35,-1.84,-7.200501897201713
C[C@@H](O)CN(C[C@@H](C)O)c1ncnc2c1sc1[nH+]c(N3CCCC3)c3c(c12)CC(C)(C)OC3,C02417609_decoy,TRY1,Decoy,0,-10.0242,-4.96,-1.93,-6.082772543021639
O=C(C[NH+]1CCC2(CC1)NC(=O)N(Cc1ccc(Cl)cc1)C2=O)Nc1ccc2c(c1)OCO2,C09419186_decoy,TRY1,Decoy,0,-9.40476,-5.75,-1.12,-5.480336127647902
CC[NH+](CC(=O)Nc1ccccc1OC)Cc1nc2scc(-c3ccco3)c2c(=O)[nH]1,C09783488_decoy,TRY1,Decoy,0,-6.4757,-6.11,-0.86,-5.059483967569229
CC[NH+](CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)Cc1ccc2c(c1)OCO2,C11351646_decoy,TRY1,Decoy,0,-8.64988,-6.07,-2.61,-5.4906372724375645
Cn1cccc1[C@H](CNC(=O)C(=O)Nc1ccc2c(c1)OCO2)[NH+]1CCc2ccccc2C1,C11898390_decoy,TRY1,Decoy,0,-9.13083,-8.03,-3.27,-6.493876625902452
C[NH+](C)CCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=O)Nc1cccc(Cl)c1,C12710694_decoy,TRY1,Decoy,0,-8.94855,-6.64,-1.54,-5.989863716994189
Cn1cnnc1SCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1C/C=C/c1ccccc1,C12836842_decoy,TRY1,Decoy,0,-8.63196,-6.63,-2.3,-6.09755647414474
CN1CCc2cc([C@H](CNC(=O)C(=O)Nc3ccccc3[N+](=O)[O-])[NH+]3CCCC3)ccc21,C08964172_decoy,TRY1,Decoy,0,-7.84172,-8.22,-3.22,-6.579612740463155
CC[C@@]1(C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)NC(=O)N(Cc2ccc3c(c2)OCO3)C1=O,C20203993_decoy,TRY1,Decoy,0,-6.6872,-6.91,-1.43,-4.953964134622623
C[C@@H]1CN(C(=O)c2nc3ccc(Cl)cn3c2C[NH2+]Cc2[nH]nc3c2CCC3)C[C@H](C)O1,C20233759_decoy,TRY1,Decoy,0,-8.44931,-5.18,-1.54,-5.708019203628134
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)C[NH+](C)Cc3ccc(Cl)s3)C2=O)cc1,C22062429_decoy,TRY1,Decoy,0,-8.1896,-7.48,-1.65,-7.156553266090442
COC(=O)c1c(NC(=O)CN2CC[NH+]([C@H](C)C(=O)NC3CC3)CC2)sc2c1CC[C@@H](C)C2,C23248823_decoy,TRY1,Decoy,0,-9.68579,-6.95,-2.87,-6.2219079499206895
O=C(C[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1)NC(=O)Nc1ccc2c(c1)OCCO2,C23824882_decoy,TRY1,Decoy,0,-9.2533,-10.43,-3.85,-8.113716532577246
Cc1ccc(-c2noc([C@H](C)[NH+]3CCN(Cc4nc(N)c5ccccc5n4)CC3)n2)cc1,C26600560_decoy,TRY1,Decoy,0,-8.09206,-8.74,-1.34,-6.225332743846337
COc1cc(Nc2nccc(-c3ccc(N4CCC[NH2+]CC4)nc3)n2)cc(OC)c1OC,C26996822_decoy,TRY1,Decoy,0,-10.055,-5.88,-2.62,-6.4380170866136455
CC[NH+]1CCC[C@H]1CN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=O)NC1CCCCC1,C12711072_decoy,TRY1,Decoy,0,-9.28946,-7.69,-2.0,-7.469814304765981
NS(=O)(=O)c1ccc(OCC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1,C32850935_decoy,TRY1,Decoy,0,-7.26786,-6.6,-2.6,-5.290716461436477
CCCC[NH+]1CCN(c2nc3sc4c(c3c(=O)n2CC(N)=O)CC(C)(C)OC4)CC1,C34734751_decoy,TRY1,Decoy,0,-8.68723,-6.46,-1.33,-5.581812179535012
CN1CCc2cc([C@H](CNC(=O)Nc3ccc4c(c3)OCO4)N3CC[NH+](C)CC3)ccc21,C35597257_decoy,TRY1,Decoy,0,-9.12153,-6.41,-2.16,-5.7863954101536015
Oc1c(O)c(=N\C2CC2)/c1=N/CC[NH+]1CCN(c2nccc3nc(C(F)(F)F)ccc23)CC1,C24910285_decoy,TRY1,Decoy,0,-9.14594,-6.38,-1.68,-6.551348142221509
COC[C@H](O)C[NH+](Cc1nc2sc(C(=O)OC)c(C)c2c(=O)[nH]1)C1CCCCC1,C35747138_decoy,TRY1,Decoy,0,-7.78109,-6.19,-1.47,-7.270642763356603
COc1cccc([C@@H]2C[C@H](C(F)(F)F)N3NC=C(C(=O)Nc4cc(C)on4)C3=[NH+]2)c1,C00884333_decoy,TRY1,Decoy,0,-7.45733,-7.16,-1.94,-5.986774144355076
Cc1cc(N(C)C)nc(NCCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)[nH+]1,C38670736_decoy,TRY1,Decoy,0,-7.76259,-7.44,-2.2,-7.133423310946958
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1NN(Cc2ccc([N+](=O)[O-])cc2)C=C1Br,C39167739_decoy,TRY1,Decoy,0,-7.63808,-7.12,-1.34,-5.35341766358502
CC[C@@H](SC1=N[C@@H]2[NH+]=c3ccccc3=C2N=N1)C(=O)Nc1ccc(NC(C)=O)cc1,C39242917_decoy,TRY1,Decoy,0,-8.0007,-8.11,-1.52,-7.064829669092644
CN1C(=O)[C@H]2[C@H]([NH+]=C(NCCc3c[nH]c4ccccc34)N2Cc2ccc(F)cc2)N(C)C1=O,C39354630_decoy,TRY1,Decoy,0,-7.49007,-5.96,-0.69,-5.237621437368095
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)N[C@H](C)C(C)C)C4(CC[NH2+]CC4)C3)cccc12,C39608252_decoy,TRY1,Decoy,0,-7.32151,-6.82,-1.39,-5.744369583850757
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)COc3cccc(Cl)c3)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674374_decoy,TRY1,Decoy,0,-9.18079,-6.46,-0.68,-6.242302514404305
Cc1nn(C)c(C)c1NC(=O)[C@@H](C)S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39777080_decoy,TRY1,Decoy,0,-8.01336,-7.73,-1.88,-8.061576203165803
Cc1ccc2cccc(Nc3ncnc(NCC[NH+]4CCCCC4)c3[N+](=O)[O-])c2n1,C40622502_decoy,TRY1,Decoy,0,-7.15297,-5.72,-3.05,-5.455968236759069
C[NH+]1CCN(Nc2ncnc(Nc3ccc(Br)cc3)c2[N+](=O)[O-])CC1,C40623567_decoy,TRY1,Decoy,0,-7.50402,-6.47,-0.76,-5.451406951252852
CCCCn1c(SCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)[nH+]c(C)c1C,C45772416_decoy,TRY1,Decoy,0,-9.20676,-7.75,-2.34,-7.186041987511768
CCOC(=O)CNC(=O)Nc1ccc2sc(N(C(C)C)C(C)C)[nH+]c(=O)c2c1,C35972866_decoy,TRY1,Decoy,0,-7.30175,-6.2,-2.66,-5.2351838010409
COc1cc(-c2n[nH]cc2C[NH+](C)Cc2nc3ccc(Cl)cc3[nH]2)cc(OC)c1OC,C19773063_decoy,TRY1,Decoy,0,-7.66189,-6.07,-2.02,-4.931540394766826
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N3N=C(c4ccco4)C[C@H]3c3ccco3)sc2[nH+]1,C57481738_decoy,TRY1,Decoy,0,-7.70576,-8.01,-2.26,-7.183247997067183
CC(C)(C)n1ncc2c1[NH+]=C(N1CCN(CC(=O)Nc3ccc(F)cc3)CC1)NC2,C58342359_decoy,TRY1,Decoy,0,-7.68676,-7.69,-1.65,-5.9835208517329965
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1,C58865652_decoy,TRY1,Decoy,0,-7.93691,-6.49,-2.79,-5.562114021247864
CNC(=O)C[NH+]1CCC(NC(=O)c2oc3ccccc3c2CSc2ncccn2)CC1,C60300420_decoy,TRY1,Decoy,0,-9.32289,-5.95,-2.08,-5.803763488749055
COCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c(C)cccc21,C63376118_decoy,TRY1,Decoy,0,-8.03855,-6.23,-0.66,-5.883284924103788
N#Cc1c(NC(=O)CN2C(=O)N[C@H](CC3=c4ccccc4=[NH+]C3)C2=O)sc2c1CCCCC2,C63869464_decoy,TRY1,Decoy,0,-8.08429,-6.91,-2.09,-6.783508278705991
Cc1ccn2c(C[NH2+]CCSc3nc[nH]n3)c(C(=O)N3CCCCCC3)nc2c1,C20913043_decoy,TRY1,Decoy,0,-7.43064,-6.91,-1.38,-7.813118370988017
CC(C)Oc1ccc(C2=[NH+][C@@H](c3ccc4c(=O)n(Cc5ccccc5F)c(=O)[nH]c4c3)ON2)cc1,C64392062_decoy,TRY1,Decoy,0,-7.82316,-8.98,-2.92,-5.7227379370734495
COc1ccc(OCC(=O)N2CC[C@@]3(C2)Nc2cccnc2N/C3=[NH+]\C(C)(C)C)cc1,C65266491_decoy,TRY1,Decoy,0,-7.79952,-6.19,-1.72,-5.329563528547643
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)C4CCCCC4)nc3[C@@H](CC(=O)N3CCC(C(N)=O)CC3)[C@]2(C)CC[C@H]1O,C04222303_decoy,TRY1,Decoy,0,-12.1202,-9.04,-3.33,-8.648283687645252
Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C05226233_decoy,TRY1,Decoy,0,-7.9028,-6.69,-1.72,-5.840110943238026
CC(C)CCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06076942_decoy,TRY1,Decoy,0,-8.39633,-6.07,-1.89,-6.674955168002167
CCC(C)(C)NC(=O)[C@@H](c1ccc(OC)cc1)N(CC(C)C)C(=O)c1snc(C(N)=O)c1N,C06462061_decoy,TRY1,Decoy,0,-9.06862,-5.55,-1.83,-6.917821442258213
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(C)o2)cc1,C06843598_decoy,TRY1,Decoy,0,-8.22011,-7.64,-3.41,-8.254220344156952
COCCNC(=O)[C@H](c1ccc(F)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06905058_decoy,TRY1,Decoy,0,-9.04529,-5.56,-2.93,-6.905499537081723
Nc1c(C(=O)NCCC2=CCCCC2)c2nc3ccccc3nc2n1/N=C/c1ccc(O)c(O)c1,C01314843_decoy,TRY1,Decoy,0,-9.81922,-7.67,-1.4,-7.114583729047942
NC(=O)c1c(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)sc2c1CCCC2,C03365569_decoy,TRY1,Decoy,0,-11.8246,-8.6,-2.32,-9.142192208576205
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#CCC4CCC(C(=O)OC)CC4)nc32)[C@@H](O)[C@@H]1O,C11616966_decoy,TRY1,Decoy,0,-7.87619,-6.39,-2.84,-5.613408746786616
COc1cc(-c2cc(=O)c3c(O)c(OC)c(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3o2)ccc1O,C12419121_decoy,TRY1,Decoy,0,-7.98382,-6.24,-2.53,-5.448077497658894
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1,C12477082_decoy,TRY1,Decoy,0,-8.59258,-6.44,-2.37,-7.950019452588698
COc1cc2ccc(=O)oc2cc1O[C@H]1O[C@@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14488180_decoy,TRY1,Decoy,0,-6.21399,-7.9,-1.17,-4.926173841092744
NC(=O)C[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2O)[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]21,C15218514_decoy,TRY1,Decoy,0,-6.05969,-7.43,-4.14,-10.02680012412628
NC(=O)C[C@@]1(C(=O)[O-])[NH2+][C@H](c2ccccc2O)[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]21,C15218518_decoy,TRY1,Decoy,0,-6.86299,-7.17,-2.17,-6.191946579147292
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@H](O)[C@@H](O)CO)c1ccccc1I,C15774946_decoy,TRY1,Decoy,0,-7.83485,-6.6,-1.78,-5.483257431504601
O=C1O[C@@H]([C@H](O)CO)C(=N/Nc2nc3ccccc3[nH]c2=O)/C1=N/Nc1nc2ccccc2[nH]c1=O,C15775116_decoy,TRY1,Decoy,0,-8.75182,-8.45,-2.29,-7.21302538890372
O=C1O[C@@H]([C@@H](O)CO)C(=N/Nc2nc3ccccc3[nH]c2=O)/C1=N/Nc1nc2ccccc2[nH]c1=O,C15775118_decoy,TRY1,Decoy,0,-8.38736,-6.87,-3.09,-6.494168151341943
O=C1O[C@H]([C@H](O)CO)C(=N/Nc2nc3ccccc3[nH]c2=O)/C1=N/Nc1nc2ccccc2[nH]c1=O,C15775120_decoy,TRY1,Decoy,0,-8.95681,-9.75,-1.78,-8.007842672260725
O=C1O[C@H]([C@@H](O)CO)C(=N/Nc2nc3ccccc3[nH]c2=O)/C1=N/Nc1nc2ccccc2[nH]c1=O,C15775122_decoy,TRY1,Decoy,0,-8.97583,-9.3,-3.6,-7.7293669500761855
CC(=O)N[C@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C22063967_decoy,TRY1,Decoy,0,-7.50596,-5.6,-3.7,-5.515548990372329
CC(=O)N[C@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C22063970_decoy,TRY1,Decoy,0,-5.5475,-5.75,-4.77,-4.911824722677629
CC(=O)N[C@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C22063974_decoy,TRY1,Decoy,0,-7.50707,-6.1,-2.64,-5.194142490641525
CC(=O)N[C@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@H](O[C@H]2O[C@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C22063978_decoy,TRY1,Decoy,0,-7.18618,-6.72,-2.01,-5.111005078932873
C[C@H]1CC[C@@H]2C(C)(C)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]2(C)[C@@]1(O)CCC1=CCOC1=O,C31169005_decoy,TRY1,Decoy,0,-7.05164,-6.75,-1.78,-5.564317451509678
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)cc12,C31170156_decoy,TRY1,Decoy,0,-8.78552,-7.36,-2.19,-6.280406176023762
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)N1CCN(CNC(=O)/C(C#N)=C/c2ccc(O)c(O)c2)CC1,C17259469_decoy,TRY1,Decoy,0,-9.64035,-9.45,-2.42,-7.756224578225774
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCN1CCN(C(=O)/C(C#N)=C\c2ccc(O)c(O)c2)CC1,C17259473_decoy,TRY1,Decoy,0,-9.49059,-7.92,-2.55,-7.263705846086585
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCN1CCN(C(=O)/C(C#N)=C/c2ccc(O)c(O)c2)CC1,C17259477_decoy,TRY1,Decoy,0,-8.16059,-9.9,-3.64,-7.309836648154539
CC(=O)N[C@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C35167379_decoy,TRY1,Decoy,0,-6.33871,-6.56,-1.28,-4.946904643365075
CC(=O)N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C35167381_decoy,TRY1,Decoy,0,-5.41518,-5.38,-1.85,-4.137428027057631
CC(=O)N[C@@H]1[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C35167384_decoy,TRY1,Decoy,0,-6.64558,-6.24,-2.31,-5.069782207903971
CC(=O)N[C@@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C35167386_decoy,TRY1,Decoy,0,-6.41233,-6.31,-2.17,-5.026449561899679
CC1=C(C(=O)O[C@@H]2O[C@@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)C(C)(C)CCC1,C35465951_decoy,TRY1,Decoy,0,-7.24245,-6.9,-3.16,-5.768110070808581
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(C)o2)cc1,C06601063_decoy,TRY1,Decoy,0,-9.30123,-6.87,-1.76,-9.603240077992435
CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C31156160_decoy,TRY1,Decoy,0,-8.2863,-8.88,-3.49,-9.096788055961962
Cc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(Br)cc4)N3N)N=N2)cc1,C38989647_decoy,TRY1,Decoy,0,-9.38708,-6.61,-0.3,-6.042327028076638
Cc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4cc(Cl)ccc4C)N3N)N=N2)cc1,C39006589_decoy,TRY1,Decoy,0,-10.5617,-9.23,-1.92,-8.660423920971219
NN1[C@@H](SCC(=O)Nc2ccc(F)c(F)c2)NN[C@H]1[C@H]1C=C(c2ccc(Cl)cc2)N=N1,C39016364_decoy,TRY1,Decoy,0,-10.2319,-6.94,-2.07,-7.289850589420219
Cc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccc(Cl)c(Cl)c4)N3N)N=N2)cc1,C38990378_decoy,TRY1,Decoy,0,-11.7488,-9.13,-1.61,-8.68752412650711
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(Cl)c(Cl)c4)N3N)N=N2)cc1,C38990380_decoy,TRY1,Decoy,0,-10.6607,-6.96,-2.33,-6.374241140922034
Cc1nc(C)c(C(=O)N/N=C/c2ccc(O)cc2O)cc1C(=O)N/N=C/c1ccc(O)cc1O,C03188152_decoy,TRY1,Decoy,0,-10.6096,-6.63,-2.41,-7.799910984293268
Cc1c(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)oc2c1/C(=N/NC(N)=S)CC(C)(C)C2,C39856203_decoy,TRY1,Decoy,0,-8.73978,-7.73,-3.51,-6.731723130399035
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3ccc(Br)cc3F)c2N)cc1,C40794672_decoy,TRY1,Decoy,0,-8.4479,-8.43,-2.23,-6.084343163017854
COC(=O)C1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCC4)n2)CC1,C41302041_decoy,TRY1,Decoy,0,-8.32356,-7.29,-2.88,-7.297865028303968
COc1cc2ccc(=O)oc2cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C36645752_decoy,TRY1,Decoy,0,-6.43136,-8.42,-1.03,-8.175282741480705
Nn1c(SCC(=O)N/N=C/c2ccc(O)cc2O)nnc1-c1ccc(Br)cc1,C58987296_decoy,TRY1,Decoy,0,-7.75258,-6.48,-2.18,-5.845326754279267
NC(=O)C[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2O)[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]21,C15218516_decoy1,TRY1,Decoy,0,-5.4503,-5.7,,-4.797031880569057
C=C(NNC(=O)c1nnn(-c2nonc2N)c1-c1cccc([N+](=O)[O-])c1)c1ccc2ccccc2c1O,C15188295_decoy,TRY1,Decoy,0,-8.51063,-9.16,-2.25,-7.675887181286043
NC(=O)C[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2O)[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]21,C15218516_decoy2,TRY1,Decoy,0,-7.62211,-7.39,,-9.687803082817403
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1,C04534390_decoy,TRY1,Decoy,0,-11.0203,-8.07,-2.84,-8.433121900478382
c1cc2cc(-c3ccc4cc(-c5ccc6oc(C7=[NH+]CCN7)cc6c5)[nH]c4c3)[nH]c2cc1C1=[NH+]CCN1,C05554003_decoy,TRY1,Decoy,0,-10.2933,-7.94,-3.4,-6.044048264235063
Oc1ccc(/C=C/c2cc(O)cc3c2[C@H](c2cc(O)cc(O)c2)[C@H](c2ccc(O)c(O)c2)O3)cc1,C05618654_decoy,TRY1,Decoy,0,-9.32374,-7.88,-1.7,-6.583292544779149
Oc1ccc(/C=C/c2cc(O)cc3c2[C@H](c2cc(O)cc(O)c2)[C@@H](c2ccc(O)c(O)c2)O3)cc1,C05618656_decoy,TRY1,Decoy,0,-10.5837,-8.04,-1.41,-8.332699309991941
Oc1cc(O)cc([C@@H]2c3c(/C=C/c4ccc(O)c(O)c4)cc(O)cc3O[C@@H]2c2ccc(O)c(O)c2)c1,C05758830_decoy,TRY1,Decoy,0,-10.4294,-8.11,-3.12,-6.965344389580952
C[NH+]1CCN(c2ccc(S(=O)(=O)c3ccc(N4CC[NH+](C)CC4)c(N)c3)cc2N)CC1,C01727701_decoy,TRY1,Decoy,0,-8.50436,-6.25,-2.85,-5.592274897201464
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C08632665_decoy,TRY1,Decoy,0,-10.0994,-7.01,-2.78,-7.243069766066576
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@@]12C,C08656128_decoy,TRY1,Decoy,0,-10.197,-7.63,-2.26,-6.206357567908811
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@]12C,C09065225_decoy,TRY1,Decoy,0,-9.48751,-7.89,-2.81,-6.992863651067742
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C12653551_decoy,TRY1,Decoy,0,-11.2081,-6.83,-1.93,-6.0077169498273895
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C12869819_decoy,TRY1,Decoy,0,-10.0774,-8.49,-1.67,-6.49916226524089
Cc1cc(Nc2ccc(O)c(C[NH+]3CCCC3)c2)cc(Nc2ccc(O)c(C[NH+]3CCCC3)c2)n1,C05614943_decoy,TRY1,Decoy,0,-9.50122,-6.57,-3.1,-5.811186120418998
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C13298457_decoy,TRY1,Decoy,0,-9.99667,-6.55,-1.93,-5.774676302873959
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C14984557_decoy,TRY1,Decoy,0,-10.7208,-6.62,-2.45,-5.9450027946087705
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C17147380_decoy,TRY1,Decoy,0,-10.1524,-6.62,-1.71,-6.1071169480286365
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C26690424_decoy,TRY1,Decoy,0,-9.06923,-8.37,-2.39,-6.233328944191085
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C35363822_decoy,TRY1,Decoy,0,-10.5584,-7.02,-2.22,-6.614122397517344
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C35493966_decoy,TRY1,Decoy,0,-10.0645,-7.06,-1.99,-6.6728877923276375
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1,C03978503_decoy,TRY1,Decoy,0,-10.9697,-9.09,-1.11,-8.99465123676613
CC(C)(O)C[C@@H](O)C[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C35456690_decoy,TRY1,Decoy,0,-9.08672,-7.69,-2.48,-5.792941724901201
CC(C)(O)C[C@@H](O)C[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C35456686_decoy,TRY1,Decoy,0,-10.1565,-7.36,-3.04,-7.426031674068785
CC(C)(O)C[C@@H](O)C[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@@]12C,C35456678_decoy,TRY1,Decoy,0,-9.81524,-7.45,-2.4,-5.899675536528076
CC(C)(O)C[C@@H](O)C[C@@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C35456682_decoy,TRY1,Decoy,0,-10.233,-7.56,-1.05,-6.279609350813213
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C03946345_decoy,TRY1,Decoy,0,-8.71878,-6.28,-3.04,-5.768677074350554
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1,C03870413_decoy,TRY1,Decoy,0,-10.4712,-8.43,-2.59,-8.249997802232102
Cc1ccccc1N1N[NH2+]N[C@H]1[C@H](NCCc1c(C)[nH]c2ccccc12)c1ccc(Cl)cc1Cl,C39211545_decoy,TRY1,Decoy,0,-7.32089,-6.78,-1.73,-5.515957260059791
Cc1ccccc1N1N[NH2+]N[C@@H]1[C@H](NCCc1c(C)[nH]c2ccccc12)c1ccc(Cl)cc1Cl,C39211546_decoy,TRY1,Decoy,0,-8.63478,-6.11,-3.04,-5.960271847989241
Oc1ccccc1NC[C@H](c1ccc(Cc2ccccc2)cc1)[NH+]1CC[NH2+][C@H](c2ccccc2O)C1,C39531016_decoy,TRY1,Decoy,0,-10.3606,-8.62,-1.2,-9.406805576966592
Oc1ccccc1NC[C@H](c1ccc(-c2ccccc2)cc1)[NH+]1CC[NH2+][C@H](c2ccccc2O)C1,C39533642_decoy,TRY1,Decoy,0,-8.66199,-6.77,-1.3,-5.428826518204702
Oc1ccccc1NC[C@@H](c1ccc(-c2ccccc2)cc1)[NH+]1CC[NH2+][C@H](c2ccccc2O)C1,C39533643_decoy,TRY1,Decoy,0,-8.56595,-6.8,-3.04,-7.855220266779634
Oc1ccccc1NC[C@@H](c1ccc(-c2ccccc2O)cc1)[NH+]1CC[NH2+][C@@H](Cc2ccccc2)C1,C39533936_decoy,TRY1,Decoy,0,-9.22201,-7.52,-0.91,-7.1953206182727065
Cc1cc([C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1[nH+]cnc(NNc2ccccc2)c1N,C40688692_decoy,TRY1,Decoy,0,-8.74837,-7.59,-2.26,-6.536852142834822
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C43721950_decoy,TRY1,Decoy,0,-10.1798,-8.24,-1.53,-6.592057161949259
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C43735716_decoy,TRY1,Decoy,0,-11.0378,-6.98,-2.87,-6.730413441680232
CC(C)(O)CC[C@H](O)[C@@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C,C43743095_decoy,TRY1,Decoy,0,-9.5871,-8.22,-3.03,-5.855379268146163
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@@]12C,C09214623_decoy,TRY1,Decoy,0,-10.3356,-6.13,-2.64,-5.914395233491892
NC(=[NH2+])Nc1ccc2c3c([nH]c2c1)[C@@H]1Oc2c(O)ccc4c2[C@]12CC[NH+](CC1CC1)[C@@H](C4)[C@@]2(O)C3,C44672344_decoy,TRY1,Decoy,0,-10.3173,-7.86,-0.92,-7.646004117654763
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@H]4C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C44689746_decoy,TRY1,Decoy,0,-10.9791,-7.73,-1.76,-6.745683847550394
CC(C)(C)CN1c2[nH+]c(-c3nc(-c4c(F)cccc4F)[nH]c3-c3ccccc3)ccc2N[C@@H]1[NH3+],C52637648_decoy,TRY1,Decoy,0,-8.43406,-7.32,-3.73,-6.484161999835317
CC(C)(C)CN1c2[nH+]c(-c3nc(-c4c(F)cccc4F)[nH]c3-c3ccccc3)ccc2N[C@H]1[NH3+],C52637650_decoy,TRY1,Decoy,0,-9.79741,-8.23,-3.41,-8.042584134847768
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@H](O)C[C@@]4(C)[C@H]3CC[C@]12C,C01280289_decoy,TRY1,Decoy,0,-10.2828,-7.36,-2.3,-6.186787567662143
NNC(=O)CCCNc1c(Br)cc(Br)c(N)c1Br,C59507321_decoy,TRY1,Decoy,0,-8.65287,-5.55,-1.59,-5.261123163499467
CCNc1cc2oc3c/c(=[NH+]\CC)c(C)cc-3c(-c3ccccc3C(=O)NCC[NH3+])c2cc1C,C43764013_decoy,TRY1,Decoy,0,-9.26663,-5.79,-1.35,-6.259537680115552
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C38281488_decoy,TRY1,Decoy,0,-9.70961,-8.59,-2.61,-6.2925389301248025
Cc1ccccc1N1N[NH2+]N[C@H]1[C@H](NCCC1=c2ccccc2=[NH+][C@@H]1C)c1ccc(Cl)cc1Cl,C63513979_decoy,TRY1,Decoy,0,-8.83274,-6.23,-2.06,-5.882461745481294
Cc1ccccc1N1N[NH2+]N[C@@H]1[C@H](NCCC1=c2ccccc2=[NH+][C@@H]1C)c1ccc(Cl)cc1Cl,C63513980_decoy,TRY1,Decoy,0,-10.0388,-6.14,-3.03,-5.982367531734695
COc1ccc(N2N[NH2+]N[C@H]2[C@@H](NCCC2=c3ccccc3=[NH+][C@@H]2C)c2ccc(Cl)cc2Cl)cc1,C63513985_decoy,TRY1,Decoy,0,-8.88502,-8.22,-2.25,-7.654327105500656
COc1ccc(N2N[NH2+]N[C@H]2[C@@H](NCCC2=c3ccccc3=[NH+][C@H]2C)c2ccc(Cl)cc2Cl)cc1,C63513986_decoy,TRY1,Decoy,0,-8.92963,-7.44,-2.75,-6.763363497611443
COc1ccc(N2N[NH2+]N[C@H]2[C@H](NCCC2=c3ccccc3=[NH+][C@@H]2C)c2ccc(Cl)cc2Cl)cc1,C63513987_decoy,TRY1,Decoy,0,-8.81334,-0.23,-3.38,-1.377014571512711
CC(C)(O)CC[C@H](O)[C@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C,C66331617_decoy,TRY1,Decoy,0,-9.97711,-7.43,-1.59,-6.01209570899108
Cc1nc2sc([C@H](c3ccc(Br)cc3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04176400_decoy,TRY1,Decoy,0,-8.58495,-5.26,-1.47,-5.225893377376807
Cc1c(Cl)cccc1Nc1nc(N)nc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)n1,C04618662_decoy,TRY1,Decoy,0,-8.79985,-7.12,-1.19,-5.668635303280304
CCOc1cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](CC)C4)N2)cc(Br)c1O,C08928001_decoy,TRY1,Decoy,0,-10.5766,-6.0,-1.48,-6.279386642893083
CCOc1cc(Br)cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](CC)C4)N2)c1O,C08928024_decoy,TRY1,Decoy,0,-9.76073,-7.37,-2.77,-5.94967606909277
Cc1ccc(Nc2nc(NC3CC(C)(C)[NH2+]C(C)(C)C3)nc(N3CCOCC3)n2)cc1C,C12235201_decoy,TRY1,Decoy,0,-8.94426,-8.53,-2.1,-7.732283633631992
[NH3+]CCCNc1nc(F)c(Cl)c(N2c3ccccc3Sc3ccc(Cl)cc32)c1F,C01833530_decoy,TRY1,Decoy,0,-9.57247,-7.29,-1.13,-8.95396505534826
COc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(F)ccc2O3)cc1NC(C)=O,C19022148_decoy,TRY1,Decoy,0,-9.29348,-6.75,-1.86,-6.058174317588078
C=CCS[C@]1(Br)NC(C)(C)C[C@@]2(C[C@H](c3ccccc3)Oc3cc(O)ccc32)[NH2+]1,C19329515_decoy,TRY1,Decoy,0,-7.93083,-4.83,-1.0,-5.055945772920706
C=CCS[C@]1(Br)NC(C)(C)C[C@]2(C[C@H](c3ccccc3)Oc3cc(O)ccc32)[NH2+]1,C19329518_decoy,TRY1,Decoy,0,-8.03613,-4.98,-1.55,-4.560719060241696
C=CCS[C@]1(Br)NC(C)(C)C[C@@]2(C[C@@H](c3ccccc3)Oc3cc(O)ccc32)[NH2+]1,C19329520_decoy,TRY1,Decoy,0,-6.65449,-4.29,-3.89,-4.10872205805095
C=CCS[C@]1(Br)NC(C)(C)C[C@]2(C[C@@H](c3ccccc3)Oc3cc(O)ccc32)[NH2+]1,C19329523_decoy,TRY1,Decoy,0,-7.86529,-5.93,-1.64,-5.334235400488629
COc1cccc([C@@H]2C[C@H](c3cc(Br)ccc3O)N[C@H](c3ccc(Br)cc3)[NH2+]2)c1,C19330652_decoy,TRY1,Decoy,0,-10.4775,-7.15,-2.2,-8.491541515676007
COc1ccc2c([C@@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3cc(Cl)ccc3O4)c[nH]c2c1,C19563106_decoy,TRY1,Decoy,0,-9.47563,-6.09,-1.81,-5.42321616556272
COc1ccc2c(c1)OC1(CC[NH+](C[C@H](O)c3c(C)[nH]c4ccc(F)cc34)CC1)C[C@H]2O,C19581427_decoy,TRY1,Decoy,0,-7.84222,-7.14,-1.27,-4.882776812661613
Cc1ccc2nc(-c3ccc(NC(=S)NC4CC(C)(C)[NH2+]C(C)(C)C4)cc3)sc2c1,C03365886_decoy,TRY1,Decoy,0,-8.06829,-8.51,-1.56,-6.251547514549329
Cc1cccc([C@@H]2NC(SCC(=O)N3c4ccccc4CCc4ccccc43)=NC(N)=[NH+]2)c1,C39448832_decoy,TRY1,Decoy,0,-8.64087,-7.76,-4.02,-6.701860256896642
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(Cc4ccccc4)=C[C@H]3C[C@@H]2CO1,C39467040_decoy,TRY1,Decoy,0,-7.81666,-7.26,-1.79,-6.5060980727154165
Cc1ccc([C@@H](CNI)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39531573_decoy,TRY1,Decoy,0,-8.50047,-6.23,-2.93,-5.745412815598285
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)c(C)c1,C39631970_decoy,TRY1,Decoy,0,-7.81966,-7.01,-3.32,-6.785028534582569
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655793_decoy,TRY1,Decoy,0,-9.03866,-6.88,-2.85,-6.697000526890772
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)[C@H]4CC=CCC4)CC34CC[NH2+]CC4)c2c1,C39656139_decoy,TRY1,Decoy,0,-8.69307,-6.45,-1.72,-5.757560345618322
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](C(F)(F)F)O1,C39671553_decoy,TRY1,Decoy,0,-8.3736,-2.72,-2.34,-4.375834258270597
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1,C39684247_decoy,TRY1,Decoy,0,-8.48771,-8.68,-2.89,-6.674198446475131
CC[NH+]1CCC(NS(=O)(=O)c2c(Br)cc(N)cc2Br)CC1,C40347759_decoy,TRY1,Decoy,0,-8.27643,-5.4,-1.7,-4.73751808280008
CC1(C)CC(Nc2ncnc(Nc3cc(Cl)cc(Cl)c3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40588008_decoy,TRY1,Decoy,0,-8.53868,-5.54,-3.0,-5.27690939709149
CC1(C)CC(Nc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40591381_decoy,TRY1,Decoy,0,-8.35112,-5.71,-2.91,-5.122373907454755
CC1(C)CC(Nc2ncnc(Nc3cc(Cl)ccc3Cl)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40629954_decoy,TRY1,Decoy,0,-8.01253,-5.63,-1.62,-5.28030539580655
CC1(C)CC(Nc2ncnc(Nc3ccccc3Br)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645185_decoy,TRY1,Decoy,0,-7.70453,-5.3,-2.43,-4.818518087711654
CC1(C)CC(Nc2ncnc(Nc3ccc(Br)cc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645193_decoy,TRY1,Decoy,0,-8.00688,-5.78,-1.78,-5.107782999263466
CC1(C)CC(Nc2ncnc(Nc3cccc(Br)c3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645250_decoy,TRY1,Decoy,0,-7.56069,-5.7,-1.57,-5.345740427988078
CCN(c1nc[nH+]c(NN(c2ccccc2)c2ccccc2)c1N)c1cccc2ccccc12,C40701993_decoy,TRY1,Decoy,0,-8.28703,-6.43,-2.03,-7.103939292573687
CCN(c1nc[nH+]c(Nc2ccc(OC(F)(F)F)cc2)c1N)c1cccc2ccccc12,C40702141_decoy,TRY1,Decoy,0,-7.04746,-5.85,-3.58,-4.952261780877008
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/Nc1ccc(F)cc1)CCC2,C40823932_decoy,TRY1,Decoy,0,-9.09798,-7.18,-0.68,-5.860166283098407
CC1(C)[C@@H](O)CC[C@]2(C)[C@H]1CC[C@@]1(C)[C@H]2C=CC2=C3C[C@](C)(C(=O)OCC[NH3+])CC(=O)[C@@]3(C)CC[C@@]21C,C43735689_decoy,TRY1,Decoy,0,-10.4027,-7.82,-2.31,-9.837123544115112
CCCC/[NH+]=C/[C@@]12CC[C@H](O)C[C@@]1(O)CC[C@@H]1[C@H]2CC[C@@]2(C)[C@H]([C@@H]3C=CC(=O)O3)CC[C@]12O,C43736569_decoy,TRY1,Decoy,0,-8.53095,-4.95,-1.18,-5.410614597142269
Nc1cc(Br)c(S(=O)(=O)N[C@H]2CC[NH+](C3CC3)C2)c(Br)c1,C44686702_decoy,TRY1,Decoy,0,-8.22628,-5.32,-2.34,-4.781520240540043
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C44713611_decoy,TRY1,Decoy,0,-8.61342,-7.9,-1.52,-6.468374861402494
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C44713654_decoy,TRY1,Decoy,0,-7.23661,-6.42,-1.2,-6.071252743285345
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C44713721_decoy,TRY1,Decoy,0,-8.55196,-5.38,-3.12,-5.5614550748620415
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C44713875_decoy,TRY1,Decoy,0,-8.72283,-6.94,-1.2,-6.034350127627854
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1F,C44713897_decoy,TRY1,Decoy,0,-8.34498,-7.1,-2.54,-5.774554157029951
[NH3+]Cc1cn(CC(=O)Nc2c(Br)cc(Br)cc2Br)nn1,C50224228_decoy,TRY1,Decoy,0,-8.70099,-6.83,-3.79,-8.475924756913125
C[C@H]([NH2+]Cc1cc(Br)c(Br)o1)c1ccc(S(N)(=O)=O)cc1,C50359639_decoy,TRY1,Decoy,0,-9.51411,-5.16,-4.76,-5.416305060142817
[NH3+]CCc1ccc(CNS(=O)(=O)c2cc(Br)sc2Br)cc1,C52899198_decoy,TRY1,Decoy,0,-9.35857,-6.95,-1.69,-7.668737211089704
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(F)ccc4C)CC34CC[NH2+]CC4)[nH]c2c1,C44737398_decoy,TRY1,Decoy,0,-8.96667,-9.01,-1.71,-7.157526269044141
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1ccccc1[NH2+]C12CC3CC(CC(C3)C1)C2,C58152863_decoy,TRY1,Decoy,0,-7.92708,-6.77,-5.97,-5.313426838007916
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1ccccc1[NH2+]C12CC3CC(CC(C3)C1)C2,C58152869_decoy,TRY1,Decoy,0,-9.31062,-6.38,-2.15,-7.709539017455806
O=C(NCCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1cccc(Br)c1,C20588820_decoy,TRY1,Decoy,0,-9.02676,-7.67,-1.52,-6.268183888412211
[NH3+]Cc1ccccc1CNS(=O)(=O)c1cc(Br)sc1Br,C61841294_decoy,TRY1,Decoy,0,-10.1198,-6.38,-1.26,-8.252611847216887
O=C(NCCC1=c2ccccc2=[NH+]C1)C1=C2N[C@@H](NC(=O)c3ccc(F)cc3)S[C@H]2CC1,C63690793_decoy,TRY1,Decoy,0,-8.8787,-5.92,-1.32,-5.818103800301197
Cc1c(C(=O)OCC(C)C)sc2ncn(CC(=O)Nc3c(C)n(C)n(-c4ccccc4)c3=O)c(=O)c12,C01290499_decoy,TRY1,Decoy,0,-8.32378,-7.53,-2.45,-6.407689810783494
CCCN(Cc1nnc(-c2cccs2)o1)C(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O,C09584981_decoy,TRY1,Decoy,0,-8.53927,-8.41,-1.35,-7.225809714256198
CCOc1cc2[nH]c(=O)n(CC3CCC(C(=O)N4CCC5(CC4)OCCO5)CC3)c(=O)c2cc1OCC,C02952656_decoy,TRY1,Decoy,0,-8.74146,-6.54,-3.07,-6.952086966936914
N#Cc1cccc(NC(=O)C2CCN(c3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])CC2)c1,C09721689_decoy,TRY1,Decoy,0,-7.09355,-5.78,-2.28,-4.768113399735177
O=C(CSc1nnc(COc2ccc(Cl)cc2)n1Cc1ccco1)N[C@H]1CCS(=O)(=O)C1,C09820104_decoy,TRY1,Decoy,0,-8.57471,-8.21,-1.38,-7.984703090263266
C[C@@H](CSc1ccc(F)cc1)Cn1c(N2CCN(C(=O)c3ccco3)CC2)nc2c1c(=O)[nH]c(=O)n2C,C10249525_decoy,TRY1,Decoy,0,-9.51177,-6.93,-2.62,-7.173082643447474
COc1cc([C@@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C[C@H]4CCCO4)CC(=O)N23)cc(OC)c1OC,C02149910_decoy,TRY1,Decoy,0,-7.79718,-6.43,-1.82,-5.658177241024895
O=C(NCc1ccco1)[C@H](c1ccncc1)N(Cc1ccc(F)cc1)C(=O)Cn1nnc2ccccc21,C01376183_decoy,TRY1,Decoy,0,-8.24831,-6.69,-3.05,-6.3479407529387615
COc1cc(NS(=O)(=O)c2ccc(N3C(=O)C(C)(C)CS3(=O)=O)cc2C)cc(OC)c1OC,C13731778_decoy,TRY1,Decoy,0,-8.0082,-6.5,-2.85,-5.1999466882218925
CCOC(=O)Cc1csc(NC(=O)C[C@@H]2CSc3nc4c(cnn4-c4ccc(F)cc4)c(=O)n32)n1,C14012773_decoy,TRY1,Decoy,0,-9.68807,-7.68,-3.27,-7.149105473891322
COc1ccccc1N1CCN([C@H](c2cc3cccc(C)c3[nH]c2=O)c2nnnn2C[C@@H]2CCCO2)CC1,C19826406_decoy,TRY1,Decoy,0,-8.695,-6.36,-2.65,-6.578915553895906
COc1ccccc1N1CCN([C@H](c2cc3ccc(C)cc3[nH]c2=O)c2nnnn2C[C@@H]2CCCO2)CC1,C19940598_decoy,TRY1,Decoy,0,-9.66036,-6.32,-1.71,-6.98990678000996
CCc1ccc2[nH]c(=O)c([C@@H](c3nnnn3CCOC)N3CCN(c4ccccc4OC)CC3)cc2c1,C19972953_decoy,TRY1,Decoy,0,-8.76837,-5.64,-2.49,-5.760231241326653
COCCn1nnnc1[C@@H](c1cc2cc(OC)ccc2[nH]c1=O)N1CCN(c2cccc(C)c2C)CC1,C19973250_decoy,TRY1,Decoy,0,-9.61548,-7.43,-3.85,-6.80370187698468
COc1ccc(N2C[C@@H](C(=O)Nc3nnc([C@@H]4CC(=O)N(c5ccc(C)c(C)c5)C4)s3)CC2=O)cc1,C20584173_decoy,TRY1,Decoy,0,-9.72836,-10.17,-1.82,-8.124984879360516
Cc1ccc(S(=O)(=O)/N=C(\[O-])N(c2ccc3c(c2)CCN3S(C)(=O)=O)C2CC[NH+](C)CC2)cc1,C25337841_decoy,TRY1,Decoy,0,-8.7463,-6.68,-1.91,-5.929872015005097
Cc1ccc(CN2C(=O)/C(=C\c3c(N4CCN(CCO)CC4)nc4ccccn4c3=O)SC2=S)cc1,C33350049_decoy,TRY1,Decoy,0,-10.3116,-6.45,-1.16,-6.288766048620533
C=CCN1C(=O)N[C@H](c2cccc(Cl)c2)C2=C1CN(CC(=O)N1CCN(C(=O)c3ccco3)CC1)C2=O,C34792418_decoy,TRY1,Decoy,0,-8.85918,-8.17,-1.37,-6.750219228877848
Cc1cccn2c(C)c(C(=O)C3=C([O-])C(=O)N(CCCn4cc[nH+]c4)[C@@H]3c3cccc([N+](=O)[O-])c3)nc12,C35484705_decoy,TRY1,Decoy,0,-7.23798,-7.06,-2.47,-6.426972075609597
COc1cc2cc([C@H](c3nnnn3C(C)(C)C)N3CCN(c4ccccc4)CC3)c(=O)[nH]c2cc1OC,C20084137_decoy,TRY1,Decoy,0,-8.24539,-7.86,-1.53,-6.119820415886592
COc1cc2cc([C@@H](c3nnnn3C(C)(C)C)N3CCN(c4ccccc4)CC3)c(=O)[nH]c2cc1OC,C20084141_decoy,TRY1,Decoy,0,-8.9042,-7.85,-2.36,-6.218974503614454
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc([N+](=O)[O-])cc2)N(Cc2ccco2)C(=O)CCl)cc1,C36503433_decoy,TRY1,Decoy,0,-7.96032,-7.55,-4.15,-8.097432407158218
COCC(=O)N(Cc1ccco1)Cc1cc(Cl)ccc1OS(=O)(=O)c1ccc(NC(C)=O)cc1,C37423204_decoy,TRY1,Decoy,0,-8.83431,-6.29,-2.21,-6.431082941083624
CC(=O)N1CCN(C(=O)CCN(Cc2ccco2)C(=O)c2csc(Nc3ccccc3F)n2)CC1,C37426192_decoy,TRY1,Decoy,0,-9.08317,-7.93,-4.07,-7.828535059053902
O=C(NCc1ccco1)[C@@H](c1ccccc1F)N(Cc1cccnc1)C(=O)Cn1nnc2ccccc21,C01376226_decoy,TRY1,Decoy,0,-8.4772,-6.58,-1.9,-6.728700694763362
Cc1ccc(-c2nnn(CC(=O)N(C[C@@H]3CCCO3)[C@@H](C(=O)NC(C)(C)C)c3ccc(F)cc3)n2)o1,C04388879_decoy,TRY1,Decoy,0,-8.109,-8.63,-2.55,-7.947154038364935
CCCCn1c(N2CC[NH+](CC)CC2)c(/C=C2/SC(=S)N(CCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33812682_decoy,TRY1,Decoy,0,-6.63769,-6.1,-3.07,-5.130901912373608
Cc1ccc(-c2nnn(CC(=O)N(Cc3ccc(F)cc3)[C@@H](C(=O)NC3CCCC3)c3ccncc3)n2)o1,C06281197_decoy,TRY1,Decoy,0,-8.62059,-8.2,-3.46,-8.002730799021935
CCOC(=O)c1c(C)[nH]c(C(=O)C(=O)N2CCN(c3ncccc3C#N)CC2)c1-c1ccc(OC)cc1,C38790426_decoy,TRY1,Decoy,0,-7.99165,-7.65,-1.68,-7.034194165382221
O=C(CCCN1C(=O)c2ccccc2C1=O)Oc1ccc2cc(C(=O)NC[C@H]3CCCO3)c(=O)oc2c1,C40897554_decoy,TRY1,Decoy,0,-8.66479,-8.26,-1.69,-8.266232681719284
O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)c1nn([C@H]2CCS(=O)(=O)C2)c2c1CCCC2,C40988498_decoy,TRY1,Decoy,0,-9.40392,-7.58,-2.85,-7.742750102769273
C[C@H](SCCCn1c(=O)c2c(ncn2C)n(C)c1=O)c1nc2scc(-c3ccco3)c2c(=O)[nH]1,C46587077_decoy,TRY1,Decoy,0,-9.50313,-7.13,-2.25,-5.985930616202896
COc1ccc(CN(Cc2cc3cc4c(cc3[nH]c2=O)OCCO4)Cc2nnnn2CCc2ccccc2)cc1,C01373986_decoy,TRY1,Decoy,0,-9.17858,-7.49,-1.44,-6.401637485765998
[H]/N=C1C(=C\c2cn(CCOc3ccccc3C)c3ccccc23)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206511_decoy,TRY1,Decoy,0,-8.47949,-6.38,-1.16,-5.74703319227371
[H]/N=C1C(=C/c2ccc(OS(=O)(=O)c3ccc(C)cc3)c(OC)c2)/C(=O)N=C2SC(CCC)=NN2/1,C08453078_decoy,TRY1,Decoy,0,-8.52252,-7.87,-4.21,-5.377623514773407
COc1ccc(-c2cc(C(=O)NCCCOC(C)C)c3c(C)nn([C@H]4CCS(=O)(=O)C4)c3n2)cc1,C57309697_decoy,TRY1,Decoy,0,-9.17901,-6.07,-1.84,-6.773254128236562
CC[C@@H](c1nnnn1C1CCCCC1)N(Cc1cccnc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C57641261_decoy,TRY1,Decoy,0,-8.85191,-7.03,-1.55,-6.915081945395378
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(C)cc3C)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077755_decoy,TRY1,Decoy,0,-8.54151,-7.54,-2.76,-5.919068215827604
[H]/N=C1C(=C\c2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OCC)c2)\C(=O)N=C2SN=C(SC)N2\1,C20205530_decoy,TRY1,Decoy,0,-7.61856,-6.75,-3.95,-5.6338586291616615
[H]/N=C1C(=C/c2cc(Cl)c(OC(=O)c3ccc(OC)c(OC)c3)c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C41078418_decoy,TRY1,Decoy,0,-7.48183,-6.45,-2.91,-5.585891426520152
CC1=C2C(=C(NC(=O)CSc3nc4ccccc4c(=O)n3CCCOC(C)C)O[C@@H]2C)C(=O)N=N1,C39782139_decoy,TRY1,Decoy,0,-9.01088,-7.5,-2.46,-7.225032822354807
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(C)cc3)cc2)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206459_decoy,TRY1,Decoy,0,-9.05133,-7.48,-2.37,-6.138839214082728
[H]/N=C1C(=C\c2ccc(O[C@@H](C)c3ccccc3)c(OCC)c2)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206479_decoy,TRY1,Decoy,0,-7.6067,-5.68,-2.51,-5.459588168279199
[H]/N=C1C(=C\c2cc(Cl)c(OCc3ccccc3)c(OCC)c2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20207642_decoy,TRY1,Decoy,0,-8.93001,-7.78,-2.12,-5.917524567474819
[H]/N=C1C(=C\c2ccc(OCCOc3c(C)cccc3C)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20207719_decoy,TRY1,Decoy,0,-8.30772,-7.95,-2.99,-5.5716093468463175
[H]/N=C1C(=C\c2ccc(OCCCOc3cccc(C)c3)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20207805_decoy,TRY1,Decoy,0,-8.15255,-7.52,-2.46,-5.5138657287208686
[H]/N=C1C(=C\c2cc(Br)c(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C20236343_decoy,TRY1,Decoy,0,-7.74312,-7.13,-2.44,-4.984676406326767
[H]/N=C1C(=C\c2cc(Br)c(OCc3ccccc3[N+](=O)[O-])c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C20236875_decoy,TRY1,Decoy,0,-6.27729,-6.17,-2.63,-4.7494696233687215
CC(=O)N1CCc2c(sc3nc(SCC(=O)NCc4ccco4)n(-c4ccc(C)cc4)c(=O)c23)C1,C35432047_decoy,TRY1,Decoy,0,-8.51924,-8.73,-2.68,-7.829349779411818
COc1cc(OC)c(N2/C(=N\C(=O)CNC(=O)OC(C)(C)C)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1Cl,C32505934_decoy,TRY1,Decoy,0,-8.38461,-7.07,-4.03,-6.804181991140309
CCOC(=O)C1=C(N)N2C(=O)[C@@H](C)SC2=C(C(=O)OC)[C@H]1c1cc(OC)c(OC)c(OC)c1,C02492181_decoy,TRY1,Decoy,0,-6.46142,-6.3,-3.83,-7.0486428405361785
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC(=O)c2cc(C)n(CC(F)(F)F)c2C)cc1,C03448626_decoy,TRY1,Decoy,0,-8.37956,-6.67,-2.36,-5.821316473261575
CCCCc1nc(SCC(=O)Nc2cccc(NC(C)=O)c2)c2c(=O)n(C)c(=O)n(C)c2n1,C08894309_decoy,TRY1,Decoy,0,-9.4792,-7.43,-4.41,-7.339939136011859
CN(C)c1ccc([C@H](CNC(=O)C(=O)NC[C@@H]2CCCO2)S(=O)(=O)c2cccs2)cc1,C09079662_decoy,TRY1,Decoy,0,-9.45521,-6.68,-2.63,-8.018657476122101
COCCCNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1,C09080644_decoy,TRY1,Decoy,0,-9.82613,-6.95,-1.64,-8.3981780485722
COc1cc(C(=O)Nc2nnc(SCC(=O)Nc3nccs3)s2)cc(OC)c1OC,C09366172_decoy,TRY1,Decoy,0,-8.99464,-7.94,-1.83,-6.593641905611849
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)[C@H]1Cc2ccccc2CN1S(C)(=O)=O,C09441955_decoy,TRY1,Decoy,0,-8.34446,-7.03,-4.02,-6.3359141155922805
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc2[nH]cc(C(=O)NC[C@@H]3CCCO3)c(=O)c2c1,C09490580_decoy,TRY1,Decoy,0,-8.37484,-5.86,-2.94,-4.736566360913816
Cc1cc(NC(=O)CSc2nnc(NC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)s2)no1,C09517970_decoy,TRY1,Decoy,0,-9.37714,-8.21,-2.75,-7.201562650513202
CCN1C(=O)C(=CNc2ccc(S(=O)(=O)Nc3onc(C)c3C)cc2)C(=O)N(CC)C1=S,C09634094_decoy,TRY1,Decoy,0,-7.81758,-6.06,-4.01,-5.624645861416568
COCCOC(=O)C[C@H]1C(=O)NCCN1C(=S)NC(=O)c1cc(Br)ccc1OC,C09696064_decoy,TRY1,Decoy,0,-9.16706,-5.32,-1.66,-5.975059467570639
CC[C@@H](C)OC(=O)C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1,C09783401_decoy,TRY1,Decoy,0,-8.4443,-5.93,-4.47,-5.608397605850714
CC[C@H](C)OC(=O)C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1,C09783402_decoy,TRY1,Decoy,0,-8.15807,-5.96,-4.05,-5.835565751384105
CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1,C10701362_decoy,TRY1,Decoy,0,-8.84299,-6.78,-1.46,-5.896232281718675
N#CCCNC(=O)COC(=O)CNS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C11306778_decoy,TRY1,Decoy,0,-9.70409,-6.23,-3.04,-7.158362079374589
COc1ccc(F)c(C[C@]2(CCC(=O)N(Cc3cccnc3)C[C@@H]3CCC(=O)N3)CCC(=O)N2)c1,C11965826_decoy,TRY1,Decoy,0,-8.33656,-7.82,-2.73,-6.615122780448267
CCn1c(-c2ccccc2F)nc2cc(NC(C)=O)cc(C(=O)N3CCNC(=O)[C@@H]3CC(=O)OC)c21,C12078552_decoy,TRY1,Decoy,0,-7.18779,-7.59,-2.82,-6.137460369970556
Cc1nc(C(=O)OCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)nn1-c1ccc(F)cc1,C16398484_decoy,TRY1,Decoy,0,-9.26235,-7.93,-1.57,-9.846715363731962
C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O,C17262146_decoy,TRY1,Decoy,0,-8.71468,-8.55,-2.76,-7.167442487290455
CCOc1ccc2[nH]c(=O)c(CN(CCN3CCOCC3)C(=S)NC[C@H]3CCCO3)cc2c1,C19824468_decoy,TRY1,Decoy,0,-10.5139,-5.65,-3.33,-5.9906667631493375
CCCn1nc(C(=O)NNC(=O)c2ccccc2SCC(=O)N(C)C)c2ccccc2c1=O,C17163240_decoy,TRY1,Decoy,0,-7.3533,-7.48,-3.19,-5.899683787143673
CCOCCCN1C(=O)c2c(NC(C)=O)c3cc(F)ccc3n2C[C@@]1(C)C(=O)NC1CCCC1,C21866383_decoy,TRY1,Decoy,0,-6.61703,-6.81,-3.52,-5.611618817695498
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1,C21974965_decoy,TRY1,Decoy,0,-9.31623,-7.1,-2.92,-9.347283224738222
CC(=O)c1ccc(N2CCN(C(=O)CSc3nnc(SCC(N)=O)s3)CC2)c(F)c1,C22068566_decoy,TRY1,Decoy,0,-10.7122,-8.25,-1.49,-7.396324577023659
CC(C)CN(C(=O)CSc1nnc(COc2ccccc2F)n1N)[C@@H]1CCS(=O)(=O)C1,C22085284_decoy,TRY1,Decoy,0,-8.3399,-6.72,-2.68,-6.527569390346351
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N3CCC(C(N)=O)CC3)c2C)cc1,C22668348_decoy,TRY1,Decoy,0,-8.65551,-7.96,-2.34,-6.356829018857295
Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@H](C)OC(=O)C[C@H]1Oc2ccccc2NC1=O,C24091472_decoy,TRY1,Decoy,0,-7.21369,-7.62,-2.4,-5.948478176163722
CC[C@@H](C)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccccc2OC)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C33580180_decoy,TRY1,Decoy,0,-6.50762,-5.08,-2.42,-4.952256821135392
COc1cc([C@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(C=O)Cc2ccco2)ccc1O,C36499575_decoy,TRY1,Decoy,0,-8.81625,-8.05,-1.92,-9.741608177394706
COCC(=O)N(Cc1ccco1)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1cccc(O)c1,C36505317_decoy,TRY1,Decoy,0,-8.71631,-8.03,-3.42,-8.682785862047858
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc3c(c2)OCO3)N(C(=O)CO)C(C)(C)C)cc1,C36590753_decoy,TRY1,Decoy,0,-7.80472,-6.7,-5.43,-5.894349846814758
CC(C)[C@H](C(=O)NC[C@H]1CCCO1)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccc(F)cc1,C04388438_decoy,TRY1,Decoy,0,-7.69124,-7.51,-3.94,-6.918114546817222
CC(C)[C@H](C(=O)NC[C@@H]1CCCO1)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccc(F)cc1,C04388436_decoy,TRY1,Decoy,0,-8.32063,-6.44,-3.36,-7.038429335638892
COc1ccc(NC(=S)N/N=C2/C(=O)N(C)c3ccc(S(=O)(=O)N4CCOCC4)cc32)cc1,C03037165_decoy,TRY1,Decoy,0,-8.33929,-5.92,-0.97,-5.194950397568505
COc1cc(OCCN2CCOCC2)ccc1[C@H]1C(C#N)=C(N)OC2=NC(C(F)(F)F)=N[C@@H]21,C39167681_decoy,TRY1,Decoy,0,-7.95532,-7.83,-2.39,-7.463342545212793
CC(C)S(=O)(=O)c1c(-c2ccccc2O)ccc([C@@H](CC=O)NC=O)c1S(=O)(=O)C(C)C,C39498874_decoy,TRY1,Decoy,0,-5.52985,-5.1,-1.95,-4.571042158645342
COc1ccc(Br)cc1C(=O)CCC(=O)OCC(=O)NC(=O)NCc1ccco1,C39514795_decoy,TRY1,Decoy,0,-8.72142,-5.84,-3.01,-6.037876881665574
CCONC[C@H](c1ccc(S(=O)(=O)C(C)C)cc1)N1CCN[C@H](S(=O)(=O)c2ccccc2)C1,C39540245_decoy,TRY1,Decoy,0,-8.63953,-6.25,-3.26,-6.032577487605417
CC(=O)Nc1ccc(S(=O)(=O)NCCS(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)cc1,C36647055_decoy,TRY1,Decoy,0,-9.61745,-8.18,-2.77,-7.188993517606675
CC1(C)[C@]2(C(=O)NCCCCNC(=O)[C@]34CC[C@](C)(C(=O)C3=O)C4(C)C)CC[C@@]1(C)C(=O)C2=O,C33514254_decoy,TRY1,Decoy,0,-7.50695,-5.96,-2.94,-6.45339464140881
Cc1cc(C)cc(OCc2nnc(SCC(=O)N(C3CC3)[C@@H]3CCS(=O)(=O)C3)n2N)c1,C24272221_decoy,TRY1,Decoy,0,-8.69218,-7.01,-1.16,-6.389718092179571
C[C@@]1(NC(=S)OCCCCOC(=S)N[C@]2(C)CCS(=O)(=O)C2)CCS(=O)(=O)C1,C40167396_decoy,TRY1,Decoy,0,-10.0515,-4.42,-3.02,-7.401423950082226
O=S1(=O)C[C@@H]2NC(=S)N(CCCCCCN3C(=S)N[C@H]4CS(=O)(=O)C[C@H]43)[C@@H]2C1,C40167884_decoy,TRY1,Decoy,0,-9.88369,-6.17,-1.41,-6.839153513372547
CN(Cc1cc2c(=O)c(C(=O)NCc3ccc(F)c(F)c3)cn(C)c2o1)C[C@@H](O)c1ccco1,C40934166_decoy,TRY1,Decoy,0,-7.72378,-9.07,-2.48,-7.334098640005601
Cc1nc(-c2ccc(N(C)C)cc2)cc([C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=O)CSCC(=O)[O-])n1,C43528059_decoy,TRY1,Decoy,0,-9.89767,-5.84,-1.56,-5.626933119638151
Cc1nn(C)c(C)c1CCC(=O)OCC(=O)c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C,C45651020_decoy,TRY1,Decoy,0,-8.91272,-5.95,-1.74,-5.525780100734052
COc1ccc([C@@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)NCc4cnn(C)c4C)c3N2)cc1OC,C00647359_decoy,TRY1,Decoy,0,-8.37497,-7.69,-4.02,-6.96588675679992
COc1ccc(N2CCN([C@@H](CNC(=O)C(=O)NCCCN3CCCC3=O)c3ccco3)CC2)cc1,C56946229_decoy,TRY1,Decoy,0,-9.51464,-6.98,-2.09,-6.350194286360143
CCN(CC(=O)Nc1ccc2c(c1)OCCCO2)Cc1nc(=O)c2cc(OC)c(OC)cc2[nH]1,C58160441_decoy,TRY1,Decoy,0,-8.52781,-8.09,-1.78,-6.95138639807809
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(NC(C)=O)cc3)c(OC)c2)/C(=O)N=C2SC(C(C)C)=NN2/1,C12471015_decoy,TRY1,Decoy,0,-8.71247,-8.49,-2.59,-8.025251488543441
COc1ccc([C@H](CC(=O)[O-])Cc2cc(OCCc3ccc4c([nH+]3)NCCC4)n(C)n2)cn1,C03962007_decoy,TRY1,Decoy,0,-9.75189,-6.43,-1.2,-5.989101944191407
Cc1cc(C(=O)CN2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C2=O)c(C)n1[C@@H]1CCS(=O)(=O)C1,C08755671_decoy,TRY1,Decoy,0,-7.95097,-7.81,-2.55,-5.510962082945399
Cc1cc(NS(C)(=O)=O)c([C@H](C(=O)OC(C)C)C(=O)C(F)(F)F)cc1NS(C)(=O)=O,C08870477_decoy,TRY1,Decoy,0,-7.54042,-4.7,-2.77,-5.075317695584498
Cc1ccc([C@H](CNS(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2O)S(=O)(=O)c2cccs2)cc1,C08967975_decoy,TRY1,Decoy,0,-8.79518,-7.95,-2.19,-8.08184288488147
Cc1cccc(CNC(=O)C(=O)NC[C@@H](c2cccnc2)S(=O)(=O)c2ccc3c(c2)OCCO3)c1,C09045024_decoy,TRY1,Decoy,0,-8.53735,-8.31,-2.21,-6.43859396441317
CCn1cc(C(=O)NCCC(=O)Nc2ccc3c(c2)OCO3)c(=O)c2cc3c(cc21)OCO3,C09059498_decoy,TRY1,Decoy,0,-8.44251,-5.8,-2.6,-5.181260466431797
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCc2cccnc2)S(=O)(=O)c2ccc(F)cc2)cc1,C09080701_decoy,TRY1,Decoy,0,-9.19956,-7.76,-3.76,-8.222591274143538
COCCN1C(=O)/C(=C/Nc2c(C#N)c(C)c(C)n2-c2ccc(OC)cc2)C(=O)NC1=S,C09127002_decoy,TRY1,Decoy,0,-7.87277,-7.17,-2.18,-5.688198662116943
C[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)OCC(=O)Nc1c(C#N)oc2ccccc12,C09283727_decoy,TRY1,Decoy,0,-8.17825,-8.64,-1.58,-7.579756644273999
O=C(Cc1csc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)n1)NCc1ccncc1,C09700061_decoy,TRY1,Decoy,0,-9.45113,-8.57,-3.43,-6.80711241451531
O=C(Cc1csc(NC(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)n1)NCc1cccnc1,C09700925_decoy,TRY1,Decoy,0,-9.93902,-8.78,-1.79,-6.839810865963724
CSCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NCCc1ccc2c(c1)OCCO2,C09729233_decoy,TRY1,Decoy,0,-9.81341,-8.06,-2.21,-9.091252424304066
Cc1ccc(C(=O)NCCCN2CCCC2=O)cc1NC1=N[C@H]2CS(=O)(=O)C[C@H]2S1,C09860636_decoy,TRY1,Decoy,0,-9.41599,-7.11,-4.24,-6.001696278470328
CCOc1ccc(NC(SCC(=O)NCc2ccco2)=C2C(=O)N(C)C(=O)N(C)C2=O)cc1,C09974244_decoy,TRY1,Decoy,0,-8.57029,-8.03,-1.62,-7.293574132879833
COc1ccccc1CNC(=O)C(=O)Nc1c2c(nn1-c1ccc(F)cc1)CS(=O)(=O)C2,C10219811_decoy,TRY1,Decoy,0,-8.41731,-8.55,-1.48,-8.472269582605323
Cc1cccc(-n2nc3c(c2NC(=O)C(=O)NCCCN2CCCC2=O)CS(=O)(=O)C3)c1,C10250562_decoy,TRY1,Decoy,0,-9.0269,-8.33,-1.77,-7.595810439884015
CC(C)Cn1c(N)c(C(=O)COC(=O)C2CCN(/C=C/C(=O)C(F)(F)F)CC2)c(=O)n(C)c1=O,C11345592_decoy,TRY1,Decoy,0,-8.45374,-7.61,-2.9,-6.936332238620451
COCCn1c(SCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)nc2cc(Cl)ccc2c1=O,C03359179_decoy,TRY1,Decoy,0,-8.61192,-7.65,-1.3,-7.632898166689309
Cc1nc2ncnn2c(C)c1CCC(=O)OCC(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C12684087_decoy,TRY1,Decoy,0,-9.43423,-8.56,-2.69,-7.477476584584123
CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c1,C12811126_decoy,TRY1,Decoy,0,-8.50606,-6.56,-1.97,-5.9598047025695
COc1ccc2[nH]c(=O)c(CN(CCCO)S(=O)(=O)c3ccc4c(c3)OCCO4)cc2c1,C06282514_decoy,TRY1,Decoy,0,-9.11193,-7.29,-2.37,-6.386078367877618
O=C(COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc2c(c1)OCCO2)Nc1cc(F)ccc1F,C14361495_decoy,TRY1,Decoy,0,-9.5412,-7.92,-1.7,-7.122505270077568
COCCOC(=O)C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1ccc(C)c(Br)c1,C14640205_decoy,TRY1,Decoy,0,-8.12885,-6.74,-2.56,-6.172964087825548
O=C(NCc1ccc2c(c1)OCO2)C(=O)NC[C@@H](c1ccco1)S(=O)(=O)c1ccc(F)cc1,C17169750_decoy,TRY1,Decoy,0,-8.73494,-8.2,-3.36,-8.629159472298292
Cn1c([O-])c(C(=O)C[C@H]([NH2+]Cc2ccncc2)c2ccc3c(c2)OCO3)c(=O)c2ccccc21,C19202892_decoy,TRY1,Decoy,0,-7.97849,-6.86,-3.23,-5.404679042102261
O=C(NCCN1CCOCC1)C(=O)NC[C@H](c1ccco1)S(=O)(=O)c1ccc(Cl)cc1,C20614950_decoy,TRY1,Decoy,0,-8.62363,-7.19,-2.6,-7.670719989993659
CCN1C(=O)c2cc(C(=O)NCCCN3CCCC3=O)nn2C[C@@]1(C)C(=O)NC1CCCC1,C21531002_decoy,TRY1,Decoy,0,-9.03736,-7.16,-3.99,-6.388170787211492
CCCN1C(=O)c2c(C(=O)NCCN3CCOCC3)ncn2C[C@@]1(C)C(=O)NCCC(C)C,C21919278_decoy,TRY1,Decoy,0,-8.40619,-5.83,-4.36,-5.9235283753227375
C=CCn1c(SCCOc2ccc(S(N)(=O)=O)cc2)nnc1[C@H]1CCS(=O)(=O)C1,C24712400_decoy,TRY1,Decoy,0,-9.18301,-4.59,-2.45,-5.737251926677256
CC(=O)N[C@@H](C)c1ccc(C(=O)CSc2nc(C3CC3)nc3c2c(=O)[nH]c(=O)n3C2CC2)cc1,C25149964_decoy,TRY1,Decoy,0,-8.83172,-7.64,-2.71,-7.681188759387769
CNS(=O)(=O)c1cc(NC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)ccc1C,C25442840_decoy,TRY1,Decoy,0,-8.74842,-7.28,-2.88,-5.939771000612073
O=C([C@H](O)CO)N1CC=C(c2c(F)cc(N3C[C@H](COc4ccon4)OC3=O)cc2F)CC1,C27416055_decoy,TRY1,Decoy,0,-8.17066,-6.95,-1.26,-6.642392710081157
C[C@@H](OC(=O)[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NC(C)(C)C,C32774538_decoy,TRY1,Decoy,0,-8.49511,-7.33,-2.28,-6.831477751340043
CC[C@@H](C)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(OC(C)=O)cc2)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@@H]21,C33497881_decoy,TRY1,Decoy,0,-6.93448,-6.0,-1.78,-5.571830515352748
Cc1c(C(N)=O)cc(-c2csc([C@@H]3COc4ccccc4O3)n2)n1CCCN1CCCC1=O,C33556561_decoy,TRY1,Decoy,0,-9.40317,-8.16,-1.95,-8.623212429744134
CC(C)(C)N1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])[NH2+][C@H]2c1ccccn1,C33743248_decoy,TRY1,Decoy,0,-7.11125,-5.55,-1.15,-5.107763843964962
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2ccncc2)c1C,C09066937_decoy,TRY1,Decoy,0,-7.93948,-5.9,-2.1,-5.670179937004222
Cc1ccc(-c2nnn(CC(=O)N(CCO)[C@@H](C(=O)NC(C)(C)C)c3ccncc3)n2)cc1,C04093177_decoy,TRY1,Decoy,0,-7.8972,-7.94,-2.39,-8.397415708625454
NS(=O)(=O)c1cc(C(=O)OCC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)cs1,C18388844_decoy,TRY1,Decoy,0,-9.43727,-6.41,-2.46,-6.122592435043816
COc1cc([C@H]2[NH2+][C@@H](C(=O)[O-])CC3=NC=N[C@@H]32)cc(Br)c1OCc1ccccn1,C39546406_decoy,TRY1,Decoy,0,-7.79087,-5.73,-2.64,-5.557623582996991
COc1cc([C@@H]2[NH2+][C@@H](C(=O)[O-])CC3=NC=N[C@H]32)cc(Br)c1OCc1ccccn1,C39546409_decoy,TRY1,Decoy,0,-8.83566,-6.04,-0.9,-5.591434502278874
C[C@@]1(NC(=S)OC/C=C/COC(=S)N[C@]2(C)CCS(=O)(=O)C2)CCS(=O)(=O)C1,C40167458_decoy,TRY1,Decoy,0,-8.67595,-5.54,-1.86,-5.8185521262794495
CCCC[C@]1(C(=O)[O-])[NH2+][C@@H](c2c(C)n(C)n(-c3ccccc3)c2=O)[C@H]2C(=O)N(CC)C(=O)[C@H]21,C43212094_decoy,TRY1,Decoy,0,-6.30318,-7.43,-1.97,-5.732524166043633
CCCOc1ccc([C@H]2[NH2+][C@](C)(C(=O)[O-])[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@@H]23)cc1,C43218550_decoy,TRY1,Decoy,0,-7.36424,-5.99,-2.58,-5.475007022865486
CC[C@@H](C)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(C#N)cc2)[C@H]2C(=O)N(c3ccc(C(C)=O)cc3)C(=O)[C@@H]21,C43221602_decoy,TRY1,Decoy,0,-7.15128,-5.64,-2.15,-5.22401466647288
CC(=O)OC[C@@H]1O[C@@H](O)[C@H](NC(=O)C(Cl)(Cl)Cl)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44608704_decoy,TRY1,Decoy,0,-6.7948,-5.33,-4.28,-4.979462118898443
COc1ccc(Cn2nnnc2[C@@H](c2cc3cccc(C)c3[nH]c2=O)N2CCC(O)CC2)cc1,C57589702_decoy,TRY1,Decoy,0,-8.46043,-7.94,-2.8,-8.669929418749646
CCCNC(=O)c1ccc(Cl)cc1NC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1,C59774646_decoy,TRY1,Decoy,0,-9.40964,-5.17,-1.34,-6.460689573428531
CCS(=O)(=O)NCCCNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Br,C60270076_decoy,TRY1,Decoy,0,-9.87454,-6.05,-2.4,-6.910502834549741
O=C(COc1ccc2c(c1)O/C(=C\c1ccco1)C2=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C63375207_decoy,TRY1,Decoy,0,-8.55281,-8.51,-2.73,-7.485718927224103
CCOCCCNC(=S)N(Cc1cccs1)Cc1cc2ccc(OC)cc2[nH]c1=O,C06195371_decoy,TRY1,Decoy,0,-9.10396,-5.94,-2.22,-7.2202166875164355
COCCCNC(=S)N(Cc1cccs1)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C06238964_decoy,TRY1,Decoy,0,-9.88276,-6.39,-0.87,-6.563706276619695
CCOCCOc1ccccc1C(=O)NC(=S)Nc1ccccc1OC[C@H]1CCCO1,C10011370_decoy,TRY1,Decoy,0,-7.55748,-6.33,-2.59,-6.630745534826157
CCC(C)(C)NC(=O)[C@@H](c1cccc(OC)c1)N(CCC1=CCCCC1)C(=O)CNC(=O)c1cccs1,C12488368_decoy,TRY1,Decoy,0,-9.50793,-6.42,-4.18,-7.51621968250364
CC[C@H](C)c1ccccc1OCC(=O)NC[C@H](C)NC(=O)COc1ccccc1[C@@H](C)CC,C13980448_decoy,TRY1,Decoy,0,-8.48611,-8.2,-2.76,-7.265036823991696
CCCOC(=O)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1,C14665960_decoy,TRY1,Decoy,0,-8.02818,-7.17,-2.58,-6.641051779204738
O=[N+]([O-])c1ccc(OCCOc2cccc(C=NNC(=S)NCc3ccccc3)c2)cc1,C15939018_decoy,TRY1,Decoy,0,-7.42612,-6.98,-2.92,-6.005000413396227
CCOc1ccc(O)c(C(=O)CCCCCCCCC(=O)c2cc(OCC)ccc2O)c1,C16689306_decoy,TRY1,Decoy,0,-8.13943,-6.48,-2.96,-6.475493555409217
C=CCNc1nnc(SCc2cccc(CSc3nnc(NCC=C)s3)c2)s1,C19134312_decoy,TRY1,Decoy,0,-9.88759,-6.48,-2.59,-7.463891287427782
CCCCOc1ccc(C(=O)Nc2ccc([C@@H]3NC(=S)N(CC)C(C)=C3C(=O)OCC(C)C)cc2)cc1,C33739901_decoy,TRY1,Decoy,0,-7.63363,-5.19,-3.06,-4.953702475914305
CCCCN(Cc1ccco1)c1ccc(NC(=O)CCC2CCCC2)cc1C(=O)NCCC,C33746631_decoy,TRY1,Decoy,0,-8.57561,-6.82,-3.71,-6.538729529863161
CCCCCC(=O)Nc1ccc(N2CCc3ccccc3C2)c(C(=O)NCCCOCC)c1,C34718473_decoy,TRY1,Decoy,0,-8.16866,-6.01,-2.81,-6.085093596518743
CCOc1cc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCC[NH+](CC)CC)ccc1O,C35444751_decoy,TRY1,Decoy,0,-10.2672,-4.97,-3.27,-6.175512888869284
CCCCCNC(=O)Cc1csc(NC(=O)CN(CC(C)C)C(=O)c2ccc(C)cc2)n1,C35807738_decoy,TRY1,Decoy,0,-8.80594,-7.13,-3.73,-6.831960161642893
CCCCC/C=C/C(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)cc1,C36495816_decoy,TRY1,Decoy,0,-8.00386,-6.49,-2.18,-8.921381479084792
CCCCC/C=C\C(=O)N(Cc1ccco1)[C@@H](C(=O)NCCCC)c1ccc(O)c(OC)c1,C36496248_decoy,TRY1,Decoy,0,-8.86063,-5.71,-3.94,-6.29618294647881
CCCC[C@@H](CC)C(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)C)c1ccc(O)c(OC)c1,C36496728_decoy,TRY1,Decoy,0,-9.24967,-6.16,-4.36,-7.506434647617018
CCCC[C@H](CC)C(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)C)c1ccc(O)c(OC)c1,C36496729_decoy,TRY1,Decoy,0,-7.33936,-5.95,-4.6,-6.243341028537705
CCCCNC(=O)[C@H](c1cccc(OC)c1)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502215_decoy,TRY1,Decoy,0,-7.5938,-7.15,-4.03,-7.367237609241929
CCCCCCN(C(=O)CCC1CCCCC1)[C@H](C(=O)NCCCC)c1ccc(O)c(OC)c1,C36509731_decoy,TRY1,Decoy,0,-10.4133,-5.85,-1.43,-7.970907330081445
CCCCC/C=C\C(=O)N(CCCCCC)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36510325_decoy,TRY1,Decoy,0,-8.90171,-5.5,-3.0,-6.514556449719017
CCCCCCN(C(=O)CC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)cc1,C36522473_decoy,TRY1,Decoy,0,-8.59441,-7.51,-3.68,-7.986666149082247
CCCCCCN(C(=O)CC)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36522759_decoy,TRY1,Decoy,0,-9.24394,-5.11,-3.62,-5.803400625456204
CCCCNC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccc(C)o1)C(=O)[C@@H](CC)CCCC,C36557856_decoy,TRY1,Decoy,0,-7.81766,-6.33,-4.27,-8.658748206395378
CCCCNC(=O)[C@@H](c1ccccc1O)N(Cc1ccc(C)o1)C(=O)[C@H](CC)CCCC,C36558017_decoy,TRY1,Decoy,0,-7.78308,-4.91,-3.09,-5.5301460752155
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(Cc1ccc(C)o1)C(=O)[C@@H](CC)CCCC,C36558333_decoy,TRY1,Decoy,0,-8.15623,-5.9,-2.22,-8.1762623414199
CCCC[C@H](CC)C(=O)N([C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)cc1)C(C)(C)C,C36582423_decoy,TRY1,Decoy,0,-7.91509,-7.97,-4.46,-7.621985103731335
C=C1CC[C@@H]2[C@@](C)(CCC[C@]2(C)C(=O)OC)[C@H]1CCc1ccoc1C[NH2+][C@@H](CCSC)C(=O)[O-],C37230338_decoy,TRY1,Decoy,0,-8.1858,-6.25,-3.22,-5.468397801319334
COC(=O)CCCCCNC(=O)[C@H](C)SCc1nc2scc(-c3ccccc3)c2c(=O)[nH]1,C24987495_decoy,TRY1,Decoy,0,-8.7907,-4.65,-2.17,-5.65129899180019
CCOCCCNC(=O)[C@@H](c1ccc(OC)cc1)N(Cc1cccs1)C(=O)c1ccccc1O,C08591198_decoy,TRY1,Decoy,0,-8.56191,-5.25,-3.81,-6.278526262602616
CCOCCCNC(=O)[C@@H](c1ccc(C)cc1)N(Cc1cccs1)C(=O)CNC(C)=O,C08690871_decoy,TRY1,Decoy,0,-6.81511,-5.3,-2.35,-5.383716843151976
CO/C(=C/C(N)=O)[C@H](C)[C@H](/C=C/c1csc(-c2csc([C@@H](C)/C=C/C=C/C(C)C)n2)n1)OC,C12504487_decoy,TRY1,Decoy,0,-11.1907,-5.34,-3.53,-6.048589193938298
CCCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(OCCC(C)C)c2)c1,C38684705_decoy,TRY1,Decoy,0,-10.7184,-6.64,-1.4,-6.635566582743618
CCCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(OCCC(C)C)c1,C38684731_decoy,TRY1,Decoy,0,-9.24539,-8.89,-5.24,-8.030684818295834
CC(C)c1ccc(OC[C@@H](O)CN2CCN(C[C@H](O)COc3ccc(C(C)C)cc3)CC2)cc1,C22916941_decoy,TRY1,Decoy,0,-10.668,-6.72,-2.93,-7.049178840471619
O=C(CCCCCCCCC(=O)N/N=C/c1ccccc1Cl)N/N=C/c1ccccc1Cl,C25691144_decoy,TRY1,Decoy,0,-9.44314,-6.78,-2.21,-8.542153878285793
CCc1ccc(OC[C@@H](O)CN2CCN(C[C@@H](O)COc3ccc(CC)cc3)CC2)cc1,C22942674_decoy,TRY1,Decoy,0,-9.61594,-6.81,-4.14,-7.673486559868727
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccco2)[C@@H]1c1cc(C)c(O)c(C)c1,C40018950_decoy,TRY1,Decoy,0,-8.28103,-6.76,-3.49,-6.857624252040896
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CCCC)CCCC)[C@H]2c2ccc(O)cc2)cc1,C40019380_decoy,TRY1,Decoy,0,-9.01583,-5.7,-3.22,-5.856996634688672
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2cc3ccccc3o2)[C@H]1c1cc(C)c(O)c(C)c1,C40019735_decoy,TRY1,Decoy,0,-8.80353,-7.11,-3.97,-8.407157020352875
CCCCCOc1ccc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCOCC)cc1,C38610575_decoy,TRY1,Decoy,0,-8.19668,-6.13,-1.26,-6.045763099447419
CCCCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OCCC)c4)ccc32)c1,C40530089_decoy,TRY1,Decoy,0,-9.47616,-6.41,-3.39,-6.835480387542939
CCCCCCOc1ccc([C@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCC)cc1OC,C38706066_decoy,TRY1,Decoy,0,-8.148,-4.91,-2.58,-5.337307407618045
C#CCOCCOCCOc1ccc(OC)cc1CCNC(=S)Nc1ccc(Br)cn1,C40864191_decoy,TRY1,Decoy,0,-9.35004,-5.71,-3.56,-6.724480547541481
C=CC[NH2+][C@@H](c1ccc(Cl)cc1)[C@@H](CN(CC=C)S(=O)(=O)c1ccccc1)C(=O)[O-],C43209088_decoy,TRY1,Decoy,0,-8.16426,-5.33,-4.62,-6.120570842871065
C=CCc1ccc(OC[C@H](O)CN2C(=O)N[C@@](CCCC)(c3ccccc3)C2=O)c(OC)c1,C24096599_decoy,TRY1,Decoy,0,-8.77266,-6.21,-2.31,-6.692021073276977
CCN(CC)C(=O)CSc1nnc(SCCCOc2ccc(C(C)(C)C)cc2)n1N,C58500795_decoy,TRY1,Decoy,0,-8.64243,-7.47,-2.07,-6.992722783827248
C=CCc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccc(OCC)cc2)cc(OCC)c1OC,C58895338_decoy,TRY1,Decoy,0,-8.89911,-6.94,-2.77,-7.544600879318103
C=CCc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccc(OCC)cc2)cc(OCC)c1OCC,C58895345_decoy,TRY1,Decoy,0,-9.30507,-5.98,-1.67,-8.611990201156113
C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)N/N=C(\C)CCCC,C59915326_decoy,TRY1,Decoy,0,-9.01946,-7.23,-2.03,-8.472210245004291
COC(=O)CCC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(=O)OC)C(C)=C4CCC(=O)OC)c(C)c3CCC(=O)OC,C04208925_decoy,TRY1,Decoy,0,-10.4627,-7.19,-3.36,-13.629218069813346
CCCCN(CCCC)c1nc(N/N=C/c2ccc3c(c2)OCO3)nc(Nc2ccc([N+](=O)[O-])cc2)n1,C08386545_decoy,TRY1,Decoy,0,-8.84531,-7.52,-3.96,-7.834158287297098
CCOC(=O)c1c(NC(=O)CCCCC(=O)Nc2sc(C)c(C)c2C(=O)OCC)sc(C)c1C,C06142202_decoy,TRY1,Decoy,0,-8.4381,-5.88,-4.03,-6.955940621748812
CCCCOc1ccc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCC,C09590661_decoy,TRY1,Decoy,0,-9.63908,-7.6,-3.81,-7.227252985119508
CC(C)O[C@H]1CCCC[C@H]1OC(=O)NCCCCCCNC(=O)O[C@H]1CCCC[C@H]1OC(C)C,C15133506_decoy,TRY1,Decoy,0,-9.04152,-5.12,-4.24,-6.039271189819592
CC(C)O[C@H]1CCCC[C@H]1OC(=O)NCCCCCCNC(=O)O[C@@H]1CCCC[C@@H]1OC(C)C,C15133514_decoy,TRY1,Decoy,0,-8.81059,-6.54,-3.31,-10.001328830988928
CCCC[NH+](CCCC)CCCN1C(=O)C(O)=C(C(=O)c2ccc(Br)cc2)[C@H]1c1cccnc1,C08695334_decoy,TRY1,Decoy,0,-8.31733,-6.22,-3.32,-5.875495622914492
CCCCOC(=O)CNC(=O)OC/C=C\C#CC#C/C=C\COC(=O)NCC(=O)OCCCC,C05812373_decoy,TRY1,Decoy,0,-8.69694,-5.99,-2.92,-6.906331295202901
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1cc(OC)ccc1OC,C20149939_decoy,TRY1,Decoy,0,-7.39849,-5.28,-3.07,-5.532290465456354
CC[C@H](SC1=Nc2ccccc2C2=N[C@@H](CCC(=O)NCc3ccco3)C(=O)N12)C(=O)NCCCOC,C20642943_decoy,TRY1,Decoy,0,-9.40993,-6.72,-3.55,-7.518624814615067
CCCCCn1c(CCC(=O)Nc2cc(OC)cc(OC)c2)nc2c1c(=O)[nH]c(=O)n2CCCC,C23039884_decoy,TRY1,Decoy,0,-9.35535,-6.95,-4.12,-7.626639078286109
CCOC(=O)c1[nH]c(/C=C/Cc2[nH]c(C(=O)OCC)c(C)c2C(=O)OCC)c(C(=O)OCC)c1C,C25763615_decoy,TRY1,Decoy,0,-9.48048,-7.1,-4.17,-7.51873117665042
Cc1c(O)c(=O)ccn1CCOCCOCCOCCOCCCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1,C27074428_decoy,TRY1,Decoy,0,-8.59973,-6.7,-4.47,-6.158012685388629
CCCOc1ccc(/C=C/C(=O)OCC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1OCC,C27421023_decoy,TRY1,Decoy,0,-9.58831,-5.26,-3.96,-6.46592741386832
C=CCOc1ccc([C@@H]2C(C(=O)c3c(C)[nH]c(C(=O)OCC)c3C)=C([O-])C(=O)N2CCC[NH+](CC)CC)cc1,C33515725_decoy,TRY1,Decoy,0,-8.89173,-5.99,-2.81,-7.069498582105712
CCCC[C@H](CC)C(=O)NCCCN(C(=O)Nc1ccccc1F)c1ccc(Oc2ccccc2)cc1,C34972403_decoy,TRY1,Decoy,0,-8.72966,-8.15,-2.98,-7.186158314771179
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC[NH+](C)C)N2[C@@H]1c1cc(OC)cc(OC)c1,C35700966_decoy,TRY1,Decoy,0,-8.11004,-4.41,-2.62,-5.363723784511683
C=CCC[C@H](O)CNc1cccc(-n2nc(OCCc3ccc(OC)cc3)nc2-c2ccco2)c1,C35742989_decoy,TRY1,Decoy,0,-8.10034,-8.42,-3.64,-8.423563327263741
COCCCNC(=O)[C@H](C[NH+](Cc1cccc(C)c1)C[C@@H]1CCCO1)Oc1ccc(F)c(F)c1,C35891022_decoy,TRY1,Decoy,0,-7.95055,-6.92,-2.5,-7.793771006128832
CCCC1(CCC)NC(=O)N(CC(=O)Nc2sc(C(=O)OCC)c(C)c2C(=O)OCC)C1=O,C36229619_decoy,TRY1,Decoy,0,-7.60879,-6.45,-3.42,-7.302226935608441
Cc1nn(-c2cccc(Cl)c2)c(Oc2ccccc2)c1C[NH+](CC1CC1)C[C@H](O)COCC(C)C,C36301817_decoy,TRY1,Decoy,0,-8.35873,-5.33,-2.7,-6.440022965502774
C=CCC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1cccc(OC)c1)CC1CC1,C36302643_decoy,TRY1,Decoy,0,-7.10152,-6.23,-2.02,-7.436188945297473
CCC[NH+](CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(C)cc1)C[C@H](O)COCC(C)C,C36309145_decoy,TRY1,Decoy,0,-10.0868,-5.68,-4.45,-6.4707376822896014
C=CCC[C@H](O)C[NH+](CCCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1ccccc1F,C36309192_decoy,TRY1,Decoy,0,-8.85465,-6.93,-3.98,-8.542441882979341
CCC[C@H](O)C[NH+](CCCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1cccc(F)c1,C36309584_decoy,TRY1,Decoy,0,-8.74754,-7.12,-3.83,-7.99602147987444
C=CCC[C@@H](O)C[NH+](CCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(F)cc1,C36310143_decoy,TRY1,Decoy,0,-8.44586,-6.85,-3.97,-8.300929178444752
C=CCC[C@H](O)C[NH+](CCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(F)cc1,C36310145_decoy,TRY1,Decoy,0,-9.80252,-6.87,-3.89,-8.354281228644476
CCC[C@H](O)C[NH+](CCCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(F)cc1,C36310158_decoy,TRY1,Decoy,0,-8.96977,-7.18,-2.24,-10.68420569516138
Cc1ccc(Oc2c(C[NH+](CC3CC3)C[C@H](O)COCc3ccccc3)c(C)nn2-c2ccccc2)cc1,C36345939_decoy,TRY1,Decoy,0,-8.12375,-7.2,-0.79,-7.0134213309391225
CCCCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccc(F)cc2)c1Oc1cccc(F)c1)C(C)C,C36346650_decoy,TRY1,Decoy,0,-7.46254,-6.87,-0.73,-9.237641338573154
CCCCC/C=C/C(=O)N(CCCCCC)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36510326_decoy,TRY1,Decoy,0,-9.38086,-5.85,-3.63,-6.950526780651376
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1cc([N+](=O)[O-])ccc1Cl,C36519452_decoy,TRY1,Decoy,0,-7.97919,-5.57,-1.87,-5.9181257436561605
CCCCC/C=C/C(=O)N(CCC)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36564034_decoy,TRY1,Decoy,0,-8.33398,-5.29,-2.84,-6.390163603623353
CCCC[C@H](CC)C(=O)N(CCC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccccc1O,C36564437_decoy,TRY1,Decoy,0,-7.78439,-5.89,-3.55,-6.867262842387357
CCC/C=C/[C@@H](C(=O)NCCCC)N(Cc1ccc(C)o1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36599017_decoy,TRY1,Decoy,0,-7.84447,-6.25,-2.32,-9.004358209165833
CCCOc1cccc([C@@H]2C(C(=O)c3c(C)[nH]c(C(=O)OC)c3C)=C([O-])C(=O)N2CC[NH+](CC)CC)c1,C33813308_decoy,TRY1,Decoy,0,-8.1402,-5.08,-3.15,-5.419574777918065
COc1cccc(/C=N/NC(=O)CCCCCC(=O)N/N=C/c2cccc(OC)c2OC)c1OC,C20274579_decoy,TRY1,Decoy,0,-8.5715,-5.47,-4.91,-6.685112631884844
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccco2)[C@@H]1c1ccc(O)c(OC)c1,C40018850_decoy,TRY1,Decoy,0,-9.30089,-6.87,-4.2,-7.488328114171036
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(F)cc2)[C@H]1c1cc(C)c(O)c(C)c1,C40019637_decoy,TRY1,Decoy,0,-9.21169,-6.53,-3.1,-7.618451268195422
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2cc3ccccc3o2)[C@H]1c1ccc(O)c(OC)c1,C40019695_decoy,TRY1,Decoy,0,-8.00433,-7.32,-3.86,-7.256721687537227
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2cc3ccccc3o2)[C@@H]1c1ccc(O)c(OC)c1,C40019696_decoy,TRY1,Decoy,0,-8.81936,-7.07,-4.17,-7.283235006230797
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2cc3cccc(OC)c3o2)[C@@H]1c1ccc(O)cc1,C40019748_decoy,TRY1,Decoy,0,-9.06433,-6.94,-4.81,-6.89707441713233
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(O)c(OC)c2)cc1C,C40092572_decoy,TRY1,Decoy,0,-8.56254,-5.66,-3.33,-6.009443029620071
COc1ccccc1COC[C@@H]1CN([C@H](C)[C@H](O)c2ccc(O)cc2)C[C@H](COCc2ccccc2OC)O1,C40556050_decoy,TRY1,Decoy,0,-9.77534,-8.43,-4.06,-8.279310388733881
COc1ccccc1COC[C@@H]1CN([C@@H](C)[C@@H](O)c2ccc(O)cc2)C[C@H](COCc2ccccc2OC)O1,C40556051_decoy,TRY1,Decoy,0,-10.4509,-7.43,-3.39,-8.179464564093328
Cc1nn(-c2cccc(Cl)c2)c(Oc2ccccc2)c1C[NH+](CC(C)C)C[C@@H](O)COCC(C)C,C36301730_decoy,TRY1,Decoy,0,-7.87621,-6.69,-1.81,-7.3127812746067775
CCCCCn1c(CCC(=O)NCCCOC2CCCCC2)nc2c1c(=O)[nH]c(=O)n2CCCC,C10737584_decoy,TRY1,Decoy,0,-8.99878,-6.06,-3.87,-6.344399523192563
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C,C57933546_decoy,TRY1,Decoy,0,-7.59552,-6.69,-4.16,-6.166732664335873
CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(Br)c(OCC(=O)OC)c(OC)c2)cc1,C58894153_decoy,TRY1,Decoy,0,-8.40966,-6.94,-1.47,-6.909910798960838
CCCCOc1ccc(CC(=O)N/N=C/C(C)=N/NC(=O)Cc2ccc(OCCCC)cc2)cc1,C12436653_decoy,TRY1,Decoy,0,-10.162,-6.05,-1.83,-6.864476410581248
CCOc1ccc(NC(=O)C[C@H]([NH2+]CCC[NH+](CC)CC)C(=O)[O-])c([N+](=O)[O-])c1,C05258767_decoy,TRY1,Decoy,0,-6.21045,-5.63,-2.68,-5.076142463684312
CCOc1ccc(NC(=O)C[C@@H]([NH2+]CCC[NH+](CC)CC)C(=O)[O-])c([N+](=O)[O-])c1,C05258768_decoy,TRY1,Decoy,0,-5.75427,-5.64,-1.85,-5.344451374905946
CCN(C[C@H](O)C[NH+](CC)C[C@H](O)COc1ccc(OC)cc1)S(=O)(=O)O,C05247196_decoy,TRY1,Decoy,0,-7.99733,-5.69,-2.07,-5.8184588343291725
NC(=O)c1cc(S(=O)(=O)NCCC[NH+](Cc2ccco2)C2CCCC2)cs1,C07006305_decoy,TRY1,Decoy,0,-8.73422,-6.69,-0.58,-5.896689315784602
Cc1cccc(OC[C@H](O)Cn2c(NCCC[NH+]3CCOCC3)nc3c2c(=O)[nH]c(=O)n3C)c1,C09292754_decoy,TRY1,Decoy,0,-8.27898,-7.74,-1.07,-6.969054134474187
COc1ccc(OC[C@H](O)C[NH+](CCO)C[C@@H](O)Cn2ccc3ccccc32)cc1,C12080507_decoy,TRY1,Decoy,0,-6.88734,-5.89,-2.27,-6.516684014675117
C=CCC(O)(CC=C)CNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(F)c(F)c1,C12373421_decoy,TRY1,Decoy,0,-9.04024,-6.71,-1.43,-6.173221938501473
Cn1c(=O)n(C)c2cc([C@H](O)COc3ccc(C[NH2+]CCCCCO)cc3)ccc21,C13727219_decoy,TRY1,Decoy,0,-7.34663,-6.55,-2.68,-5.547383079868637
CC[NH+](CC)Cc1c(C(=O)N/N=C/CCc2ccccc2)nnn1-c1nonc1N,C15162656_decoy,TRY1,Decoy,0,-8.38903,-7.11,-2.67,-7.672342844982873
C=C(C)CNC(=S)NCCCN1CC[NH+](CCCNC(=S)NCC(=C)C)CC1,C19690755_decoy,TRY1,Decoy,0,-8.09727,-5.58,-3.57,-7.049781257246023
Cc1n[nH]c(C)c1CCNCc1ccccc1OC[C@H](O)C[NH+](C)C1CCCCC1,C19758205_decoy,TRY1,Decoy,0,-9.16059,-7.26,-2.63,-7.167759345153308
Cc1n[nH]c(C)c1CCNCc1ccccc1OC[C@@H](O)C[NH+](C)C1CCCCC1,C19758208_decoy,TRY1,Decoy,0,-8.73216,-7.28,-2.08,-7.640519172249113
CC(=O)OC[C@H]1O[C@@H](SC(N)=[NH2+])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C19899161_decoy,TRY1,Decoy,0,-6.72897,-5.06,-1.06,-5.227989138527525
CCNc1nc2nc(SCC(=O)Nc3ccccc3OCC)nn2c(NCC)[nH+]1,C00629342_decoy,TRY1,Decoy,0,-8.50386,-6.23,-3.96,-7.066947825199408
CCOc1ccc2nc(NCCCNC(=S)NCCC[NH+](C)C)c(C#N)cc2c1,C20151277_decoy,TRY1,Decoy,0,-8.19627,-4.93,-3.11,-4.757641530203117
COc1cccc(C[NH2+]CC2(O)CCCCC2)c1OC[C@@H](O)CN1CCOCC1,C15063555_decoy,TRY1,Decoy,0,-7.39439,-6.53,-2.67,-6.27863361323714
COc1cccc(C[NH2+]CC2(O)CCCCC2)c1OC[C@H](O)CN1CCOCC1,C15063556_decoy,TRY1,Decoy,0,-8.35359,-6.26,-1.56,-7.87753823574335
Cc1n[nH]c(SCC[NH2+]Cc2cccc(OC[C@@H](O)CN3CCOCC3)c2)n1,C20599314_decoy,TRY1,Decoy,0,-8.08853,-5.24,-2.29,-4.829931884626181
Cc1n[nH]c(SCC[NH2+]Cc2cccc(OC[C@H](O)CN3CCOCC3)c2)n1,C20599315_decoy,TRY1,Decoy,0,-8.91027,-6.27,-3.26,-5.949320874969716
CC[C@@H](CO)[NH2+]Cc1cc(Br)c(OC[C@@H](O)c2ccc3c(c2)OCCO3)c(OC)c1,C20877136_decoy,TRY1,Decoy,0,-9.9352,-6.92,-2.07,-7.766708868833158
CC(=O)OC[C@@H]1O[C@@H](SC(N)=[NH2+])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16930974_decoy,TRY1,Decoy,0,-7.15775,-4.77,-3.16,-5.112605272109309
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)C[NH+](C)Cc2ccc(F)cc2F)c(=O)[nH]c1=O,C25531197_decoy,TRY1,Decoy,0,-7.06413,-5.59,-3.9,-5.428956855784996
CC(C)CN(C(=O)C[NH+](CC(C)C)C(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C29724145_decoy,TRY1,Decoy,0,-6.87254,-5.65,-3.07,-5.634020561575268
C=CC[NH+](CC(=O)c1c(N)n(CCOC)c(=O)[nH]c1=O)Cc1ccc(Cl)s1,C29054913_decoy,TRY1,Decoy,0,-8.66232,-5.82,-2.27,-5.867792480686913
CC[NH+](CC(=O)c1c(N)n(CCOC)c(=O)[nH]c1=O)Cc1ccc(OC)c(F)c1,C29064956_decoy,TRY1,Decoy,0,-7.33483,-6.48,-2.16,-5.629978171922477
CCCCN(C(=O)C[NH+](C1CC1)[C@@H](C)C1CC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C31654852_decoy,TRY1,Decoy,0,-7.24187,-5.1,-2.65,-5.507624374653194
CCCCN(C(=O)C[NH+](C1CC1)[C@H](C)C1CC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C31654855_decoy,TRY1,Decoy,0,-7.64067,-4.78,-4.16,-5.638493023790974
C=Cc1ccccc1OC[C@H](O)C[NH+](CCO)C[C@H](O)Cn1ccc2ccccc21,C35048267_decoy,TRY1,Decoy,0,-7.08105,-6.81,-3.03,-6.331018616117777
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccncc2)nnn1-c1nonc1N,C03633111_decoy,TRY1,Decoy,0,-7.73068,-7.35,-1.56,-6.952415409883054
C[NH+](C)CCCNC(=S)N(CCO)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C04160434_decoy,TRY1,Decoy,0,-7.24711,-5.51,-3.0,-5.417093957171191
COc1ccc(OC[C@H](O)C[NH+](CCO)C[C@H](O)Cn2ccc3ccccc32)cc1,C04248029_decoy,TRY1,Decoy,0,-7.94443,-7.13,-2.45,-7.28830417950135
OCC[NH+](C[C@H](O)Cn1ccc2ccccc21)C[C@H](O)Cn1ccc2ccccc21,C02707531_decoy,TRY1,Decoy,0,-7.9603,-5.87,-1.81,-6.192942026339349
OCC[NH+](C[C@@H](O)Cn1ccc2ccccc21)C[C@@H](O)Cn1ccc2ccccc21,C02707532_decoy,TRY1,Decoy,0,-6.80826,-7.25,-2.33,-7.80059215034746
OCC[NH+](C[C@H](O)Cn1ccc2ccccc21)C[C@@H](O)Cn1ccc2ccccc21,C13147457_decoy,TRY1,Decoy,0,-7.78621,-6.9,-1.66,-8.832661929512492
COc1ccc(OC[C@@H](O)C[NH+](CCO)C[C@H](O)Cn2ccc3ccccc32)cc1,C02710303_decoy,TRY1,Decoy,0,-8.54568,-5.51,-2.37,-5.503313219480326
CC(=O)OC[C@H]1O[C@@H](SC(N)=[NH2+])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C38323639_decoy,TRY1,Decoy,0,-5.48322,-6.57,-3.02,-8.215800468729217
OCC[NH+](CCO)C[C@H](O)COCCOc1c(F)cc(Br)cc1F,C39916146_decoy,TRY1,Decoy,0,-8.09834,-5.3,-1.93,-5.349144047344709
CC(=O)OC[C@@H]1O[C@@H](SC(N)=[NH2+])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C08652400_decoy,TRY1,Decoy,0,-6.99156,-4.14,-3.19,-5.080732239483098
COc1ccc(C(=O)NNc2ncnc(NCCCn3cc[nH+]c3)c2[N+](=O)[O-])cc1,C40658904_decoy,TRY1,Decoy,0,-7.33813,-7.5,-2.66,-7.34600836675669
O=C([O-])[C@H](C[NH2+]Cc1ccccn1)[C@H]([NH2+]Cc1ccccn1)c1ccc(Cl)cc1,C43209035_decoy,TRY1,Decoy,0,-7.87123,-6.78,-2.04,-7.035358440042071
O=C([O-])[C@@H](C[NH2+]Cc1ccccn1)[C@@H]([NH2+]Cc1ccccn1)c1ccc(Cl)cc1,C43209036_decoy,TRY1,Decoy,0,-7.04735,-6.9,-3.88,-6.178760079084149
COc1cccc(CNC(=O)[C@H]2C[NH2+]C[C@@H]2C(=O)NCCCOC(C)C)c1OC,C43222696_decoy,TRY1,Decoy,0,-8.04256,-6.67,-2.46,-6.140601462457246
CC(=O)OC[C@@H]1O[C@@H](SC(N)=[NH2+])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44170934_decoy,TRY1,Decoy,0,-6.39078,-3.55,-1.34,-4.605370431325973
CC[NH+](CC)CC[NH2+][C@H](CC(=O)Nc1ccc(/N=N\c2ccccc2)cc1)C(=O)[O-],C22592612_decoy,TRY1,Decoy,0,-6.92383,-6.3,-1.75,-6.488087483887598
CC[NH2+]CCCNCc1ccc(OC[C@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C13735277_decoy,TRY1,Decoy,0,-8.42173,-6.51,-3.94,-5.320868489214409
CC[NH2+]CCCNCc1ccc(OC[C@@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C13735274_decoy,TRY1,Decoy,0,-8.88013,-6.33,-3.58,-6.267410150861674
CCOc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)cc(C(=O)NCCCn4cc[nH+]c4)c3c2)cc1,C23238522_decoy,TRY1,Decoy,0,-9.17039,-6.96,-2.34,-6.316822727210447
CCOC(=O)C1=C(COCC[NH3+])NC(C)=C(C(=O)OC)[C@@H]1c1ccccc1Cl,C19796039_decoy,TRY1,Decoy,0,-7.32573,-5.11,-1.95,-5.559142377762586
CCOC(=O)C1=C(COCC[NH3+])NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C19796041_decoy,TRY1,Decoy,0,-7.65769,-5.46,-3.12,-6.422836520318581
CCOc1ccc(NC(=O)C[C@H]([NH2+]CCCCC[NH+](C(C)C)C(C)C)C(=O)[O-])c([N+](=O)[O-])c1,C65090338_decoy,TRY1,Decoy,0,-7.1109,-5.69,-3.77,-5.73727547178348
CCOC(=O)CNC(=O)CSc1nnc(NC(=O)c2cc(OCC)c(OCC)c(OCC)c2)s1,C08822650_decoy,TRY1,Decoy,0,-10.324,-6.06,-3.52,-8.555568172262078
CCS(=O)(=O)Nc1cc([C@H](C(=O)OC(C)C)C(=O)C(F)(F)F)c(NS(=O)(=O)CC)cc1OC,C08870525_decoy,TRY1,Decoy,0,-8.0032,-4.93,-3.64,-5.548695389266644
CCOc1ccc(N2C[C@H](CNC(=O)Nc3cc(OCC)c(OCC)c(OCC)c3)CC2=O)cc1,C09039698_decoy,TRY1,Decoy,0,-9.84651,-5.41,-3.3,-5.882796688084079
CCCCN(CCCC)S(=O)(=O)c1ccc(C(=O)Nc2sccc2C(=O)NC(=O)OC)cc1,C09384364_decoy,TRY1,Decoy,0,-9.93367,-5.36,-3.86,-6.200095046454851
CCOc1cc(/C=C/C(=O)OCc2c(C(=O)OC)sc(N)c2C(=O)OC)cc(Cl)c1OC,C09617337_decoy,TRY1,Decoy,0,-10.0884,-6.08,-3.39,-6.135944799602483
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)[C@H](C)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-],C09662417_decoy,TRY1,Decoy,0,-7.4124,-7.12,-3.02,-5.836380368001752
CCOC(=O)COc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)cc1OCC,C10002356_decoy,TRY1,Decoy,0,-9.38248,-4.9,-2.04,-5.73701479630786
CCOC(=O)c1c(-c2ccco2)csc1NC(=O)COC(=O)CN1C(=O)NC(CC)(CC)C1=O,C10167116_decoy,TRY1,Decoy,0,-7.23957,-6.39,-3.56,-5.374372761439363
CCCCc1cc(=O)oc2c(C)c(OCC(=O)NCCCCCC(=O)N3CC[C@@]4(O)CCCC[C@H]4C3)ccc12,C11867187_decoy,TRY1,Decoy,0,-9.68722,-7.87,-3.09,-7.402354417632237
CCCc1cc(=O)[nH]c(-n2nc(-c3ccco3)cc2NC(=O)c2cc(OCC)c(OCC)c(OCC)c2)n1,C12007213_decoy,TRY1,Decoy,0,-8.76377,-7.22,-2.54,-7.777301210439987
CCCCOc1ccc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1OC,C12695588_decoy,TRY1,Decoy,0,-7.76076,-6.13,-3.08,-5.234054909458377
CCOC(=O)c1ccc(S(=O)(=O)NCCCC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)cc1,C13000281_decoy,TRY1,Decoy,0,-9.39028,-7.31,-2.48,-6.405825740358712
CCOC(=O)Cc1csc(NC(=O)CSc2nnc(-c3ccc(NS(=O)(=O)CC)cc3)o2)n1,C13151215_decoy,TRY1,Decoy,0,-9.81283,-8.12,-2.08,-7.679596001165424
CCCCN(C(=O)CCC(=O)Nc1cc(C)on1)[C@H](C(=O)NC[C@H]1CCCO1)c1ccccc1C,C13505845_decoy,TRY1,Decoy,0,-8.11012,-6.67,-2.51,-6.392711154202471
COc1ccc(/C=C(\NC(C)=O)C(=O)N2CCNC(=O)[C@H]2CC(=O)OCCOc2ccccc2)cc1OC,C14018883_decoy,TRY1,Decoy,0,-8.97224,-7.91,-2.99,-7.615551437962975
CCCCCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1ccc(OC)cc1[N+](=O)[O-],C14648598_decoy,TRY1,Decoy,0,-8.34648,-6.35,-4.45,-6.751758424336508
CCCCOc1ccc(C(=O)NC(=S)N2CCNC(=O)[C@@H]2CC(=O)OCC(C)C)cc1Br,C14663868_decoy,TRY1,Decoy,0,-9.25764,-5.28,-3.47,-5.80123621997839
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)/C=C/C(=O)O[C@H](C)C(=O)c2[nH]c(C)c(C(C)=O)c2C)c1C,C14754074_decoy,TRY1,Decoy,0,-8.69387,-8.25,-3.31,-7.811684748391509
CC(C)CCNC(=O)[C@@H](c1ccncc1)N(CCCO)C(=O)Cn1nnc(-c2ccc(F)cc2)n1,C06076922_decoy,TRY1,Decoy,0,-8.44145,-7.77,-1.77,-7.1674712349455225
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2C)[C@H]1c1ccc(O)c(OC)c1,C20065332_decoy,TRY1,Decoy,0,-8.95945,-6.28,-1.61,-6.107961891604276
COc1ccc(/C=N/Nc2nc(SCC(=O)OC3CCCCC3)n[nH]2)cc1OCn1cccn1,C20424549_decoy,TRY1,Decoy,0,-10.0256,-7.71,-1.73,-8.80042778642667
CCN(CCCNC(=O)CCCCCn1c(=S)[nH]c2cc3c(cc2c1=O)OCO3)c1cccc(C)c1,C20644399_decoy,TRY1,Decoy,0,-9.71813,-6.64,-4.25,-6.12505198458489
CCOc1ccc(NC(=O)CS[C@@H](C)C(=O)Nc2cc(C)on2)cc1S(=O)(=O)N(CC)CC,C24038715_decoy,TRY1,Decoy,0,-8.69409,-6.56,-3.33,-6.461147721410555
CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)C2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC)c1C,C25480356_decoy,TRY1,Decoy,0,-7.7569,-6.04,-3.44,-5.745567198687797
COc1ccc([C@@H](CC(=O)[O-])Cc2csc(CCCCNc3cc(N4CCCC4)cc[nH+]3)n2)cn1,C28568706_decoy,TRY1,Decoy,0,-10.7169,-6.76,-1.98,-7.766952038001542
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@H]2c2ccc(C(C)(C)C)cc2)c1C,C33515696_decoy,TRY1,Decoy,0,-8.2164,-7.07,-3.9,-7.571180538058615
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@@H]2c2ccccn2)c1C,C33515697_decoy,TRY1,Decoy,0,-7.32281,-5.91,-3.15,-6.706164810454889
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@H]2c2ccncc2)c1C,C33515700_decoy,TRY1,Decoy,0,-8.09513,-6.5,-2.64,-7.678712509155011
CCCCNC(=O)Cc1csc(NC(=O)CN(CCOC)C(=O)c2ccc(Cl)c(Cl)c2)n1,C35306663_decoy,TRY1,Decoy,0,-10.2432,-6.82,-2.7,-6.625137629582869
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(Cc1ccco1)C(=O)CCc1ccc(OC)cc1,C36501281_decoy,TRY1,Decoy,0,-9.0746,-5.33,-1.9,-5.911984856368678
CCCCCCN(C(=O)Cc1ccc2c(c1)OCO2)[C@@H](C(=O)NC1CCCCC1)c1ccc(O)c(OC)c1,C36516253_decoy,TRY1,Decoy,0,-8.40893,-6.74,-3.09,-7.090605506165367
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccco1,C36519484_decoy,TRY1,Decoy,0,-8.05284,-7.95,-4.3,-7.92550434677227
CCCCC/C=C\C(=O)N(C)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)c(OC)c1,C36526617_decoy,TRY1,Decoy,0,-9.401,-5.69,-3.53,-5.768786022716305
COc1cccc(C(=O)OCC(=O)NCCNC(=O)COC(=O)c2cccc(OC)c2OC)c1OC,C12815768_decoy,TRY1,Decoy,0,-8.12125,-6.93,-2.84,-7.19182346205405
CCC[C@@H](C(=O)NCc1ccco1)N(C[C@H]1CCCO1)C(=O)CNS(=O)(=O)c1ccc(F)cc1,C13150979_decoy,TRY1,Decoy,0,-8.41949,-7.4,-3.37,-7.527374263976951
CCOC(=O)C[C@H](O)C[C@H](O)/C=C/c1c(-c2ccc(F)cc2)nc(N(C)S(C)(=O)=O)nc1C(C)C,C38339134_decoy,TRY1,Decoy,0,-8.79946,-4.54,-2.54,-5.404251530538355
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(CC)cc4)ccc32)cc1OCC,C38683942_decoy,TRY1,Decoy,0,-8.21357,-7.69,-3.78,-6.997407643325096
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)[C@H](NC(=O)c2cc(OC)cc(OC)c2)C(C)C)c1C,C39191539_decoy,TRY1,Decoy,0,-8.40036,-7.17,-3.53,-7.537972476544872
CCOC(=O)c1c(NC(=O)COC(=O)/C=C/c2cccc(OC)c2OC)sc(C(=O)NC)c1C,C39618379_decoy,TRY1,Decoy,0,-9.45973,-7.1,-2.97,-6.502592102849996
C=CCn1c(S[C@@H](CC)C(=O)Nc2nccs2)nnc1[C@H](C)NC(=O)Cc1ccc(OC)cc1,C39743464_decoy,TRY1,Decoy,0,-9.77748,-5.82,-2.33,-6.531592507031978
CCn1c(S[C@H](C)C(=O)Nc2ccc(C)cc2)nnc1[C@H](CCSC)NC(=O)c1ccc(OC)cc1,C39753434_decoy,TRY1,Decoy,0,-9.67951,-7.98,-2.1,-7.452137248612076
C=CCn1c(S[C@H](CC)C(=O)Nc2nnc(C)s2)nnc1[C@@H](C)NC(=O)Cc1ccc(OC)cc1,C39757577_decoy,TRY1,Decoy,0,-9.55692,-8.33,-3.01,-7.50296561091003
C=CCn1c(CC(=O)Nc2ccc(OCC)cc2)nnc1SCC(=O)Nc1ncc([N+](=O)[O-])s1,C39766972_decoy,TRY1,Decoy,0,-9.59198,-7.99,-3.08,-7.309490751008962
COc1cc(OC)cc(OC[C@@H](O)CN2CCN(C[C@H](O)COc3cc(OC)cc(OC)c3)CC2)c1,C23078723_decoy,TRY1,Decoy,0,-9.38277,-7.46,-4.26,-7.8652320227801535
CCCOc1ccc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(=O)NCCOC)CCCC3)cc1OCC,C39992424_decoy,TRY1,Decoy,0,-8.95963,-6.15,-2.49,-6.084058201795711
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)NCC(=O)Nc1ccccc1CC,C46876413_decoy,TRY1,Decoy,0,-8.28603,-7.43,-2.66,-7.089395570546595
CCOc1cc(C(=O)NC(=S)NCc2ccc(-c3nc4ncccc4o3)cc2)cc(OCC)c1OCC,C57327722_decoy,TRY1,Decoy,0,-10.4997,-8.06,-5.37,-3.0578952700795874
CCC[C@H](c1nnnn1C[C@@H]1CCCO1)N(CCCO)Cc1cc2cc(OCC)ccc2[nH]c1=O,C13501060_decoy,TRY1,Decoy,0,-8.79657,-6.5,-2.38,-6.985909936590618
CCC[C@H](c1nnnn1C[C@H]1CCCO1)N(CCCO)Cc1cc2cc(OCC)ccc2[nH]c1=O,C33937379_decoy,TRY1,Decoy,0,-8.27554,-6.93,-2.24,-6.711356995498348
C=CCn1cc(/C=N/NC(=O)[C@@H](C)Sc2nnc(CNc3ccc(Cl)cc3)n2CC=C)cn1,C59830031_decoy,TRY1,Decoy,0,-9.84389,-7.9,-3.16,-9.293000031476558
O=C([O-])[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,C04654620_decoy,TRY1,Decoy,0,-8.10486,-8.87,-3.17,-7.6135588669771055
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(Cc1ccccc1F)C(=O)c1snc(C(N)=O)c1N,C06462262_decoy,TRY1,Decoy,0,-8.15957,-7.33,-2.75,-11.783476915977843
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@H]1CCCO1)c1ccc(C)o1,C06631427_decoy,TRY1,Decoy,0,-8.19335,-7.35,-1.94,-11.00957421659074
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06135855_decoy,TRY1,Decoy,0,-7.38151,-6.58,-1.31,-6.256305951573708
CC1=C(C2=C(C)[C@H](C(C)C)C3=C(C(=O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@@H](O)C2=C([C@@H]1C(C)C)[C@H](O)[C@H](O)C2=O,C08681781_decoy,TRY1,Decoy,0,-7.92925,-7.52,-1.15,-5.685778740440435
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08788810_decoy,TRY1,Decoy,0,-9.3963,-8.27,-3.63,-6.663540688614767
CC1(O[P@](=O)([O-])Oc2ccc([N+](=O)[O-])cc2)[C@](C)(O)[C@](C)(O)C(C)(O)[C@@](C)(O)[C@]1(C)O,C09970452_decoy,TRY1,Decoy,0,-6.28227,-7.07,-3.46,-5.404212032996807
O=C([O-])[C@@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@@H](O)[C@@H](O)[C@@H]1O,C12153628_decoy,TRY1,Decoy,0,-7.76124,-8.31,-1.9,-7.081820056356957
Nc1nc2c(nc(SCc3ccccc3Br)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C12406923_decoy,TRY1,Decoy,0,-7.97262,-8.25,-3.49,-8.714064537509353
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1C,C12473203_decoy,TRY1,Decoy,0,-7.62857,-6.21,-3.5,-6.233708042902615
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)c(Cl)c2)cc1,C12477112_decoy,TRY1,Decoy,0,-9.24358,-5.65,-1.05,-6.299781351360589
C[C@]12CC[C@@H]3[C@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C12653357_decoy,TRY1,Decoy,0,-8.80006,-5.88,-2.79,-5.975664708874248
CCOc1cc(O)c2c(=O)c(-c3ccc(O[C@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3)coc2c1,C12654518_decoy,TRY1,Decoy,0,-8.11006,-7.46,-1.85,-5.045229962992249
O=C([O-])c1[nH]nc(-c2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C12656504_decoy,TRY1,Decoy,0,-8.8309,-7.93,-3.71,-5.961872751547224
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)cc1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12660159_decoy,TRY1,Decoy,0,-8.92215,-8.67,-1.56,-9.14403414008711
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c(O)c1C2=O,C13547730_decoy,TRY1,Decoy,0,-6.35738,-6.29,-4.07,-4.200053472114921
O=C(O[C@H]1C=C(CO)[C@H]2[C@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C14858111_decoy,TRY1,Decoy,0,-9.17061,-7.83,-1.6,-6.960807458855058
C[C@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@H]2C1=CC(=O)OC1,C17057356_decoy,TRY1,Decoy,0,-7.67078,-5.25,-2.22,-4.679364726432493
NC(=O)CSc1nnc(N/N=C/c2cc(Br)c([O-])c(Br)c2)n1N,C21320371_decoy,TRY1,Decoy,0,-8.90464,-7.04,-1.06,-7.169970113464145
NC(=O)CSc1nnc(N/N=C/c2cc(Br)cc(Br)c2[O-])n1N,C21320404_decoy,TRY1,Decoy,0,-9.97498,-7.81,-1.88,-7.946210558315078
O=C([O-])[C@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C21992916_decoy,TRY1,Decoy,0,-7.67026,-8.3,-2.84,-7.214091831130624
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c(O)c1C2=O,C28095922_decoy,TRY1,Decoy,0,-7.54161,-7.83,-2.69,-5.099902526857891
C[C@@H]1[C@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)O[C@@H](c2ccc(O)cc2)[C@@]1(C)O,C31164902_decoy,TRY1,Decoy,0,-7.76096,-8.51,-1.68,-7.550253984314377
NC(=O)COc1ccc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2CSc2ccccc2)cc1,C33162963_decoy,TRY1,Decoy,0,-9.15884,-7.65,-1.12,-9.10158263305596
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493882_decoy,TRY1,Decoy,0,-9.26848,-8.22,-1.3,-7.209406386631584
Nc1nc2c(nc(Sc3ccccc3N)n2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C36488908_decoy,TRY1,Decoy,0,-7.08522,-8.54,-1.78,-10.608277489879136
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)[C@@H]1CCC(=O)N1,C36504534_decoy,TRY1,Decoy,0,-8.68782,-6.08,-0.77,-6.643085409138903
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c(O)c1C2=O,C04099037_decoy,TRY1,Decoy,0,-8.29971,-7.93,-2.91,-5.487192083756427
O=C([O-])[C@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C31155995_decoy,TRY1,Decoy,0,-8.21836,-9.08,-3.83,-8.088142000642774
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c(O)c1C2=O,C03830557_decoy,TRY1,Decoy,0,-7.12598,-6.88,-3.51,-5.5588537306399335
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c(O)c1C2=O,C03830555_decoy,TRY1,Decoy,0,-9.19527,-8.1,-3.96,-5.929853627754368
O=C([O-])C1=NN=C(c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[C@@H]1c1ccc2c(c1)OCCO2,C38168313_decoy1,TRY1,Decoy,0,-7.30313,-5.91,,-4.699062890766209
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)c(O)c(O)c21,C39778197_decoy,TRY1,Decoy,0,-8.04172,-7.75,-3.35,-5.798442334171472
C[NH+]1CC[C@]23c4c5ccc(O[C@@H]6O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]6O)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5,C39937376_decoy,TRY1,Decoy,0,-6.47754,-6.4,-5.38,-4.677593218147349
C[C@@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@@]34/C=N/NC(N)=O)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43735684_decoy,TRY1,Decoy,0,-7.54046,-6.42,-1.59,-5.941799436278308
C/C(=N\NC(N)=O)[C@]12OC(C)(C)O[C@@H]1C[C@@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@]4(C)[C@@H]3CC[C@@]12C,C43760901_decoy,TRY1,Decoy,0,-7.35289,-5.97,-3.33,-5.243234023760463
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867016_decoy,TRY1,Decoy,0,-8.87942,-5.4,-2.09,-5.681974744999356
C[C@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867021_decoy,TRY1,Decoy,0,-7.76728,-5.61,-2.45,-6.055011901596402
O=C([O-])[C@@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@@H](O)[C@H](O)[C@@H]1O,C33949418_decoy,TRY1,Decoy,0,-7.3915,-7.97,-0.94,-6.77226592934934
Cc1c(C(=O)[O-])c(O)c(O)c2c1C(=O)c1c(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c1C2=O,C44075838_decoy,TRY1,Decoy,0,-6.91313,-6.62,-3.38,-4.131100496043868
O=[P@@]([O-])(Oc1c[nH]c2cc(Cl)c(Br)cc12)OC1[C@@H](O)[C@H](O)C(O)[C@@H](O)[C@H]1O,C15206038_decoy,TRY1,Decoy,0,-9.11556,-6.89,-1.83,-5.891071173415092
CC1=C(C2=C(C)[C@H](C(C)C)C3=C(C(=O)[C@@H](O)[C@@H]3O)[C@@H]2O)[C@@H]([O-])C2=C([C@H]1C(C)C)[C@@H](O)[C@@H](O)C2=O,C13813178_decoy1,TRY1,Decoy,0,-7.56491,-5.72,,-4.885020564784108
O=C([O-])[C@@H]1O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C34245015_decoy,TRY1,Decoy,0,-7.15479,-8.72,-3.31,-8.564320742765668
O=C([O-])C1=NN=C(c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[C@H]1c1ccc2c(c1)OCCO2,C38168314_decoy1,TRY1,Decoy,0,-6.30113,-8.24,,-6.427511358799208
CC1=C(C2=C(C)[C@H](C(C)C)C3=C(C(=O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@@H]([O-])C2=C([C@H]1C(C)C)[C@H](O)[C@H](O)C2=O,C13813178_decoy2,TRY1,Decoy,0,-8.88275,-6.76,,-6.633996185059203
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c1C2=O,C65735194_decoy,TRY1,Decoy,0,-6.67225,-7.9,-4.19,-5.214664933432408
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c1C2=O,C65735195_decoy,TRY1,Decoy,0,-6.93109,-7.7,-3.77,-4.159463926476525
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c1C2=O,C65735199_decoy,TRY1,Decoy,0,-8.137,-8.0,-2.77,-4.967322259947623
C[NH+]1CC[C@]23c4c5ccc(O[C@H]6O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]6O)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5,C65748366_decoy,TRY1,Decoy,0,-5.20534,-6.75,-1.86,-4.1930374895777565
CCCCNC(=S)N(CCC[NH+](CC)CC)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C06149733_decoy,TRY1,Decoy,0,-9.47066,-6.35,-2.64,-9.07271057988195
CC[NH+](CC)CCCN(Cc1cc2cc(OC)c(OC)cc2[nH]c1=O)C(=S)Nc1ccc(C)cc1,C06078173_decoy,TRY1,Decoy,0,-9.98259,-6.2,-4.08,-6.4019644257193615
CCOc1ccc(NC(=S)N(CC[NH+](CC)CC)Cc2cc3cc(OCC)ccc3[nH]c2=O)cc1,C06078345_decoy,TRY1,Decoy,0,-8.80648,-5.91,-1.21,-6.355164007169435
CCC[C@H](c1nnnn1C(C)(C)CC)[NH+](CCO)Cc1cc2cc(OCC)ccc2[nH]c1=O,C13501006_decoy,TRY1,Decoy,0,-7.47263,-6.38,-3.1,-7.059565223518073
CCOc1cccc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)c1OCc1ccccc1Cl,C13729777_decoy,TRY1,Decoy,0,-7.95516,-6.29,-2.29,-5.403922293562236
CCOc1cccc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2)c1OCc1ccc(Cl)cc1Cl,C13730085_decoy,TRY1,Decoy,0,-7.80987,-6.13,-0.79,-6.407118305956204
CCOc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)cc(Cl)c1OCc1ccc(F)cc1,C16688515_decoy,TRY1,Decoy,0,-7.43154,-6.87,-4.95,-6.3874025398191
CCOc1ccc(OC[C@@H](O)C[NH+](CC)Cc2nc3cc(OC)c(OC)cc3c(=O)[nH]2)cc1,C25660341_decoy,TRY1,Decoy,0,-8.09779,-5.81,-2.28,-6.8075971628883
CCOc1ccc(OC[C@H](O)C[NH+](CC)Cc2nc3cc(OC)c(OC)cc3c(=O)[nH]2)cc1,C25660345_decoy,TRY1,Decoy,0,-8.43558,-5.95,-2.63,-5.836664592078558
C[NH+](C)CCNC(=O)CCN(Cc1ccco1)C(=O)c1csc(Nc2cccc(C(F)(F)F)c2)n1,C35593842_decoy,TRY1,Decoy,0,-8.1971,-7.41,-2.64,-7.844748623593702
COCC[NH+](Cc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C[C@H](O)COCc1ccccc1,C35745621_decoy,TRY1,Decoy,0,-8.09296,-7.64,-2.37,-6.563855285980721
CCOC[C@@H](O)C[NH+](CCN1CCOCC1)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C35745896_decoy,TRY1,Decoy,0,-9.97472,-6.19,-3.52,-6.988222470169558
Cc1ccc(-c2csc3nc(C[NH+](CCN4CCOCC4)C[C@H](O)COCC(C)C)[nH]c(=O)c23)c(C)c1,C35746362_decoy,TRY1,Decoy,0,-9.18752,-7.0,-3.48,-6.868054898230498
Cc1c(C(=O)OC(C)C)sc2nc(C[NH+](C[C@H](O)COCC(C)C)C3CC3)[nH]c(=O)c12,C35746835_decoy,TRY1,Decoy,0,-8.85865,-6.3,-4.17,-6.265646256593733
CCCC(=O)OC[C@H](O)C[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C1CC1,C35746842_decoy,TRY1,Decoy,0,-9.5486,-6.12,-3.4,-7.548959037325753
C=CCC[C@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)Cc1ccco1,C35747286_decoy,TRY1,Decoy,0,-9.62537,-5.52,-1.45,-6.183459204559752
C=CCOC[C@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)C1CC1,C35747317_decoy,TRY1,Decoy,0,-9.67615,-6.42,-3.39,-8.846290518322771
COCCC[NH+](Cc1nc2scc(-c3ccccc3F)c2c(=O)[nH]1)C[C@@H](O)COc1ccccc1C,C35747397_decoy,TRY1,Decoy,0,-9.19988,-6.62,-1.99,-6.782505046102355
C=CCOC[C@@H](O)C[NH+](CCOC)Cc1nc2sc3c(c2c(=O)[nH]1)CCN(Cc1ccccc1)C3,C36156020_decoy,TRY1,Decoy,0,-10.2861,-6.95,-1.21,-7.488304019533728
COc1cc(-c2noc([C@@H]([NH2+]C[C@H](O)COc3ccccc3)C(C)C)n2)cc(OC)c1OC,C36160766_decoy,TRY1,Decoy,0,-7.86258,-6.77,-2.14,-6.154813219650139
C=CC[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)C[C@@H](O)COCC,C36206093_decoy,TRY1,Decoy,0,-9.10716,-6.81,-3.31,-8.75462342841616
CCOC[C@H](O)C[NH+](CCCOC)Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1,C36206314_decoy,TRY1,Decoy,0,-8.12755,-5.88,-3.58,-6.385504332240606
COCCC[NH+](Cc1nc2scc(-c3cccc(Cl)c3)c2c(=O)[nH]1)C[C@H](O)COCC(C)C,C36206424_decoy,TRY1,Decoy,0,-9.44269,-6.56,-3.46,-8.072032091788401
C=CC[NH+](Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1)C[C@H](O)COCC(C)C,C36206609_decoy,TRY1,Decoy,0,-8.67034,-6.58,-1.45,-6.818575899200421
C=CCOC(=O)c1sc2nc(C[NH+](Cc3ccco3)C[C@@H](O)COC(C)(C)C)[nH]c(=O)c2c1C,C36206776_decoy,TRY1,Decoy,0,-8.81173,-5.1,-2.3,-6.236570877485889
COCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@H](O)COC(C)C,C36206816_decoy,TRY1,Decoy,0,-8.06298,-5.83,-2.9,-7.530820937077606
COCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)COCC(C)C,C36206819_decoy,TRY1,Decoy,0,-9.3627,-4.59,-4.49,-5.951848156816604
C=CCOC[C@H](O)C[NH+](CCCOC)Cc1nc2sc(C(=O)OC)c(CC)c2c(=O)[nH]1,C36207329_decoy,TRY1,Decoy,0,-8.68893,-4.3,-2.38,-5.672052298788702
C=CCOC[C@H](O)C[NH+](CCOC)Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1,C36207391_decoy,TRY1,Decoy,0,-8.01027,-4.58,-2.36,-5.693804567687526
C=CCC[C@@H](O)C[NH+](CCCOC)Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1,C36207454_decoy,TRY1,Decoy,0,-8.44844,-5.58,-4.63,-6.264144220714458
C#CCOC[C@H](O)C[NH+](CCCOC)Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1,C36207461_decoy,TRY1,Decoy,0,-9.7969,-4.25,-1.79,-6.377708575258644
CCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)COc1ccc(Cl)cc1,C36207465_decoy,TRY1,Decoy,0,-9.45579,-6.32,-4.04,-7.353776816789187
COC(=O)c1sc2nc(C[NH+](Cc3ccco3)C[C@@H](O)COCc3ccco3)[nH]c(=O)c2c1C,C36207512_decoy,TRY1,Decoy,0,-8.40157,-7.24,-3.28,-7.2302394889852035
COCCC[NH+](Cc1nc2scc(-c3ccc(C)cc3)c2c(=O)[nH]1)C[C@@H](O)COCc1ccco1,C36207652_decoy,TRY1,Decoy,0,-9.00063,-6.96,-2.6,-6.975414393014255
C=CCC[C@@H](O)C[NH+](CCC(C)C)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C36207735_decoy,TRY1,Decoy,0,-9.6803,-6.79,-3.38,-8.837504276839297
C=CCC[C@@H](O)C[NH+](CC=C)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C36207747_decoy,TRY1,Decoy,0,-9.02896,-6.47,-3.41,-8.073709066430876
C=CCOC[C@@H](O)C[NH+](CCOC)Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1,C36207835_decoy,TRY1,Decoy,0,-8.68551,-6.45,-2.08,-8.040662568324356
C=CCOC[C@H](O)C[NH+](CCOC)Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1,C36207836_decoy,TRY1,Decoy,0,-8.42759,-6.31,-2.81,-8.097440387931949
CC[NH+](CC)CC1O[C@@H]2CO[C@H](C[NH+](CC)CC)O[C@@H]2[C@@H]2O[C@@H](C[NH+](CC)CC)OC[C@H]2O1,C37630165_decoy,TRY1,Decoy,0,-8.67378,-4.43,-2.6,-6.720040842085484
CCOC(=O)[C@@H]1S[C@H](NC(=O)CS[C@H]2N=NC(N/N=C/c3ccc(OCC)cc3)=[NH+]2)[C@H](C#N)[C@@H]1C,C39404327_decoy,TRY1,Decoy,0,-8.49553,-6.82,-4.65,-6.557849813323553
COCCC[NH+](Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1)C[C@H](O)COCC(C)C,C40404747_decoy,TRY1,Decoy,0,-8.93185,-6.32,-4.0,-8.408683206484326
C=CCC[C@@H](O)C[NH+](CCCOC)Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1,C40404858_decoy,TRY1,Decoy,0,-8.27901,-6.13,-3.49,-6.592310634230533
COC(=O)c1sc2nc(C[NH+](CC(C)C)C[C@@H](O)COCc3ccco3)[nH]c(=O)c2c1C,C36207494_decoy,TRY1,Decoy,0,-8.57964,-5.84,-3.49,-5.953213716496342
Cc1c(C(=O)OC(C)C)sc2nc(C[NH+](CC(C)C)C[C@H](O)COCC(C)C)[nH]c(=O)c12,C36206806_decoy,TRY1,Decoy,0,-8.3141,-6.1,-2.32,-7.834629454836933
COc1ccccc1COC[C@@H](O)C[NH+](C[C@@H](O)COCc1ccccc1OC)C12CC3CC(CC(C3)C1)C2,C12801199_decoy,TRY1,Decoy,0,-9.65536,-7.32,-4.12,-8.581301865818322
CCCCCC/C(NCCC1=c2ccccc2=[NH+]C1)=C1\C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O,C63425439_decoy,TRY1,Decoy,0,-9.46968,-6.87,-3.22,-6.576189957299597
CCCC[C@H](CC)C(=O)/N=C(\NCCC1=c2ccc(OC)cc2=[NH+]C1)Nc1nc(C)cc(C)n1,C63744060_decoy,TRY1,Decoy,0,-9.32469,-6.23,-3.77,-7.55851291536582
CCCC(CCC)C(=O)/N=C(\NCCC1=c2ccc(OC)cc2=[NH+]C1)Nc1nc(C)cc(C)n1,C63744061_decoy,TRY1,Decoy,0,-9.24832,-7.59,-2.39,-12.442631668542427
CCCC[C@@H](CC)C(=O)/N=C(\NCCC1=c2cc(OC)ccc2=[NH+]C1)Nc1nc(C)cc(C)n1,C63804278_decoy,TRY1,Decoy,0,-9.83618,-5.93,-2.61,-6.6207531833146325
CCOC(=O)c1c(NC(=O)COC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(C)=O)sc(C)c1CC,C63814514_decoy,TRY1,Decoy,0,-9.26927,-7.95,-3.58,-8.128116354704478
COc1cc(C[NH2+]C23CC4C[C@@](C)(C2)C[C@](C)(C4)C3)cc(Cl)c1OCC(=O)NC(C)(C)C,C04489429_decoy,TRY1,Decoy,0,-8.35261,-6.95,-1.93,-5.908393998892991
CCOc1ccc(NC(=S)NCCC[NH+]2CCN(c3cc(C)ccc3C)CC2)cc1,C04792006_decoy,TRY1,Decoy,0,-8.3034,-6.67,-2.8,-6.103339237420428
Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1C[NH2+]C1CCC(O)CC1,C08751234_decoy,TRY1,Decoy,0,-8.96755,-6.88,-3.55,-7.26316507362229
Oc1ccccc1C[NH+](Cc1ccco1)C[C@@H](O)COc1ccc(Cl)cc1Cl,C03425880_decoy,TRY1,Decoy,0,-7.38644,-7.31,-1.77,-7.518457495674647
CCOc1cccc([C@@H]2CC(c3ccc(Cl)cc3)=N[C@H](c3cccc(OC)c3)[NH2+]2)c1O,C09542508_decoy,TRY1,Decoy,0,-8.06961,-6.04,-4.49,-5.151248578353464
Cc1n[nH]c(C)c1CC[NH2+]Cc1cn(-c2ccc(F)cc2)nc1-c1ccccc1Cl,C12613274_decoy,TRY1,Decoy,0,-8.19226,-6.82,-1.96,-6.7344347471542365
CC1(C)CC(N(Cc2ccncc2)C(=S)Nc2ccccc2C(F)(F)F)CC(C)(C)[NH2+]1,C05945427_decoy,TRY1,Decoy,0,-7.11356,-6.92,-2.3,-6.001092228162898
C[NH+](C)CCCN1C(=O)c2[nH]nc(-c3ccc(Cl)cc3O)c2[C@H]1c1ccc(Cl)cc1,C08845492_decoy,TRY1,Decoy,0,-7.37932,-4.92,-1.2,-4.873906688509872
CCOc1ccc(NC(=S)NCCC[NH+]2CCN(c3cc(Cl)ccc3C)CC2)cc1,C04791811_decoy,TRY1,Decoy,0,-9.05515,-6.54,-2.56,-5.785547225094187
Cc1ccc(NC(=S)NCCC[NH+]2CCN(c3cc(Cl)ccc3C)CC2)c(Cl)c1,C04791819_decoy,TRY1,Decoy,0,-9.25634,-6.93,-3.47,-6.323514053384952
CCOc1cc(C[NH2+]CCc2c[nH]c3ccccc23)cc(Cl)c1OCc1ccccc1Cl,C16688691_decoy,TRY1,Decoy,0,-7.20439,-7.22,-2.69,-5.112206408066398
Cc1ccc2nc(N3CCN(c4cccc(Cl)c4)CC3)c(C[NH2+][C@@H](C)CO)cc2c1,C20205522_decoy,TRY1,Decoy,0,-8.55828,-6.23,-1.22,-5.375725893581709
OC12C[C@H]3C[C@@H](C1)CC([NH2+]Cc1cc(Cl)ccc1OCc1ccccc1Cl)(C3)C2,C13728653_decoy,TRY1,Decoy,0,-9.36478,-6.53,-2.02,-5.727641113289881
CCc1ccc(/[NH+]=c2\oc3c(C)ncc(CO)c3cc2C(=O)Nc2ccccc2CC)cc1,C20616975_decoy,TRY1,Decoy,0,-8.92142,-8.72,-2.12,-8.79584980278732
Cc1c(Cl)cccc1NC(=S)N/N=C1\C(=O)N(C[NH+]2CCCCC2)c2ccccc21,C02923033_decoy,TRY1,Decoy,0,-9.36397,-8.51,-5.49,-8.854192652407546
CCOc1cccc([C@@H]2CC(c3ccc(OC)cc3)=N[C@@H](c3ccc(Cl)cc3)[NH2+]2)c1O,C20762953_decoy,TRY1,Decoy,0,-8.85501,-7.52,-1.27,-7.350640132911217
CCOc1cccc([C@@H]2CC(c3ccc(Br)cc3)=N[C@@H](CC(C)C)[NH2+]2)c1O,C20763181_decoy,TRY1,Decoy,0,-9.54252,-6.88,-0.8,-7.170853941374244
COc1ccc(CN(C[C@H]2CC=CCC2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C21263601_decoy,TRY1,Decoy,0,-10.2099,-5.64,-2.47,-6.10724721254989
CCOC(=O)c1c(NC(=O)[C@H](C)[NH2+][C@H](C)C23CC4CC(CC(C4)C2)C3)sc2c1CC[C@@H](C)C2,C34805242_decoy,TRY1,Decoy,0,-9.74564,-8.35,-2.81,-7.087435085688444
C=CCC[C@H](O)C[NH+](Cc1nc2scc(-c3cccc(Cl)c3)c2c(=O)[nH]1)CC(C)C,C35747571_decoy,TRY1,Decoy,0,-9.23154,-6.78,-2.11,-7.002626342574939
C=CCC[C@@H](O)C[NH+](CCC)Cc1nc2scc(-c3ccc(C)cc3C)c2c(=O)[nH]1,C35747706_decoy,TRY1,Decoy,0,-8.66876,-6.85,-2.8,-7.370702260314357
C=CCC[C@@H](O)C[NH+](CC=C)Cc1nc2scc(-c3ccc(C)cc3C)c2c(=O)[nH]1,C35747723_decoy,TRY1,Decoy,0,-9.13196,-6.84,-1.5,-7.125352235065853
CCC[C@@H](O)C[NH+](Cc1nc2scc(-c3ccc(C)c(C)c3)c2c(=O)[nH]1)CC(C)C,C36205200_decoy,TRY1,Decoy,0,-8.00443,-7.64,-3.11,-5.873308519835869
Cc1ccc(-c2csc3nc(C[NH+](C[C@H](O)Cc4ccccc4)C(C)C)[nH]c(=O)c23)cc1C,C36205305_decoy,TRY1,Decoy,0,-9.16288,-8.38,-1.41,-7.56049706471019
Cc1cc([C@@H](Nc2cccc[nH+]2)c2ccc(C(F)(F)F)cc2)c(NC(=O)c2ccco2)s1,C38546997_decoy,TRY1,Decoy,0,-8.55358,-6.61,-1.15,-7.879109471980864
CSc1ccc([C@@H](Nc2cc(C)cc[nH+]2)c2cc(C)sc2NC(=O)c2ccco2)cc1,C38547015_decoy,TRY1,Decoy,0,-9.39903,-6.73,-1.86,-8.602425870218665
Cc1cc[nH+]c(N[C@@H](c2cccnc2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)c1,C38547407_decoy,TRY1,Decoy,0,-10.3949,-5.52,-2.75,-6.600406499763649
Cc1cc[nH+]c(N[C@@H](c2ccc(F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547576_decoy,TRY1,Decoy,0,-8.05008,-5.54,-1.38,-5.488442300142727
Cc1cc[nH+]c(N[C@@H](c2ccc(Br)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547649_decoy,TRY1,Decoy,0,-7.58105,-6.6,-2.92,-6.587647537780831
CCc1cc([C@@H](Nc2cc(C)cc[nH+]2)c2ccc(SC)cc2)c(NC(=O)c2ccco2)s1,C38547870_decoy,TRY1,Decoy,0,-10.9827,-7.0,-1.9,-8.985285051689102
CCc1cc([C@@H](Nc2cccc(C)[nH+]2)c2ccsc2)c(NC(=O)c2ccco2)s1,C38547947_decoy,TRY1,Decoy,0,-11.979,-6.81,-0.44,-9.920372192693328
CC1=C(CC[NH2+]CC2=CN(c3ccc(F)cc3F)N[C@H]2c2ccccc2C)[C@@H](C)N=N1,C39399201_decoy,TRY1,Decoy,0,-8.74411,-7.39,-1.73,-7.272824718217993
Cc1ccc(Cl)c(NC(=S)N(Cc2cccnc2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1,C39411907_decoy,TRY1,Decoy,0,-7.29743,-5.11,-4.7,-4.713118733613423
CC1=C(CC[NH2+]C[C@H]2CN(c3ccc(F)cc3)N[C@@H]2c2ccccc2Cl)[C@H](C)N=N1,C39421315_decoy,TRY1,Decoy,0,-8.49063,-7.15,-0.77,-7.046613449615148
CC1(C)CC(N(Cc2ccc(F)cc2)C(=S)Nc2ccc(Cl)cc2C(F)(F)F)CC(C)(C)[NH2+]1,C39422032_decoy,TRY1,Decoy,0,-9.13085,-5.82,-2.76,-6.115696310765505
CC(C)Cc1ccc([C@@H](C[NH2+]Cc2ccccc2)N2CCN[C@H](Br)C2)cc1,C39533482_decoy,TRY1,Decoy,0,-8.24328,-4.86,-2.96,-6.199922625125451
CCCCNS(=O)(=O)c1ccc(/[NH+]=c2/cc(C)[nH]c3cc(C(F)(F)F)ccc23)cc1,C40570927_decoy,TRY1,Decoy,0,-7.45524,-8.29,-1.82,-5.554052091553924
COc1cc(C[NH2+]CCc2c[nH]c3ccccc23)cc(Cl)c1OCc1ccccc1C,C40742455_decoy,TRY1,Decoy,0,-7.41798,-6.96,-1.75,-4.98768012730163
Cc1cccc(N[C@@H](c2cccc(F)c2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)[nH+]1,C38551079_decoy,TRY1,Decoy,0,-9.91351,-5.74,-0.28,-5.91786144039279
C[C@H](NC(=O)[C@@H](C)[NH+](C)CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1,C45313490_decoy,TRY1,Decoy,0,-8.06774,-7.49,-1.98,-6.4128004878573295
CCOc1ccc([C@@H](C)[NH2+]CC(=O)/N=c2/[nH]c(-c3ccc(Br)cc3)cs2)cc1,C19840890_decoy,TRY1,Decoy,0,-10.5103,-8.46,-1.9,-9.615660924445002
Cc1ccc(CN(C(=S)Nc2ccc(Cl)cc2Cl)C2CC(C)(C)[NH2+]C(C)(C)C2)o1,C59095866_decoy,TRY1,Decoy,0,-9.27935,-5.89,-2.56,-6.279642325504752
Cc1cc(C)c(NC(=S)N(Cc2cccs2)C2CC(C)(C)[NH2+]C(C)(C)C2)c(C)c1,C59098199_decoy,TRY1,Decoy,0,-8.7899,-5.52,-2.84,-5.708967976712721
Cc1cc(NC(=S)N(Cc2ccc(F)cc2)C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1Cl,C59101062_decoy,TRY1,Decoy,0,-9.77416,-5.84,-2.45,-6.462991695663367
CCc1cccc(C)c1NC(=S)N(Cc1ccccc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C06284999_decoy,TRY1,Decoy,0,-7.92638,-5.59,-3.21,-5.43496326887052
Cc1ccccc1CN(C(=S)Nc1cccc(Cl)c1Cl)C1CC(C)(C)[NH2+]C(C)(C)C1,C59187789_decoy,TRY1,Decoy,0,-8.83967,-5.81,-1.85,-5.815387381329422
COc1ccc(CN(C(=S)Nc2cccc(C)c2Cl)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C59195612_decoy,TRY1,Decoy,0,-8.58232,-5.56,-2.11,-5.629322133946927
CCc1cccc(C)c1NC(=S)N(Cc1cccs1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59199522_decoy,TRY1,Decoy,0,-9.06931,-5.6,-3.19,-6.149338290827748
C[C@@H]1[NH+]=c2ccc(Cl)cc2=C1CCNC(=S)Nc1ccc(OC(F)(F)F)cc1,C63664057_decoy,TRY1,Decoy,0,-7.53954,-5.67,-1.1,-5.874326940014566
Cc1ccc(Nc2nc(C(=O)NCCC3=c4ccccc4=[NH+]C3)cc3occc23)cc1Cl,C64772184_decoy,TRY1,Decoy,0,-8.288,-7.59,-2.12,-6.813441755256833
Cc1ccc(C(C)C)c(OC(=O)NCCCCCCNC(=O)Oc2cc(C)ccc2C(C)C)c1,C04771158_decoy,TRY1,Decoy,0,-8.2874,-6.57,-2.76,-7.0921145980418085
CCCCOC(=S)Nc1ccc(S(=O)(=O)c2ccc(NC(=S)OCCCC)cc2)cc1,C04823121_decoy,TRY1,Decoy,0,-8.70449,-6.2,-4.29,-6.007625606351198
O=C(CCCSCCCC(=O)N/N=C/C=C/c1ccccc1)N/N=C\C=C/c1ccccc1,C08614748_decoy,TRY1,Decoy,0,-8.42002,-6.64,-3.53,-6.86587872113882
CCCCN(CCCC)C(=O)Cc1csc(SCC(=O)Nc2cccc(NC(C)=O)c2)n1,C08849900_decoy,TRY1,Decoy,0,-8.19772,-7.0,-4.02,-6.267539920259441
CCCCN(CCCC)C(=O)Cc1csc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)n1,C09819648_decoy,TRY1,Decoy,0,-9.06617,-6.58,-3.87,-6.69297696722453
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1OCCOc1ccccc1,C12137190_decoy,TRY1,Decoy,0,-9.06237,-6.78,-2.27,-6.820466066512775
CC(C)OCCCNC(=O)NC(=O)CSc1nnc(-c2cccs2)n1[C@@H](C(=O)[O-])C(C)C,C13271907_decoy,TRY1,Decoy,0,-8.83274,-6.55,-4.62,-8.19888976365644
COCC(=O)Nc1c(C(=O)OC)n(CCCc2ccccc2)c2ncc(NCC(C)(C)C)cc12,C14538648_decoy,TRY1,Decoy,0,-7.28144,-6.86,-2.07,-6.056614703475396
CC[C@H](OC(C)=O)c1cc(=O)oc2c(C(=O)[C@@H](C)CC)c(O)c(C/C=C(\C)CCC=C(C)C)c(O)c12,C14718758_decoy,TRY1,Decoy,0,-8.7588,-5.8,-2.24,-6.95863398668888
CC(C)CCOC(=O)C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1ccccc1OCC(C)C,C14775183_decoy,TRY1,Decoy,0,-8.56589,-4.7,-3.76,-6.201153997315142
CCOc1cc(C(=O)NNC(=O)CSCc2ccc(Cl)cc2)cc(OCC)c1OCC,C15792847_decoy,TRY1,Decoy,0,-9.01554,-5.48,-3.79,-6.07655066428378
CCCCCOC(=O)[C@@H](CCCC)c1c(O)nc(C)nc1/C=C/c1c(O)ccc2ccccc12,C16857151_decoy,TRY1,Decoy,0,-8.57427,-6.37,-2.11,-7.697127545202303
COCCNC(=O)c1c(NC(=O)COC(=O)CCOc2ccccc2)sc2c1CCCC2,C18358900_decoy,TRY1,Decoy,0,-9.38621,-7.01,-2.59,-7.1676630340972425
COCCNC(=O)c1c(NC(=O)COC(=O)COc2ccccc2C(C)C)sc2c1CCCC2,C18975705_decoy,TRY1,Decoy,0,-10.6998,-6.45,-3.8,-7.1706612663613685
CCCCC[C@@H](C)NC(=O)CSc1nnc(SCC(=O)N[C@H](C)CCCCC)s1,C19285867_decoy,TRY1,Decoy,0,-9.8356,-5.62,-2.9,-6.863458455907794
Cc1ccc(C(C)C)c(OC[C@@H](O)CN2CCN(C[C@H](O)COc3cc(C)ccc3C(C)C)CC2)c1,C20034462_decoy,TRY1,Decoy,0,-10.619,-7.57,-3.89,-7.924099920534361
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](C)C)[C@@H]2c2ccc(O)c(OCC)c2)cc1C,C09375131_decoy,TRY1,Decoy,0,-8.41376,-5.99,-2.02,-6.597570774494283
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@H]2c2ccc(O)c(OC)c2)cc1,C09358846_decoy,TRY1,Decoy,0,-8.91242,-6.86,-2.3,-8.751555230635358
CCCCOc1cccc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(OC)c([O-])c([N+](=O)[O-])c3)n2)c1,C21084138_decoy,TRY1,Decoy,0,-7.63192,-6.42,-4.24,-6.256403339750891
CCOC(=O)c1sc(NC(=S)NC(=O)COc2ccc(Cl)c(C)c2)c(C(=O)OCC)c1C,C22819823_decoy,TRY1,Decoy,0,-9.27557,-4.89,-2.53,-6.015603250031238
CCOC(=O)c1c(NC(=O)CSc2nnc(NCCOC)s2)sc(C)c1-c1ccccc1,C22842919_decoy,TRY1,Decoy,0,-9.12064,-5.89,-2.7,-6.196683671901501
C[C@@H]1CN(C[C@@H](O)COCc2ccc(Cl)cc2)CCN1C[C@@H](O)COCc1ccc(Cl)cc1,C22924110_decoy,TRY1,Decoy,0,-10.8639,-7.49,-2.29,-7.67494976857342
CCCCCOc1ccc(C(=O)O[C@@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)cc1,C23866678_decoy,TRY1,Decoy,0,-8.06149,-8.26,-1.18,-6.793795354724876
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccccc2)[C@H]1c1cccc(O)c1,C25183257_decoy,TRY1,Decoy,0,-8.06201,-6.49,-3.24,-6.231623682724348
CCOC(=O)c1c(C2CC2)csc1NC(=O)COC(=O)c1ccccc1NCCc1ccc(F)cc1,C25398028_decoy,TRY1,Decoy,0,-8.68658,-7.73,-2.26,-8.320244036512038
CCCNC(=O)CSc1nnc(SCC(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)s1,C26219592_decoy,TRY1,Decoy,0,-10.4054,-6.62,-3.18,-6.463340584166968
C=CCn1c(COc2ccccc2F)nnc1SCC(=O)N(CCC(N)=O)c1ccccc1,C29841154_decoy,TRY1,Decoy,0,-8.57641,-7.36,-5.21,-6.855067922247693
CSc1cccc(NC(=O)COC(=O)CCCCCNC2=NS(=O)(=O)c3ccccc32)c1,C32945525_decoy,TRY1,Decoy,0,-8.73254,-8.02,-3.53,-6.771777082814376
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@H]2c2cccc(O)c2)cc1,C33499052_decoy,TRY1,Decoy,0,-8.46491,-5.53,-4.34,-5.703582593951005
CCCCCCN(C(=O)Cc1ccccc1C)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36509339_decoy,TRY1,Decoy,0,-8.57118,-6.14,-3.56,-6.8939558518158695
CCCCCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NCCCC)c1ccc(O)c(OC)c1,C36513958_decoy,TRY1,Decoy,0,-7.73368,-5.3,-4.61,-5.90492054961683
CCCCCCN(C(=O)CCl)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1cccc(O)c1,C36517254_decoy,TRY1,Decoy,0,-9.33988,-8.05,-4.44,-8.742647794542988
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(Cl)cc1,C36519637_decoy,TRY1,Decoy,0,-8.91353,-5.76,-3.44,-6.368951457022905
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(Cc1ccc(C)o1)C(=O)[C@H](CC)CCCC,C36558332_decoy,TRY1,Decoy,0,-8.07772,-5.21,-3.49,-6.756054056429556
CCCCNC(=O)[C@@H](c1cccc(OC)c1)N(CCC)C(=O)C(O)(c1ccccc1)c1ccccc1,C36573058_decoy,TRY1,Decoy,0,-6.65818,-6.41,-3.69,-8.5362939107421
CCCC[C@@H](CC)C(=O)N([C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)cc1)C(C)(C)C,C36582422_decoy,TRY1,Decoy,0,-7.50844,-5.57,-3.74,-5.515756542278239
CCCC[C@@H](CC)C(=O)N([C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccccc1O)C(C)(C)C,C36582568_decoy,TRY1,Decoy,0,-6.24737,-5.97,-5.25,-5.260315480738671
CCC[C@H](C(=O)NC(C)(C)CC)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccccc1,C13502742_decoy,TRY1,Decoy,0,-7.73422,-6.32,-3.79,-6.654472513620273
CCC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(CCOC)C(=O)CCC(=O)Nc1nccs1,C13151122_decoy,TRY1,Decoy,0,-9.26748,-7.14,-4.61,-8.360036713779042
CCOC(=O)/C(C#N)=C/c1ccc(C(c2ccc(C(=O)[O-])cc2)c2ccc(/C=C(\C#N)C(=O)OCC)[nH]2)[nH]1,C17729632_decoy,TRY1,Decoy,0,-9.55837,-6.12,-3.68,-6.45005915611906
CCCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C/c4ccccc4)ccc32)cc1OC,C38681979_decoy,TRY1,Decoy,0,-8.29885,-6.57,-2.81,-6.057157450969779
CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C/c4ccccc4)ccc32)cc1OCC,C38684317_decoy,TRY1,Decoy,0,-8.06034,-6.0,-4.93,-5.47405789026658
CCCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OCCCC)ccc32)c1,C38685248_decoy,TRY1,Decoy,0,-8.25506,-5.9,-2.37,-6.110990912219592
CCCCCN1C(=O)c2[nH]nc(-c3cc(C)cc(C)c3O)c2[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C39912048_decoy,TRY1,Decoy,0,-9.33625,-6.59,-1.98,-7.706268931590383
CCCCCN1C(=O)c2[nH]nc(-c3c(C)cc(C)cc3O)c2[C@H]1c1ccc(OCCCC)c(OCC)c1,C38705901_decoy,TRY1,Decoy,0,-8.73992,-5.45,-3.18,-7.374129848361794
CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)CSc2nnc(NCCOC)s2)cc1,C45353261_decoy,TRY1,Decoy,0,-9.31151,-7.1,-1.85,-7.468618948700834
O=C([O-])CCCCCNC(=O)CCCCCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S,C15044840_decoy,TRY1,Decoy,0,-8.70758,-6.92,-2.34,-6.4489514599054125
CCCCC[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(C(=O)c1cc([N+](=O)[O-])ccc1O)c1ccccc1,C36609456_decoy,TRY1,Decoy,0,-7.17315,-6.11,-2.52,-6.0949749474729575
C=CCc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccc(OCC)cc2)cc(OC)c1OCc1cccc(F)c1,C58895270_decoy,TRY1,Decoy,0,-8.2484,-6.08,-4.15,-5.782001728517768
Cc1ccc(C)c(OCCCC(C)(C)C(=O)NC(=S)Nc2ccccc2OCCOc2ccccc2)c1,C66201687_decoy,TRY1,Decoy,0,-9.58029,-6.01,-1.94,-7.7464407831577455
Cc1cc[nH+]c(NC(NC(=O)c2ccccc2C)(C(F)(F)F)C(F)(F)F)c1,C04336749_decoy,TRY1,Decoy,0,-7.20126,-5.89,-1.06,-5.905413636815501
COc1ccc(C2=N[C@H](c3ccc(OC)cc3)[NH2+][C@@H](c3cc(Cl)ccc3O)C2)cc1,C04729301_decoy,TRY1,Decoy,0,-8.89975,-7.76,-1.27,-7.713577535335815
COc1cccc([C@H]2N=C(c3ccc(Cl)cc3)C[C@H](c3cccc(OC)c3O)[NH2+]2)c1,C04729950_decoy,TRY1,Decoy,0,-8.3698,-7.4,-0.99,-5.781577858559982
CCOc1cc(Br)ccc1S(=O)(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C05235048_decoy,TRY1,Decoy,0,-7.73041,-5.12,-3.13,-5.081873101910683
CCOc1cc(C[NH2+]CCO)cc(Cl)c1OCc1ccc(Cl)cc1Cl,C08254025_decoy,TRY1,Decoy,0,-9.57065,-5.48,-4.08,-6.150888505887987
COc1ccc(C2=N[C@H](c3ccc(OC)cc3)[NH2+][C@H](c3cc(Cl)ccc3O)C2)cc1,C04729298_decoy,TRY1,Decoy,0,-9.44513,-7.47,-0.71,-7.708452643625593
COc1cc(CC[NH3+])cc(Cl)c1OCCOc1cc(C)ccc1C(C)(C)C,C11830156_decoy,TRY1,Decoy,0,-9.26661,-5.69,-1.7,-8.655740926080897
COc1cc(CC[NH3+])cc(Cl)c1OCCOc1ccc(C)cc1C(C)(C)C,C11861267_decoy,TRY1,Decoy,0,-8.82615,-6.2,-1.81,-8.009660614690699
COc1cccc(C[NH3+])c1OCCOc1ccc(C(C)(C)c2ccccc2)cc1,C11948866_decoy,TRY1,Decoy,0,-9.00115,-7.22,-2.95,-5.695509215560956
CC(C)(O)C#Cc1ccc(C[NH+]2CCC3(CC2)C[C@H]3C(=O)NCc2ccco2)cc1,C11995892_decoy,TRY1,Decoy,0,-8.12695,-7.38,-3.06,-7.589161919445393
CCOc1ccccc1[C@H]1c2[nH]c3ccccc3c2CC[NH+]1Cc1cc2ccccc2[nH]c1=O,C12072509_decoy,TRY1,Decoy,0,-8.17475,-9.17,-1.74,-6.264526506694633
CCOc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(Cl)ccc2O3)cc1,C12293674_decoy,TRY1,Decoy,0,-9.2924,-6.72,-2.26,-5.836116887975381
CCOc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(Cl)ccc2O3)cc1,C12293679_decoy,TRY1,Decoy,0,-8.96083,-6.27,-2.02,-5.894688994346658
CCOc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(F)ccc2O3)cc1,C12293686_decoy,TRY1,Decoy,0,-9.32934,-6.1,-1.79,-5.729278441634622
CCc1ccccc1NC(=S)N(Cc1cccnc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C06286419_decoy,TRY1,Decoy,0,-7.66853,-5.77,-2.16,-5.79031002747251
O=C1Nc2ccc(O)c3c2[C@@]1(CCCC[NH+]1CC=C(c2ccccc2)CC1)CCC3,C13473725_decoy,TRY1,Decoy,0,-7.39862,-6.22,-4.48,-5.260314559434099
[NH3+][C@@H](CC(=O)N1CCc2nc(C(F)(F)F)sc2C1)Cc1cc(F)ccc1F,C14948993_decoy,TRY1,Decoy,0,-7.33598,-7.59,-2.07,-8.17460799926262
O=C(N[C@@H]([NH2+][C@H]1CCS(=O)(=O)C1)C(Cl)(Cl)Cl)c1ccc(Br)cc1,C08672720_decoy,TRY1,Decoy,0,-9.09626,-5.9,-1.53,-6.125712850699684
OCCC#Cc1ccc(C[NH2+][C@@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)cc1,C19228564_decoy,TRY1,Decoy,0,-8.23499,-6.68,-1.43,-5.137051543795492
Clc1ccc(-c2n[nH]cc2CN[C@@H]2CCC[NH+](C3Cc4ccccc4C3)C2)cc1,C20295751_decoy,TRY1,Decoy,0,-8.33986,-7.08,-0.49,-5.633117773291044
Cc1c(Cl)cccc1-n1ncc(C(=O)NCc2ccccc2Cl)c1C1CC[NH2+]CC1,C20941318_decoy,TRY1,Decoy,0,-8.91473,-8.46,-2.68,-8.135281033815714
Cn1c(C(F)(F)F)nc2c1CN(C(=O)C[C@H]([NH3+])Cc1cc(F)ccc1F)CC2,C28956648_decoy,TRY1,Decoy,0,-7.33949,-7.45,-2.52,-10.054614725801814
CCCNC(=O)C[NH2+]Cc1cc(Br)cc(Br)c1OC,C34992512_decoy,TRY1,Decoy,0,-8.59454,-4.32,-4.41,-5.322307262379054
CCc1cccc2c([C@@H](CC(=O)NCC[NH+]3CCCC3)c3ccsc3)c[nH]c12,C35371308_decoy,TRY1,Decoy,0,-9.84898,-6.8,-2.13,-8.308202467252956
COc1cccc(C[NH2+]C23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)c1OCc1ccc(F)cc1,C18179197_decoy,TRY1,Decoy,0,-8.37623,-6.01,-1.73,-5.678333239550349
CC[NH2+]C[C@@H](O)COc1c(Br)cc(Br)cc1Br,C36951233_decoy,TRY1,Decoy,0,-8.40079,-4.52,-1.41,-5.132192430439693
CC[C@@H](C)[NH2+]CC(=O)Nc1c(Br)cc(Br)cc1Br,C37394517_decoy,TRY1,Decoy,0,-7.1259,-5.24,-1.97,-4.699277704146375
CC[NH+]1CCc2c(sc(-n3cccc3)c2[C@H](C)NC(=O)Nc2ccccc2C)C1,C06877453_decoy,TRY1,Decoy,0,-7.59981,-5.25,-1.71,-5.124772937830688
O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1cc(Br)ccc1O,C36684487_decoy,TRY1,Decoy,0,-8.12421,-5.27,-1.53,-5.081416968911813
CC1=CC=CC2=C(C)[C@@H](C[NH+]3CCC(O)(Cc4cc(-c5ccccc5)no4)CC3)N[C@@H]12,C39442202_decoy,TRY1,Decoy,0,-8.84179,-8.84,-1.63,-6.268753187483138
O=C(NCCc1cccs1)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39657244_decoy,TRY1,Decoy,0,-9.62889,-7.01,-2.54,-6.361119604924634
CCC[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C39673561_decoy,TRY1,Decoy,0,-8.86167,-4.05,-1.18,-4.944314228771535
Cc1ccc(C)c(CCNC(=O)[C@H]2CN(C(=O)c3ccc(F)cc3F)CC23CC[NH2+]CC3)c1,C39676909_decoy,TRY1,Decoy,0,-8.40225,-7.39,-1.26,-5.586437581828286
Cc1ccc(C)c(CCNC(=O)[C@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)c1,C39677011_decoy,TRY1,Decoy,0,-8.26939,-6.39,-1.09,-5.694322792095111
C=CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@]2(C)Cc3sc(NC)[nH+]c3[C@@H](C)[C@@H]2[C@@H]1O,C43548290_decoy,TRY1,Decoy,0,-9.82036,-6.88,-1.26,-13.047840014444784
C=CCN(C)C(=O)[C@@H](C)[C@H]1CC[C@]2(C)Cc3sc(NC)[nH+]c3[C@@H](C)[C@@H]2[C@@H]1O,C43548295_decoy,TRY1,Decoy,0,-8.85672,-5.69,-1.18,-5.830780760483866
O=C(NCCc1ccccc1Cl)[C@@H]1CSC[C@H](c2ccc(F)c(F)c2)[NH2+]1,C44167142_decoy,TRY1,Decoy,0,-9.26123,-5.64,-1.35,-5.294569230716508
CCOc1c(Br)cc(C[NH2+][C@H](C)C(=O)NC)cc1Br,C48416724_decoy,TRY1,Decoy,0,-7.98921,-5.27,-3.09,-5.095927460942625
O=C(NCCCn1cc[nH+]c1)Nc1cc(Br)ccc1I,C49030355_decoy,TRY1,Decoy,0,-8.23537,-4.16,-1.39,-5.07084149374887
OCC[NH+]1CCC(c2ccc3c(-c4ccncc4)c(-c4ccc(F)cc4)[nH]c3c2)CC1,C40428717_decoy,TRY1,Decoy,0,-9.03054,-7.33,-0.47,-8.035747663312911
C[C@@H](C(=O)Nc1ccc(F)c(F)c1F)[NH+]1CCC(C(=O)NC2CCCCC2)CC1,C58393467_decoy,TRY1,Decoy,0,-8.15121,-5.63,-0.81,-5.196586592609367
CCc1cccc(C)c1NC(=S)N(Cc1cccnc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59188281_decoy,TRY1,Decoy,0,-7.67828,-5.66,-1.88,-5.388621902237634
C[C@@H]([NH3+])[C@H](Sc1ccc(S(C)(=O)=O)cc1)c1ccc(Br)s1,C63131237_decoy,TRY1,Decoy,0,-10.8081,-4.71,-3.06,-6.0192176056543705
O=C(NCCC1=CC[C@@H](Br)S1)NCCC1=c2ccccc2=[NH+]C1,C64012108_decoy,TRY1,Decoy,0,-9.32137,-7.15,-1.39,-7.1997749383669545
C[C@H](NC(=O)CC1=c2cccc(F)c2=[NH+][C@@H]1C)C1=CNN(c2cccc(F)c2)[C@@H]1C,C64044223_decoy,TRY1,Decoy,0,-8.11956,-7.78,-2.53,-6.489371490049265
C[C@H](NC(=O)CC1=c2cccc(F)c2=[NH+][C@H]1C)C1=CNN(c2cccc(F)c2)[C@@H]1C,C64044224_decoy,TRY1,Decoy,0,-8.43003,-5.72,-1.24,-5.902277821294318
C[C@@H]1[C@@H](C)CCC[C@H]1NC(=O)[C@@H](C)[NH+]1CCC(C(=O)NC2CCCCC2)CC1,C65964832_decoy,TRY1,Decoy,0,-8.28475,-7.29,-3.54,-5.522613438953584
Cc1nn(CCO)c(C)c1C[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1,C67216032_decoy,TRY1,Decoy,0,-8.99101,-6.05,-0.62,-5.712270351156747
C=CCOc1c(Br)cc(C[NH2+]Cc2ccccc2CO)cc1OC,C67247798_decoy,TRY1,Decoy,0,-8.79688,-5.56,-2.43,-5.420763096355398
Cc1cc(Br)ccc1NC(=O)C(=O)N[C@H](C)C[NH+]1CCC[C@H](C)C1,C67397954_decoy,TRY1,Decoy,0,-7.96284,-5.21,-1.35,-4.776831035943623
Cc1cccc2cc(CN(CC[NH+](C)C)C(=S)Nc3ccc(F)cc3)c(=O)[nH]c12,C00880611_decoy,TRY1,Decoy,0,-8.50666,-6.65,-1.17,-7.643651992437534
O=C(C[C@H]1Sc2ccccc2NC1=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C08777804_decoy,TRY1,Decoy,0,-8.55173,-7.43,-1.52,-6.105336771781944
Cn1cccc1[C@H](CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1)[NH+]1CCCC1,C11898248_decoy,TRY1,Decoy,0,-8.52365,-6.01,-1.15,-5.5595603746637625
COc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2ccccc2O3)cc1OC,C12329652_decoy,TRY1,Decoy,0,-8.24224,-5.87,-2.68,-5.186739204456086
CC(=O)NCC[NH2+]Cc1cn(-c2ccc(F)cc2)nc1-c1ccccc1Cl,C12702972_decoy,TRY1,Decoy,0,-7.38668,-6.03,-2.01,-5.512553345342851
O[C@@H]1C[NH+](Cc2c(F)cccc2Cl)CC[C@H]1NCCCN1CCOCC1,C19292587_decoy,TRY1,Decoy,0,-8.76988,-5.32,-4.23,-5.395017924128805
C[C@@H]1Cc2cc([C@H](O)C[NH+]3CCC(O)(c4ccccc4F)CC3)ccc2N1S(C)(=O)=O,C19497853_decoy,TRY1,Decoy,0,-8.04387,-7.36,-2.93,-5.388919486743003
CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H]([NH2+]CC1(O)CCCCC1)C2,C19772139_decoy,TRY1,Decoy,0,-9.45148,-5.48,-2.68,-5.451683287228602
[H]/N=c1\n(CCC[NH+](C)C)c2ccccc2n1C[C@H](O)c1ccc(Br)cc1,C19798725_decoy,TRY1,Decoy,0,-7.96589,-6.68,-2.34,-7.105525433231806
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CN1CCOCC1)Nc1ccc(F)cc1F,C20503786_decoy,TRY1,Decoy,0,-8.75863,-7.43,-1.53,-5.937708628123279
O=c1cc(C[NH+]2CCC(CO)(CCOc3ccccc3)CC2)[nH]c2ccccc12,C20785369_decoy,TRY1,Decoy,0,-8.56373,-5.92,-3.23,-5.517783515491297
O=C(C[C@@H]1Sc2ccccc2NC1=O)Nc1nc(C[NH+]2CCCCC2)cs1,C22290540_decoy,TRY1,Decoy,0,-7.74228,-6.42,-2.62,-6.674537336708256
C[C@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)Cc1cc2c(cc1Br)OCCO2,C28727603_decoy,TRY1,Decoy,0,-9.4999,-6.21,-1.24,-5.6807766749407
CCOc1ccc(N/C(=N\c2ccc(Br)c(C)c2)[n+]2sc(C)cc2N)cc1,C35740014_decoy,TRY1,Decoy,0,-9.39157,-4.48,-1.9,-5.465621979687459
COc1ccccc1[C@]1(O)CCC[NH+](C[C@H](O)c2ccc3c(c2)OCCO3)C1,C36741281_decoy,TRY1,Decoy,0,-7.51848,-8.35,-3.37,-5.645361882883714
Cc1cc(-c2nn(-c3ccccc3F)cc2C[NH+](C)C[C@@H](O)CO)c(C)s1,C12472211_decoy,TRY1,Decoy,0,-8.57927,-5.99,-1.53,-8.338512715905924
CCCCCNC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2)CC12CC[NH2+]CC2,C39623405_decoy,TRY1,Decoy,0,-8.78434,-6.6,-2.36,-5.986345907678036
CCCCNC(=O)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39623844_decoy,TRY1,Decoy,0,-8.51254,-5.18,-2.28,-6.283272314390384
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)NCC(C)C)C3(CC[NH2+]CC3)C2)cc1Cl,C39624651_decoy,TRY1,Decoy,0,-9.30443,-5.57,-1.43,-5.603464882402007
CC[C@H](COC)NC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39638012_decoy,TRY1,Decoy,0,-7.5154,-4.65,-2.41,-5.464918055519761
CCSCCNC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39656497_decoy,TRY1,Decoy,0,-9.27402,-5.15,-1.89,-5.679828551144009
O=C(N[C@@H]1CCSC1=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39661076_decoy,TRY1,Decoy,0,-8.7135,-5.69,-1.35,-6.291219733160284
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H]2CCSC2=O)C2(CC[NH2+]CC2)C1,C39661326_decoy,TRY1,Decoy,0,-8.07899,-5.04,-2.58,-5.600672229561534
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)NCCS)C3(CC[NH2+]CC3)C2)cc1Cl,C39662133_decoy,TRY1,Decoy,0,-9.9582,-4.83,-3.2,-6.088781770403998
O=C(NCCc1ccco1)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39670857_decoy,TRY1,Decoy,0,-9.25515,-6.65,-2.34,-6.145478689449878
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)N[C@@H](C)c2ccncc2)C2(CC[NH2+]CC2)C1,C39681135_decoy,TRY1,Decoy,0,-8.19344,-5.86,-1.59,-6.105263237145893
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)C(C)(C)C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39684632_decoy,TRY1,Decoy,0,-7.53817,-7.44,-1.95,-5.800381365838722
CCC(=O)N1C[C@H](C(=O)N[C@@H](C)Cc2ccccc2OC)C2(CC[NH2+]CC2)C1,C39686526_decoy,TRY1,Decoy,0,-7.70872,-4.82,-2.73,-5.1993717076299415
CCC(=O)N1C[C@H](C(=O)N[C@H](C)Cc2ccccc2OC)C2(CC[NH2+]CC2)C1,C39686528_decoy,TRY1,Decoy,0,-8.58101,-6.22,-2.16,-5.828868901766647
CCc1ccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3cccn3C)CC23CC[NH2+]CC3)cc1,C39696124_decoy,TRY1,Decoy,0,-8.5933,-8.35,-1.81,-6.477121825963733
C[NH+](C)C[C@@H](F)c1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40975239_decoy,TRY1,Decoy,0,-6.63664,-5.68,-0.48,-4.873412437321999
CC(C)[C@H](CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1)N1CC[NH+](C)CC1,C41329877_decoy,TRY1,Decoy,0,-8.52132,-6.53,-1.98,-5.836235715859846
C#CCN(C)C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=S)Nc1ccc(N(C)C)cc1,C43527681_decoy,TRY1,Decoy,0,-9.28565,-5.76,-2.06,-5.668098741546032
C[C@@H]1CCCC[NH+]1[C@@H](C)CNC(=O)C(=O)Nc1sc2c(c1C#N)CCCC2,C47998951_decoy,TRY1,Decoy,0,-10.4186,-7.18,-2.07,-7.403241626661186
Cc1cc(I)ccc1NC(=O)C(=O)NCCC[NH+](C)C,C48490698_decoy,TRY1,Decoy,0,-8.41979,-4.56,-1.15,-5.133592243026662
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccccc1SC(F)F)c1cccs1,C48743961_decoy,TRY1,Decoy,0,-8.81565,-7.05,-1.41,-6.977404075282339
C[NH+](C)Cc1ccccc1CNC(=O)C(=O)Nc1ccccc1SC(F)F,C49269652_decoy,TRY1,Decoy,0,-6.67282,-7.22,-2.05,-7.284285001332478
O=C(NCc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1ccc(F)c(F)c1,C49395411_decoy,TRY1,Decoy,0,-8.59365,-7.91,-1.8,-6.867434207043442
Cc1ncsc1C(=O)NC1CC[NH+]([C@H](C)C(=O)c2c[nH]c3ccccc23)CC1,C51099910_decoy,TRY1,Decoy,0,-6.27931,-7.11,-1.76,-4.77750989981208
C[C@@H](C(=O)Nc1ccccc1SC(F)F)[NH+]1CCC(C(=O)NC2CC2)CC1,C55913030_decoy,TRY1,Decoy,0,-6.88529,-4.75,-2.44,-4.505995605766066
O=C(NC[C@@H]1COc2ccccc2O1)NC[C@@H](c1cccs1)[NH+]1CCCC1,C58467373_decoy,TRY1,Decoy,0,-8.51106,-7.93,-1.79,-8.063569220805755
Cc1sc2[nH]c(CCC(=O)NC[C@@H]3CCC[NH+](C(C)C)C3)nc(=O)c2c1C,C60319238_decoy,TRY1,Decoy,0,-9.02562,-8.03,-1.5,-6.778938615007305
Cc1cc(I)ccc1NC(=O)C(=O)NCCn1cc[nH+]c1,C48917999_decoy,TRY1,Decoy,0,-7.17143,-5.28,-1.62,-5.382916414716271
O=C(NC[C@@H](c1ccco1)[NH+]1CCCCCC1)c1cc2ccc(F)cc2[nH]c1=O,C62356499_decoy,TRY1,Decoy,0,-8.20334,-6.26,-1.23,-4.871790910424653
CC(=O)Nc1ccc(C(F)(F)F)cc1NCc1cc(=O)n2c(C)csc2[nH+]1,C64398603_decoy,TRY1,Decoy,0,-6.70226,-6.91,-1.58,-5.222780259184932
CC[NH+]1CCN(c2ccc(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc2F)CC1,C66309260_decoy,TRY1,Decoy,0,-7.32761,-7.63,-1.64,-6.292377180681645
O=C(NC1CC[NH+](C[C@H](O)c2ccc3c(c2)OCCO3)CC1)c1ccsc1,C66471654_decoy,TRY1,Decoy,0,-8.4991,-6.15,-0.76,-5.193059509824545
CC(C)[C@H]1C(=O)NCCN1Cc1ccc(C[NH+]2CCNC(=O)[C@@H]2C(C)C)cc1,C66498685_decoy,TRY1,Decoy,0,-8.72989,-6.91,-4.19,-6.087714607900158
NC(=O)[C@H]1CCCC[NH+]1CC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1,C66563542_decoy,TRY1,Decoy,0,-9.06641,-6.25,-1.82,-5.545593842630619
Cc1occc1C(=O)NC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2Cl)CC1,C66890906_decoy,TRY1,Decoy,0,-7.80742,-5.82,-0.56,-5.402081176985392
CCOC(=O)[C@](NC(=O)c1ccccc1Cl)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C02050093_decoy,TRY1,Decoy,0,-8.18011,-5.98,-2.75,-5.9386751087349126
CCOC(=O)[C@@](NC(=O)c1ccccc1Cl)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C02050094_decoy,TRY1,Decoy,0,-9.02276,-6.63,-1.88,-8.184684410756672
CCOc1ccccc1C(=O)NC(Nc1sc2c(c1C(N)=O)CCCC2)(C(F)(F)F)C(F)(F)F,C02050098_decoy,TRY1,Decoy,0,-8.51841,-6.36,-2.62,-6.122340478003703
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCc1cccnc1,C03841837_decoy,TRY1,Decoy,0,-9.08284,-7.91,-2.72,-7.878131834857672
CCN(CC)c1ccc(/C=C(/NC(=O)c2ccccc2Cl)C(=O)N/N=C/c2ccc(O)cc2O)cc1,C08386409_decoy,TRY1,Decoy,0,-10.1874,-6.31,-2.1,-7.83025891176316
CC(=O)Nc1ccc(/C(C)=N\Nc2nc(Nc3ccc([N+](=O)[O-])cc3)nc(Nc3ccc(C)c(C)c3)n2)cc1,C08872802_decoy,TRY1,Decoy,0,-9.11505,-9.85,-2.6,-8.300410310208507
CCc1c(C)sc(NC(=S)NC(=O)c2cc(Br)ccc2OCC(C)C)c1C(N)=O,C10150059_decoy,TRY1,Decoy,0,-10.4027,-5.23,-4.66,-6.589583229203137
FC(F)Oc1ccc(NC(=S)NC2CCC(NC(=S)Nc3ccc(OC(F)F)cc3)CC2)cc1,C12620468_decoy,TRY1,Decoy,0,-8.75512,-6.12,-2.14,-5.823143247153049
CCCCOc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCCC3)cc1Br,C14041366_decoy,TRY1,Decoy,0,-11.3893,-6.15,-3.09,-7.10874928855092
COCCOc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCCC3)cc1Br,C14661919_decoy,TRY1,Decoy,0,-11.2081,-6.09,-3.37,-7.32402903977992
COc1cc(/C=N/Nc2nc(Nc3ccc([N+](=O)[O-])cc3)nc(Nc3ccc(C)c(C)c3)n2)ccc1O,C15134995_decoy,TRY1,Decoy,0,-9.19063,-9.41,-2.62,-7.892188711629637
COc1ccc(Br)cc1/C=C/C(=O)NC(=S)Nc1ccc(NC(=S)NC(C)=O)cc1,C16320848_decoy,TRY1,Decoy,0,-10.7259,-6.25,-2.09,-6.571991310145702
CCc1cccc(C)c1NC(=S)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccccc1F,C16782511_decoy,TRY1,Decoy,0,-9.7667,-6.6,-4.12,-8.137124933257502
C[NH+](CCc1ccccn1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH+](Cc1ccc(F)cc1)Cc1ccc(F)cc1,C20464719_decoy,TRY1,Decoy,0,-7.0104,-7.02,-2.55,-6.942883562298727
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)Nc2ccc(OC(F)(F)F)cc2)n1N,C20912070_decoy,TRY1,Decoy,0,-9.26812,-6.54,-4.95,-6.470632621168506
O=C(CCSc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1)Nc1cccc(N2CCCC2=O)c1,C21080521_decoy,TRY1,Decoy,0,-10.1339,-8.94,-3.88,-9.257946928967517
Cc1cc(C)nc(N/C(=N/C(=S)NCCCN2CCOCC2)NCCc2c[nH]c3ccc(F)cc23)n1,C14158835_decoy,TRY1,Decoy,0,-9.04753,-6.47,-1.27,-6.523647909009121
O[C@@H](C[NH2+]Cc1ccccc1)COc1ccc(Cc2ccc(OC[C@@H](O)C[NH2+]Cc3ccccc3)cc2)cc1,C26897943_decoy,TRY1,Decoy,0,-8.4977,-7.62,-4.94,-6.712688339361779
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=S)N[C@H](NC(C)=O)C(Cl)(Cl)Cl,C34966505_decoy,TRY1,Decoy,0,-8.71822,-4.88,-2.74,-6.042229892010496
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=S)N[C@@H](NC(C)=O)C(Cl)(Cl)Cl,C34966506_decoy,TRY1,Decoy,0,-8.60903,-5.35,-3.31,-5.81870313701716
CCC(=O)N(Cc1ccco1)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36506953_decoy,TRY1,Decoy,0,-9.54246,-8.44,-2.14,-7.615518644193549
CCCCC(=O)N(c1ccccc1Cl)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36550686_decoy,TRY1,Decoy,0,-7.68146,-5.27,-2.07,-6.116454893990707
Cc1ccc(CN(C(=O)C2CCCCC2)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36555806_decoy,TRY1,Decoy,0,-8.61182,-7.89,-2.56,-10.50527117091277
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)/C(=C/c1ccccc1)c1ccccc1,C36559611_decoy,TRY1,Decoy,0,-8.42529,-6.02,-3.39,-7.123016891523662
Cc1ccc(CN(C(=O)c2c(O)cccc2O)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccccc2O)o1,C36597494_decoy,TRY1,Decoy,0,-6.69719,-6.02,-5.24,-5.898266641872421
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccccc2O)o1,C36597710_decoy,TRY1,Decoy,0,-7.67672,-6.15,-4.58,-6.332022367540056
Cc1ccc(CN(C(=O)C[C@@H](C)c2ccccc2)[C@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36598526_decoy,TRY1,Decoy,0,-9.03899,-6.43,-1.34,-7.222829636142307
Cc1ccc(CN(C(=O)C[C@@H](C)c2ccccc2)[C@@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36598527_decoy,TRY1,Decoy,0,-9.25846,-6.28,-3.34,-6.826962140317686
Cc1ccc(CN(C(=O)C[C@H](C)c2ccccc2)[C@@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36598529_decoy,TRY1,Decoy,0,-7.85098,-6.57,-3.2,-5.883785612460505
C/C(NCCCCCCCCCCCCN/C(C)=C1/SC(=S)NC1=O)=C1\SC(=S)NC1=O,C20032678_decoy,TRY1,Decoy,0,-12.2502,-5.97,-2.3,-7.936877559880449
COc1ccc(Nc2nc(NCc3ccco3)nc(N/[NH+]=C/c3cc(Cl)cc(Cl)c3[O-])n2)cc1,C06156939_decoy,TRY1,Decoy,0,-10.1556,-8.02,-1.34,-7.4403427975873555
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2)C(C)C,C39634829_decoy,TRY1,Decoy,0,-10.3169,-6.16,-2.52,-8.894106871835154
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2)C(C)C,C39634830_decoy,TRY1,Decoy,0,-9.04682,-6.74,-2.45,-6.6377077976276135
Cc1ccc(Oc2ncccc2C(=O)N2C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)cc1,C39634832_decoy,TRY1,Decoy,0,-9.41989,-8.17,-1.59,-9.996558802204229
COc1ccc([C@@H](CNC(=O)[C@@H]2CN(C(=O)c3ccccc3OC(C)=O)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663678_decoy,TRY1,Decoy,0,-8.23919,-7.37,-3.8,-5.842681411876582
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39663795_decoy,TRY1,Decoy,0,-9.06978,-6.15,-3.4,-6.240222978414309
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)NC[C@H](c2ccc(OC)cc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39663798_decoy,TRY1,Decoy,0,-9.58567,-7.25,-4.05,-7.164026232584007
COc1ccc(Nc2nc(N/N=C/c3cc(Cl)ccc3O)nc(Nc3ccc([N+](=O)[O-])cc3)n2)cc1,C08872718_decoy,TRY1,Decoy,0,-9.25947,-6.25,-3.28,-5.816323214631271
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1cccc(Cl)c1Cl)c1ccccc1,C36610528_decoy,TRY1,Decoy,0,-7.5682,-6.03,-3.74,-6.054745492996201
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)cc3Br)n[nH]2)c1O,C58998280_decoy,TRY1,Decoy,0,-10.17,-8.07,-3.72,-7.169120348242579
CCOc1ccc(NC(=S)NC[C@]2(C)C[C@H](NC(=S)Nc3ccc(OCC)cc3)CC(C)(C)C2)cc1,C59113468_decoy,TRY1,Decoy,0,-10.6634,-6.04,-1.87,-6.414132062749005
CCOc1ccc(NC(=S)NC[C@@]2(C)C[C@H](NC(=S)Nc3ccc(OCC)cc3)CC(C)(C)C2)cc1,C59113470_decoy,TRY1,Decoy,0,-10.6306,-5.81,-2.38,-6.564825847205587
CCOc1ccc(NC(=S)NC[C@]2(C)C[C@@H](NC(=S)Nc3ccc(OCC)cc3)CC(C)(C)C2)cc1,C59113472_decoy,TRY1,Decoy,0,-9.88162,-7.19,-3.15,-6.705705742024107
CCOc1ccccc1NC(=S)NC[C@@]1(C)C[C@H](NC(=S)Nc2ccccc2OCC)CC(C)(C)C1,C59113988_decoy,TRY1,Decoy,0,-10.4586,-5.87,-3.09,-6.6597732348219525
CCOc1ccccc1NC(=S)NC[C@]1(C)C[C@@H](NC(=S)Nc2ccccc2OCC)CC(C)(C)C1,C59113989_decoy,TRY1,Decoy,0,-9.50113,-7.15,-4.98,-6.8237357354831705
CCOc1ccccc1NC(=S)NC[C@@]1(C)C[C@@H](NC(=S)Nc2ccccc2OCC)CC(C)(C)C1,C59113991_decoy,TRY1,Decoy,0,-9.97325,-5.57,-2.86,-7.325848711994257
COc1ccc(NC(=S)NC[C@@]2(C)C[C@H](NC(=S)Nc3ccc(OC)cc3)CC(C)(C)C2)cc1,C59114014_decoy,TRY1,Decoy,0,-10.5936,-5.83,-2.16,-6.134935851800391
COC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)C[NH+]1CC[C@@]2(O)CCCC[C@H]2[C@@H]1c1ccccc1OC,C63351342_decoy,TRY1,Decoy,0,-9.18332,-8.38,-1.65,-8.564629158861951
CC[C@H](S[C@@H]1[NH+]=c2ccccc2=C2[NH+]=C(CCC3=C(C)N=N[C@@H]3C)NN21)C(=O)NCc1ccc(C)cc1,C63708256_decoy,TRY1,Decoy,0,-10.1172,-8.32,-3.01,-9.530283159716312
CC[C@H](S[C@H]1[NH+]=c2ccccc2=C2[NH+]=C(CCC3=C(C)N=N[C@@H]3C)NN21)C(=O)NCc1ccc(C)cc1,C63708260_decoy,TRY1,Decoy,0,-9.55172,-7.3,-2.55,-7.912505033481072
CCCCN(C(=O)C1=CCC(=O)N(c2ccccc2)N1)c1c(N)n(CCC)c(=O)[nH]c1=O,C03433619_decoy,TRY1,Decoy,0,-6.51582,-5.35,-2.51,-5.707732108018891
CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1,C09223043_decoy,TRY1,Decoy,0,-8.62956,-5.45,-0.9,-5.815359826127826
CC(C)C(=O)Nc1ccc(C(=O)NNC(=S)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C09229871_decoy,TRY1,Decoy,0,-8.9863,-7.32,-2.79,-6.477931682396316
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1,C09255625_decoy,TRY1,Decoy,0,-7.38223,-6.23,-3.46,-5.314373858957953
CC(C)C[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)O[C@H](C(=O)NC(N)=O)C(C)C,C10850013_decoy,TRY1,Decoy,0,-8.18449,-6.55,-0.64,-7.551032667740864
CC(C)C[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C,C10850020_decoy,TRY1,Decoy,0,-8.35482,-6.99,-1.87,-6.234981968700184
CCCCCN(C(=O)CCC(=O)Nc1cccc(C)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C12459393_decoy,TRY1,Decoy,0,-7.98468,-7.04,-3.77,-7.739208225810796
COC(=O)CCC(=O)NC(=S)NNC(=O)CCC(=O)Nc1ccc(Cl)cc1Cl,C12500836_decoy,TRY1,Decoy,0,-8.92278,-6.79,-3.73,-7.421732050440759
CCc1cc2c(=O)c(-c3nc(C)cs3)coc2cc1O[C@@H](C)C(=O)N[C@H](CC(C)C)C(=O)NCC(N)=O,C12654131_decoy,TRY1,Decoy,0,-9.40775,-7.91,-3.25,-7.695662750967885
CNS(=O)(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)ccc1Cl,C13010931_decoy,TRY1,Decoy,0,-8.8452,-6.43,-1.66,-5.66946203392643
CCCCn1c(N)c(N(CCOC)C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)c(=O)[nH]c1=O,C14624290_decoy,TRY1,Decoy,0,-8.00754,-5.68,-3.1,-5.911110018916256
CCCC1=C(C(=O)OCC)[C@@H](c2cc(Cl)c(OCC(N)=O)c(OCC)c2)NC(=O)N1,C16382574_decoy,TRY1,Decoy,0,-9.0068,-4.33,-3.76,-5.829659768035827
CCOC(=O)N[C@@](Nc1sc2c(c1C(N)=O)CCCC2)(C(=O)OCC)C(F)(F)F,C02270318_decoy,TRY1,Decoy,0,-9.11116,-4.34,-2.13,-5.812057672291881
CC(=O)N[C@@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C(C)C,C17576796_decoy,TRY1,Decoy,0,-8.58909,-7.18,-4.4,-7.781783650217036
CC(=O)Nc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2ccc(C)cc2)n1,C20908188_decoy,TRY1,Decoy,0,-8.40016,-8.41,-4.56,-7.194151837445698
Nn1c(N/N=C/c2cccc3ccccc23)nnc1SCCC(=O)NCc1ccco1,C20912917_decoy,TRY1,Decoy,0,-9.43862,-8.57,-2.06,-12.08254861198527
Cc1cc(Cl)ccc1NC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20920635_decoy,TRY1,Decoy,0,-9.36138,-7.58,-1.46,-6.693483085457518
C/C(=N\Nc1nc(SCC(=O)NNC(=O)c2ccc(Cl)cc2)n[nH]1)c1ccccn1,C20923650_decoy,TRY1,Decoy,0,-9.40303,-7.66,-2.64,-9.27115949288708
Cc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)cc1,C20924058_decoy,TRY1,Decoy,0,-9.22848,-7.6,-2.13,-6.979585248249411
COCCOC(=O)c1c(NC(=O)CNc2ccc(C(=O)OC)cc2C)sc(C(N)=O)c1C,C25524252_decoy,TRY1,Decoy,0,-9.11264,-6.3,-3.99,-7.529504042354931
CC(C)Cn1c(N)c(C(=O)CSc2nnc(NC3CCCCC3)s2)c(=O)[nH]c1=O,C10580170_decoy,TRY1,Decoy,0,-7.8284,-7.14,-2.17,-5.390845634800047
CCCCOc1ccc(C(=O)NCC(=O)Nc2nc(C)c(SCC(N)=O)s2)cc1,C30709422_decoy,TRY1,Decoy,0,-11.3621,-7.87,-2.47,-8.485969776708538
CC[C@@H](C)n1c(COc2ccccc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594332_decoy,TRY1,Decoy,0,-7.1242,-7.26,-3.78,-7.24713758595302
CC[C@H](C)n1c(COc2ccccc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594333_decoy,TRY1,Decoy,0,-5.81455,-6.24,-4.61,-6.071588346333204
CCOc1ccc(/C=C2\SC(=O)N(CCNC(=O)C[C@@H](NC(N)=O)c3ccccc3C)C2=O)cc1OC,C32796462_decoy,TRY1,Decoy,0,-8.03837,-7.36,-3.01,-6.667173234816666
CCOc1ccccc1NC(=O)/C(=N/NC(N)=S)[C@@H]1C(=O)N(c2ccccc2)N=C1C,C33590982_decoy,TRY1,Decoy,0,-7.45528,-5.37,-0.79,-5.530327681151165
CCCCNC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500711_decoy,TRY1,Decoy,0,-8.31282,-5.47,-2.83,-6.092350010931507
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1ccco1,C36595770_decoy,TRY1,Decoy,0,-8.97762,-5.63,-2.54,-6.927775762370613
C=CCn1c(CNc2ccccc2)nnc1SCC(=O)N/N=C/c1ccc(O)cc1O,C00695485_decoy,TRY1,Decoy,0,-9.50375,-8.68,-3.66,-7.986640395052885
COc1ccc(C(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(OC)cc4)N=N3)N2N)cc1,C38748317_decoy,TRY1,Decoy,0,-9.64311,-8.93,-2.07,-8.386657611217725
COc1ccc(C(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(OC)cc4)N=N3)N2N)cc1,C38748319_decoy,TRY1,Decoy,0,-10.399,-8.45,-1.73,-11.171334058969878
CCOc1ccccc1CN(C[C@@H](C)O)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1,C40138977_decoy,TRY1,Decoy,0,-8.68555,-6.77,-0.62,-6.962973187164592
Cc1ccc(NC(=O)NC(=O)[C@@H](C)Sc2nnc(-c3ccco3)n2CCC(N)=O)c(C)c1,C45850383_decoy,TRY1,Decoy,0,-9.66865,-8.45,-3.04,-11.469843256664848
CC(=O)Nc1nc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cs1,C46766389_decoy,TRY1,Decoy,0,-8.7771,-6.9,-3.42,-5.689304278109045
C[C@@H](NC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C12CC3CC(CC(C3)C1)C2,C28994847_decoy,TRY1,Decoy,0,-9.03394,-7.84,-1.87,-7.192479983261105
CCOC(=O)C1=C(COC(=O)c2c(C)noc2N)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C58669427_decoy,TRY1,Decoy,0,-9.04192,-6.48,-4.28,-6.101108388102157
C=CCc1cccc(/C=N/NC(=O)CCCSc2nnc(-c3ccncc3)n2N)c1O,C58988387_decoy,TRY1,Decoy,0,-9.05764,-7.58,-3.15,-7.015806134155243
CCN(CC)c1ccc(/C=N/NC(=O)CSc2nnc(-c3ccncc3)n2N)c(O)c1,C58991822_decoy,TRY1,Decoy,0,-9.56491,-6.86,-1.23,-6.818435106651168
CCOc1cc(/C=N/NC(=O)CCCSc2nnc(-c3ccncc3)n2N)ccc1O,C58992045_decoy,TRY1,Decoy,0,-9.40073,-6.29,-1.9,-5.997382633036751
O=C(CSc1n[nH]c(N/N=C/c2c[nH]c3ccccc23)n1)NCc1ccc2c(c1)OCO2,C59006478_decoy,TRY1,Decoy,0,-9.55577,-8.92,-2.11,-7.717179596443682
Nc1nnc(SCC(=O)NCCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1,C59447219_decoy,TRY1,Decoy,0,-6.31341,-7.31,-3.36,-6.190282179495627
CCNC(=O)c1ccc(Cl)cc1NCC(=O)c1c(N)n(CC(C)C)c(=O)n(C)c1=O,C59804707_decoy,TRY1,Decoy,0,-8.32865,-6.59,-3.23,-6.2908400803508
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3Cl)n2)cc1,C59814413_decoy,TRY1,Decoy,0,-9.43066,-9.27,-4.75,-9.09565769254598
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(Cl)c3)n2)cc1,C59819096_decoy,TRY1,Decoy,0,-9.82888,-6.46,-2.21,-6.066010135801043
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NNC(=O)C1CCC1,C59879212_decoy,TRY1,Decoy,0,-9.31083,-5.69,-1.24,-5.513553644970136
Cc1ccccc1Nc1nc(N)nc(COC(=O)CNS(=O)(=O)/C=C/c2ccccc2)n1,C23597464_decoy,TRY1,Decoy,0,-8.18516,-6.44,-3.14,-6.01845814993107
C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C23868442_decoy,TRY1,Decoy,0,-7.98492,-6.76,-3.41,-6.866726993343352
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C23868440_decoy,TRY1,Decoy,0,-7.39701,-7.92,-3.38,-6.053685801539462
NC(=O)CSC1=N[C@@H](c2ccccc2)N2C(SCC(N)=O)=N[C@H](c3ccccc3)N12,C13773719_decoy,TRY1,Decoy,0,-9.64509,-5.37,-1.94,-6.992863717483165
O=C(CS[C@H]1NN=NN1c1ccc(O)cc1)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C64684495_decoy,TRY1,Decoy,0,-7.55335,-8.42,-2.13,-6.72274856898731
COCCNC(=O)C[C@@H]1c2nc(NC(=O)c3ccc(C(C)(C)C)cc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222343_decoy,TRY1,Decoy,0,-10.0746,-7.14,-1.44,-6.95992042942195
COc1ccccc1CNC(=O)C[C@@H]1[C@H](O)CC[C@H]2[C@](C)(CO)[C@H](OC(=O)Nc3cccc(F)c3)CC[C@]21C,C04236745_decoy,TRY1,Decoy,0,-9.51709,-8.14,-2.36,-7.647954688253828
Nc1ccc(/C=C/c2ccc(N)cc2OS(=O)(=O)c2ccccc2)c(OS(=O)(=O)c2ccccc2)c1,C04235248_decoy,TRY1,Decoy,0,-8.55373,-7.81,-1.11,-16.283671758160008
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccc(C)cc2)ccc1O,C01828184_decoy,TRY1,Decoy,0,-10.2523,-7.43,-4.22,-7.549545296974645
COc1cc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CC[C@@H](C(C)(C)C)C3)cc(OC)c1OC,C09668113_decoy,TRY1,Decoy,0,-9.16172,-6.26,-2.62,-7.7212026359597425
CCOc1ccc([C@H]2NC(=O)N[C@H](c3ccc(OCC)c(OC)c3)C23C(=O)NC(=O)NC3=O)cc1OC,C09941897_decoy,TRY1,Decoy,0,-8.39051,-6.04,-3.16,-6.798771008169284
CC(=O)N[C@@H]1[C@@H](O/N=C2/C(=O)N(CCOc3ccc(C)cc3)c3ccc(C)cc32)O[C@H](CO)[C@H](O)[C@@H]1O,C12636393_decoy,TRY1,Decoy,0,-7.15869,-8.48,-2.18,-5.919397020337493
O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1NNC(=S)Nc1ccccc1F,C16218955_decoy,TRY1,Decoy,0,-7.63739,-5.5,-3.61,-5.424449508348205
CCOc1ccc(OCc2nnc(SCc3nc(N)nc(N)n3)n2-c2ccc(C)c(Cl)c2)cc1,C17672715_decoy,TRY1,Decoy,0,-10.4921,-8.3,-3.28,-10.363968183085213
COc1ccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)NNC(=S)NC[C@@H]4CCCO4)c3N2)cc1,C20613831_decoy,TRY1,Decoy,0,-9.09171,-5.8,-3.76,-6.054596285473448
CC(C)c1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)NNC(=S)NC[C@@H]4CCCO4)cc3N2)cc1,C20613865_decoy,TRY1,Decoy,0,-10.3173,-7.94,-3.55,-6.7168320599418365
CC(C)c1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)NNC(=S)NC[C@@H]4CCCO4)cc3N2)cc1,C20613867_decoy,TRY1,Decoy,0,-10.1224,-8.15,-1.46,-6.893081875556787
CC(C)c1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)NNC(=S)NC[C@@H]4CCCO4)cc3N2)cc1,C20613868_decoy,TRY1,Decoy,0,-10.0152,-7.07,-2.73,-6.523002249141981
CCOc1ccc2nc(NC(=O)CSc3n[nH]c(N/N=C/c4cc(Cl)ccc4O)n3)sc2c1,C20834771_decoy,TRY1,Decoy,0,-10.5545,-9.1,-3.56,-10.873373264845505
CCCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cccc(O)c4)n3)cc2s1,C20906503_decoy,TRY1,Decoy,0,-9.08249,-8.91,-3.0,-7.932385370632708
C=CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cccc(O)c4)n3)cc2s1,C20906517_decoy,TRY1,Decoy,0,-9.71242,-6.04,-3.07,-6.212501497239504
CCOC(=O)c1c(NC(=O)CCSc2nnc(N/N=C/c3ccc(C)cc3)n2N)sc2c1CCCC2,C20918144_decoy,TRY1,Decoy,0,-10.4359,-8.99,-1.75,-8.060668348852516
C/C(=N\Nc1nc(SCC(=O)NNC(=O)c2ccc(Cl)cc2)n[nH]1)C12CC3CC(CC(C3)C1)C2,C20923801_decoy,TRY1,Decoy,0,-9.27395,-7.02,-3.11,-7.330827853871384
C=CCc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3ccc(Br)cc3)n[nH]2)c1O,C21075914_decoy,TRY1,Decoy,0,-10.09,-7.52,-3.33,-7.532738455255852
O=C(CCSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)Nc1ccccc1Cl,C21080076_decoy,TRY1,Decoy,0,-10.4043,-8.09,-2.05,-7.5105155936112915
CCOc1cc(/C=N/Nc2nc(SCCC(=O)Nc3cc(Cl)ccc3Cl)n[nH]2)ccc1O,C21084025_decoy,TRY1,Decoy,0,-10.8039,-7.28,-4.01,-7.6038941011387235
CCOc1cc(/C=N/Nc2nc(SCCC(=O)Nc3c(Cl)cccc3Cl)n[nH]2)ccc1O,C21084030_decoy,TRY1,Decoy,0,-10.4458,-6.65,-2.51,-6.490217477110241
Nn1c(NN=C2CCCC2)nnc1SCC(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C21327792_decoy,TRY1,Decoy,0,-10.628,-7.67,-1.74,-7.080864208865159
Cc1ccc(Nc2nc(C)c(C(/C=C/c3ccc([N+](=O)[O-])cc3)=N/NC(=O)C(N)=O)s2)c([N+](=O)[O-])c1,C25574075_decoy,TRY1,Decoy,0,-9.02985,-7.46,-4.23,-8.156811026145764
COc1cc([C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccco2)C(=O)c2c(O)cccc2O)ccc1O,C36500685_decoy,TRY1,Decoy,0,-8.39416,-5.58,-3.79,-6.05923831094189
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500709_decoy,TRY1,Decoy,0,-7.54152,-7.16,-3.59,-6.466465413405348
CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36528103_decoy,TRY1,Decoy,0,-7.93265,-4.9,-3.1,-5.73392485927874
Cc1ccc(CN(C(=O)c2ccco2)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36595767_decoy,TRY1,Decoy,0,-7.95013,-8.02,-4.73,-11.357583196525498
Cc1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36603025_decoy,TRY1,Decoy,0,-8.48742,-5.85,-2.91,-6.4940350743894495
O=C(CCCCCC(=O)N/N=C1/C(=O)Nc2ccc(Cl)cc21)N/N=C1\C(=O)Nc2ccc(Cl)cc21,C09871743_decoy,TRY1,Decoy,0,-9.47342,-7.38,-4.07,-7.362673579329127
CC(C)[C@@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C39611768_decoy,TRY1,Decoy,0,-8.88483,-6.11,-2.68,-6.462684986528459
CC(C)(C)c1ccc(OCCCn2c(S[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)nc3ccccc32)cc1,C39916021_decoy,TRY1,Decoy,0,-7.41795,-8.7,-1.09,-6.504106336010793
O=C(NNc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1,C40658418_decoy,TRY1,Decoy,0,-8.78135,-7.31,-3.66,-7.2834305697434365
NC(=O)c1c(Nc2nc(NCCN3CCOCC3)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026285_decoy,TRY1,Decoy,0,-10.9963,-7.43,-3.46,-7.221419796994545
COCCNC(=O)C[C@@H]1c2nc(NC(=O)c3ccc(F)cc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553478_decoy,TRY1,Decoy,0,-9.84774,-7.72,-1.76,-8.437540690318086
C=CCOC(=O)[C@H]1O[C@H](OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)[C@@H](O)[C@H](O)[C@@H]1O,C44019941_decoy,TRY1,Decoy,0,-7.18244,-7.41,-3.0,-5.931809690348547
C=C1C[C@](O)(c2ccccc2)N(C(=O)CSc2nnc(SCC(=O)N3NC(C)=C[C@]3(O)c3ccccc3)s2)N1,C01655007_decoy,TRY1,Decoy,0,-9.77815,-6.87,-3.86,-6.40150522043912
COC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)CONC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@]2(O)C(C)=O,C01877147_decoy,TRY1,Decoy,0,-10.3442,-8.96,-3.38,-8.97546693593599
Cc1ccccc1Nc1nc(N)nc(COC(=O)CCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)n1,C09463457_decoy,TRY1,Decoy,0,-8.97368,-8.53,-1.51,-6.664541582906627
Cc1cc(Br)ccc1NC(=O)CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1,C58997364_decoy,TRY1,Decoy,0,-9.68797,-6.4,-5.0,-5.629294495000424
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)NCc1ccc(Cl)c(Cl)c1,C58997406_decoy,TRY1,Decoy,0,-9.30664,-8.6,-4.35,-8.507862325362812
Cc1cc(NC(=O)CSc2n[nH]c(N/N=C/c3cc([N+](=O)[O-])ccc3O)n2)ccc1Br,C58997556_decoy,TRY1,Decoy,0,-9.34786,-6.87,-2.74,-6.742601387136981
C=CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4ccc(O)cc4)n3)cc2s1,C59015489_decoy,TRY1,Decoy,0,-11.6685,-8.68,-2.48,-8.766703246997318
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)Nc1ccccc1[N+](=O)[O-],C59016938_decoy,TRY1,Decoy,0,-8.39324,-7.79,-1.8,-7.014111610466858
CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59017013_decoy,TRY1,Decoy,0,-10.8713,-7.58,-4.54,-7.298431159589321
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(Br)c3)n[nH]2)c(O)c1,C59039026_decoy,TRY1,Decoy,0,-10.1638,-5.15,-4.23,-5.014565420439956
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(F)c(Cl)c3)n[nH]2)c(O)c1,C59039144_decoy,TRY1,Decoy,0,-10.4676,-6.47,-0.96,-8.713596244631535
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3sc4c(c3C#N)CCCC4)n[nH]2)c(O)c1,C59039184_decoy,TRY1,Decoy,0,-10.3501,-7.19,-2.82,-7.13881684852974
C=CCNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Br)cc(Br)c2O)n1,C59819206_decoy,TRY1,Decoy,0,-10.4974,-7.51,-2.67,-9.432552535901667
CCC/C(C)=N/Nc1nnc(SCC(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)n1N,C59915190_decoy,TRY1,Decoy,0,-9.96601,-7.63,-3.17,-6.829619341026088
Cc1ccc(NC(=O)O[C@@H]2CC[C@]3(C)[C@H](CC[C@@H](O)[C@H]3CC(=O)NCc3ccco3)[C@]2(C)CO)cc1,C04236709_decoy,TRY1,Decoy,0,-8.96272,-6.2,-3.01,-6.694040292571362
C#CCNC(=O)C[C@@H]1c2nc(Nc3cc(OC)ccc3OC)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03841631_decoy,TRY1,Decoy,0,-10.3897,-6.4,-3.87,-6.888229441851713
Cc1c(CC(=O)NC[C@H](CC(=O)NC(C)C)c2ccc(Cl)cc2)c(=O)oc2cc(O)cc(O)c12,C09306524_decoy,TRY1,Decoy,0,-10.354,-7.68,-2.21,-7.803888834719278
O=[N+]([O-])c1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1NNC(=S)NC[C@@H]1CCCO1,C09631057_decoy,TRY1,Decoy,0,-8.23046,-6.7,-3.47,-5.69899243813646
C[C@H](SCc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C(=O)Nc1nc(CC(N)=O)cs1,C09910170_decoy,TRY1,Decoy,0,-10.9739,-8.45,-3.58,-7.695869716904998
Cc1ccc(S(=O)(=O)NCCNC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1,C12545942_decoy,TRY1,Decoy,0,-7.7335,-6.5,-4.61,-5.907810726997556
COc1ccc2[nH]cc(CCN/C(=N\C(=S)NC[C@@H]3CCCO3)Nc3nc(C)cc(C)n3)c2c1,C14158486_decoy,TRY1,Decoy,0,-9.05442,-7.34,-1.65,-7.702777070556756
CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)O[C@H](C)C(=O)Nc1sccc1C(N)=O,C16819439_decoy,TRY1,Decoy,0,-8.49263,-6.24,-2.82,-6.283796287062199
O=C(NNC(=S)NCc1ccco1)c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(Cl)cc1)N2,C02793652_decoy,TRY1,Decoy,0,-8.78047,-8.25,-1.15,-7.03375572791877
O=C(NNC(=S)NCc1ccco1)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc(Cl)cc1)N2,C02793651_decoy,TRY1,Decoy,0,-9.03521,-7.47,-1.62,-7.49351121876686
COc1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2N)cc(OC)c1OC,C20827178_decoy,TRY1,Decoy,0,-8.36005,-7.43,-3.42,-6.4526216625995785
O=C(CCSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1ccc(I)cc1,C20906661_decoy,TRY1,Decoy,0,-10.3049,-7.34,-1.95,-7.235744237519525
COc1cc(/C=N/Nc2nnc(SCCC(=O)Nc3cc(Cl)ccc3C)n2N)cc(OC)c1OC,C20920135_decoy,TRY1,Decoy,0,-9.65236,-5.89,-2.52,-5.757354333059152
O=C(CSc1n[nH]c(N/N=C/c2cccc(Cl)c2Cl)n1)NNC(=O)c1ccc(Cl)cc1,C20923442_decoy,TRY1,Decoy,0,-10.3763,-6.96,-4.26,-7.484604702530159
COc1ccc(/C=N/Nc2nc(SCCC(=O)Nc3cc(Cl)ccc3Cl)n[nH]2)cc1O,C21078728_decoy,TRY1,Decoy,0,-10.0542,-8.31,-2.49,-10.475510161555766
COc1ccc(/C=N/Nc2nc(SCCC(=O)Nc3c(Cl)cccc3Cl)n[nH]2)cc1O,C21078731_decoy,TRY1,Decoy,0,-9.49803,-8.37,-2.46,-11.198764176613974
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(Cl)c3)n2)cc1,C21081105_decoy,TRY1,Decoy,0,-10.6695,-8.49,-3.89,-8.033695343568924
C/C(=N\Nc1nc(SCC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)n[nH]1)c1ccncc1,C21082351_decoy,TRY1,Decoy,0,-9.76283,-6.1,-2.84,-5.686873603679028
Nn1c(N/N=C/c2ccccc2OCc2ccc(Cl)cc2)nnc1SCC(=O)Nc1ccccn1,C21327918_decoy,TRY1,Decoy,0,-8.50309,-8.57,-1.96,-8.190605105251617
NC(=O)CCc1nnc(SCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)n1Cc1ccco1,C23369778_decoy,TRY1,Decoy,0,-8.93568,-8.61,-0.98,-7.161275900376123
CCOC(=O)C1=C(COC(=O)c2cc3c(OC)nc(N)nc3s2)NC(=O)N[C@@H]1c1ccc(C)o1,C32754875_decoy,TRY1,Decoy,0,-8.76084,-7.5,-2.17,-6.679164372360932
CCOC(=O)[C@@H]1C(c2ccc(O)cc2)[C@@H](C(=O)OCC)[C@](O)(C(F)(F)F)N[C@]1(O)C(F)(F)F,C18996318_decoy,TRY1,Decoy,0,-7.96875,-4.64,-1.25,-5.57019576924482
CCOC(=O)[C@@H]1C(c2ccc(O)cc2)[C@H](C(=O)OCC)[C@@](O)(C(F)(F)F)N[C@@]1(O)C(F)(F)F,C18996325_decoy,TRY1,Decoy,0,-6.96707,-6.85,-1.88,-9.242732574199264
NC(=O)c1c(NC(=O)COC(=O)CNC(=O)c2ccc(Cl)cc2Cl)sc2c1CCCC2,C36184347_decoy,TRY1,Decoy,0,-11.3163,-7.19,-3.58,-7.538524272637493
CCCC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C1=O,C36339823_decoy,TRY1,Decoy,0,-9.41319,-7.39,-2.06,-7.552596122156295
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2c(O)cc(O)cc2O)N(C)C(=O)Cc2ccccc2C)cc1,C36525276_decoy,TRY1,Decoy,0,-8.86286,-8.46,-2.56,-8.419791936454686
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1ccccc1OC,C36555572_decoy,TRY1,Decoy,0,-7.3278,-6.07,-2.8,-6.155728592644651
CCCCn1c(N)c(N(Cc2ccccc2OC)C(=O)CN2C(=O)NC3(CCCC3)C2=O)c(=O)[nH]c1=O,C12850231_decoy,TRY1,Decoy,0,-8.72988,-6.84,-2.42,-6.867804141717607
CC(C)CNC(=O)NC(=O)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@@H](C)O,C09083610_decoy,TRY1,Decoy,0,-9.38941,-7.24,-1.59,-7.743191820079658
CCOC(=O)C1=C(CSc2nnc(-c3ccoc3C)n2N)NC(=O)N[C@@H]1c1ccc(OC)cc1,C36663592_decoy,TRY1,Decoy,0,-7.94742,-5.58,-1.18,-5.608606098507513
CCOC(=O)C1=C(CSc2nnc(-c3ccoc3C)n2N)NC(=O)N[C@H]1c1ccc(OC)cc1,C36663594_decoy,TRY1,Decoy,0,-8.83301,-6.99,-1.38,-6.8084101272447946
[NH3+][C@@H]1[C@@H](N(CCC2=CCCCC2)C(=O)Cc2c[nH]c3ccccc23)C([O-])=NC(=O)N1Cc1ccccc1,C39672560_decoy,TRY1,Decoy,0,-7.87464,-7.2,-1.56,-7.53080513545316
CC(C)CN(C(=O)CCC(=O)O[C@@H](C)C(=O)Nc1cccc(C#N)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12863282_decoy,TRY1,Decoy,0,-8.00931,-7.36,-4.03,-7.471040734982042
CC(C)CN(C(=O)CCC(=O)O[C@H](C)C(=O)Nc1cccc(C#N)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12863289_decoy,TRY1,Decoy,0,-7.96469,-6.62,-4.5,-7.004032304737522
CC(C)(C)c1ccc(OCCCn2c(S[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)nc3ccccc32)cc1,C39916020_decoy,TRY1,Decoy,0,-8.1503,-7.16,-1.35,-6.044759830562198
CC(C)(C)c1ccc(OCCCn2c(S[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)nc3ccccc32)cc1,C39916022_decoy,TRY1,Decoy,0,-8.03984,-7.58,-3.86,-7.188779832052422
CCOCCCNC(=O)c1c(NC(=O)c2cc(-c3c(C)cc(C)cc3O)n[nH]2)sc2c1CCC2,C40549575_decoy,TRY1,Decoy,0,-10.553,-6.12,-1.73,-6.798505893774449
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)NCc2ccc3c(c2)OCO3)[C@]1(C)CO,C43553872_decoy,TRY1,Decoy,0,-10.1487,-7.28,-3.52,-6.4436160411939705
COCCNC(=O)C[C@@H]1c2nc(NC(=O)CC(C)(C)C)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43554198_decoy,TRY1,Decoy,0,-10.4291,-6.83,-2.56,-8.3073123983248
CCOc1cc(/C=N/NC(=O)C(=O)N/N=C/c2cc(Cl)c(O)c(OCC)c2)cc(Cl)c1O,C16688255_decoy,TRY1,Decoy,0,-8.99554,-7.87,-3.87,-8.387210080554926
Cc1cc(NC(=O)c2ccco2)sc1C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C45670060_decoy,TRY1,Decoy,0,-10.8126,-7.94,-1.76,-7.520075782459617
CCOc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)ccc1OC(=O)c1cccc([N+](=O)[O-])c1,C19799931_decoy,TRY1,Decoy,0,-7.91891,-7.0,-1.94,-6.101441530547292
COc1ccc2c(c1)NC(=O)/C2=N\NC(=O)CCCCC(=O)N/N=C1\C(=O)Nc2ccc(OC)cc21,C02360998_decoy,TRY1,Decoy,0,-8.39118,-7.46,-3.3,-7.365056441399787
CCOC(=O)[C@@H]1C(c2ccc(O)cc2)[C@H](C(=O)OCC)[C@](O)(C(F)(F)F)N[C@]1(O)C(F)(F)F,C18996322_decoy,TRY1,Decoy,0,-7.54691,-4.51,-1.06,-5.569013840043503
Nn1c(SCCCC(=O)N/N=C/c2c[nH]c3ccccc23)nnc1-c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C58988900_decoy,TRY1,Decoy,0,-7.63217,-6.81,-3.38,-6.920194059304672
N#Cc1c(NC(=O)CSc2n[nH]c(N/N=C/c3cc([N+](=O)[O-])ccc3O)n2)sc2c1CCC2,C58997481_decoy,TRY1,Decoy,0,-10.848,-7.81,-2.64,-10.204098675325582
CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)sc2c1CCCC2,C59015447_decoy,TRY1,Decoy,0,-10.7494,-8.66,-2.06,-10.364051371430342
CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)sc2c1CCC2,C59015474_decoy,TRY1,Decoy,0,-9.69502,-9.45,-2.38,-10.5016881744482
CCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Cl)ccc3O)n2)s1,C59018657_decoy,TRY1,Decoy,0,-11.5883,-7.58,-3.97,-9.41922149480063
[H]/N=C1\C(C(=O)N[C@H]2CCCC[C@H]2C)=C(NCC(C)C)S[C@@H]1C(=O)Nc1sc2c(c1C(=O)OC)CCC2,C06298905_decoy,TRY1,Decoy,0,-10.5839,-7.75,-2.79,-7.84809554101818
C=CCNC(=O)O[C@@H]1CC[C@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)N2CCC[C@H]2CO)[C@]1(C)CO,C04236587_decoy,TRY1,Decoy,0,-8.48011,-6.59,-3.41,-7.115104020304223
CCCNC(=O)NC(=O)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@H](C)O,C09083617_decoy,TRY1,Decoy,0,-8.97432,-6.4,-2.44,-6.6022947280763
CNc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc1[N+](=O)[O-],C09282925_decoy,TRY1,Decoy,0,-7.72021,-8.15,-2.67,-7.91379526132274
CNc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc1[N+](=O)[O-],C09282926_decoy,TRY1,Decoy,0,-7.82466,-8.3,-4.72,-7.430773750115402
NC(=O)c1c(NC(=O)COC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)sc2c1CCC2,C09361480_decoy,TRY1,Decoy,0,-11.0871,-6.77,-1.73,-8.340866591948263
CC(C)Cn1c(N)c(C(=O)CSc2nnc(Nc3cccc(F)c3)s2)c(=O)[nH]c1=O,C11016631_decoy,TRY1,Decoy,0,-7.22366,-7.66,-2.36,-6.452647524698979
CC(C)NC(=O)NC(=O)COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1,C12985886_decoy,TRY1,Decoy,0,-8.4036,-7.84,-2.3,-8.030924743114536
CCCCn1c(N)c(N(CC(C)C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)c(=O)[nH]c1=O,C14670232_decoy,TRY1,Decoy,0,-6.65506,-4.47,-2.55,-4.666810452151947
COCCOC(=O)c1c(NC(=O)CNc2cccc([N+](=O)[O-])c2C)sc(C(N)=O)c1C,C15124486_decoy,TRY1,Decoy,0,-7.56228,-5.58,-1.62,-5.910657470394851
CCOC(=O)CC1=C(C(=O)OCC)[C@@]2(C(=O)N(CC(N)=O)c3ccccc32)C(C#N)=C(N)O1,C02229325_decoy,TRY1,Decoy,0,-6.68746,-4.63,-2.59,-4.710031203840733
CCOc1ccccc1NC(=S)NNC(=O)c1cnn2c1N[C@H](C)C[C@H]2C(F)(F)F,C02794119_decoy,TRY1,Decoy,0,-7.64632,-8.04,-2.92,-6.7912360140241885
CCOc1ccc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)cc1,C20827548_decoy,TRY1,Decoy,0,-8.98963,-5.65,-2.96,-6.527566674640343
CC(=O)Nc1cccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(C(C)C)c3C)n2)c1,C20904957_decoy,TRY1,Decoy,0,-9.8992,-7.98,-3.13,-9.442706654801414
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)NCc1cccc(C(F)(F)F)c1,C20906311_decoy,TRY1,Decoy,0,-8.32532,-6.59,-4.05,-6.53156588948558
COCC(=O)NNC(=O)CSc1n[nH]c(NN=C(Cc2ccccc2)Cc2ccccc2)n1,C20909112_decoy,TRY1,Decoy,0,-7.47098,-7.55,-2.09,-6.922042728582988
O=C(CSc1n[nH]c(N/N=C/c2ccccc2Cl)n1)NNC(=O)c1ccc(F)cc1,C20923401_decoy,TRY1,Decoy,0,-9.36803,-7.72,-1.59,-7.886320969460276
COc1ccc(/C=N/Nc2nc(SCCC(=O)Nc3ccccc3OC)n[nH]2)cc1O,C21078715_decoy,TRY1,Decoy,0,-9.18181,-8.5,-3.04,-7.663231486749406
Cc1ccc(NC(=O)NC(=O)COC(=O)CSc2nc(C)c(C)c(C)c2C(N)=O)cc1C,C21740781_decoy,TRY1,Decoy,0,-9.41442,-7.57,-2.99,-7.364783721567507
CCOc1cc(CNn2c(-c3ccncc3)n[nH]c2=S)cc(Br)c1OCC(N)=O,C22110911_decoy,TRY1,Decoy,0,-8.68283,-6.48,-2.42,-6.658528911448048
COc1cc([C@H](CC(=O)c2c([O-])n(C)c3ccccc3c2=O)[NH2+]CCO)cc(OC)c1O,C24717296_decoy,TRY1,Decoy,0,-8.76158,-8.28,-2.68,-6.519896321777444
CCc1cc(C(C)=O)c(O)cc1OCc1cccc(C(=O)NC[C@@H](O)c2ccc(O)cc2)n1,C28458896_decoy,TRY1,Decoy,0,-9.30642,-7.69,-3.01,-7.352531506926325
CCCNC(=O)NC(=O)COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@H](C)O,C09083618_decoy,TRY1,Decoy,0,-9.03486,-6.16,-3.44,-6.538446710866289
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2c(O)cc(O)cc2O)N(C=O)Cc2ccco2)cc1,C36499268_decoy,TRY1,Decoy,0,-9.01193,-8.7,-1.38,-10.017366417227327
O=C(NC1CCCCC1)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CCS,C36501350_decoy,TRY1,Decoy,0,-9.89891,-5.36,-2.18,-7.5233087961151135
COc1ccc2[nH]cc(CCN3C[C@H](C(=O)N[C@H]4NN[C@@H](CC(C)C)S4)CC3=O)c2c1,C39252474_decoy,TRY1,Decoy,0,-8.58318,-6.66,-2.78,-5.714977875413346
CCCCN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1c(N)n(CCCC)c(=O)[nH]c1=O,C39548384_decoy,TRY1,Decoy,0,-7.25912,-6.73,-3.03,-7.069005413228171
CCOc1c(Cl)cc(/C=C/C(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1OC,C39559524_decoy,TRY1,Decoy,0,-8.9017,-8.17,-2.88,-10.613231567840408
Cc1cc(C)cc(C(=O)NCC(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1,C39589468_decoy,TRY1,Decoy,0,-10.0839,-7.84,-2.15,-7.272076923100106
C=CCN1[C@H](CNC(=O)c2ccc(OC)cc2)NN[C@@H]1SCc1nc2ccccc2c(=O)[nH]1,C39969478_decoy,TRY1,Decoy,0,-8.19611,-6.06,-3.6,-5.396997572842423
C=CCN1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@@H]1CNC(=O)c1ccc(OC)cc1,C39969479_decoy,TRY1,Decoy,0,-9.39291,-7.16,-2.17,-6.619724909062401
C=CCN1[C@H](CC(=O)Nc2ccccc2F)NN[C@@H]1SCc1nc2ccccc2c(=O)[nH]1,C39969671_decoy,TRY1,Decoy,0,-9.34772,-5.78,-1.82,-5.734140680108304
COc1ccccc1Nc1nc(N)nc(COC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)n1,C21741329_decoy,TRY1,Decoy,0,-7.99468,-8.55,-2.6,-8.601309267830342
COc1ccccc1C(=O)NNc1ncnc(NNC(=O)c2ccccc2F)c1[N+](=O)[O-],C40658188_decoy,TRY1,Decoy,0,-7.28283,-8.58,-3.23,-6.730139788119577
O=C([O-])C[C@@]1(C(=O)[O-])[NH2+][C@@H](c2nccs2)[C@@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@H]21,C33581044_decoy,TRY1,Decoy,0,-7.13638,-7.2,-1.97,-6.674071306651823
CCCCCN(C(=O)C[C@H](NC(C)=O)c1ccccc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C45285373_decoy,TRY1,Decoy,0,-8.28596,-6.87,-2.38,-8.150785809742949
CCOc1ccc2nc(SCC(=O)N(CCOC)c3c(N)n(Cc4ccccc4)c(=O)[nH]c3=O)[nH]c2c1,C12506132_decoy,TRY1,Decoy,0,-8.19861,-6.99,-2.93,-7.048297561233787
CCOC(=O)C1=C(COC(=O)c2cc(S(N)(=O)=O)ccc2F)NC(=O)N[C@@H]1c1ccco1,C57941330_decoy,TRY1,Decoy,0,-8.51725,-7.12,-2.53,-5.872550595453488
CC(=O)N/C(=C\c1ccccc1)C(=O)O[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C22033740_decoy,TRY1,Decoy,0,-8.44773,-7.61,-1.82,-6.898167084472543
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1sccc1C(N)=O,C58613852_decoy,TRY1,Decoy,0,-7.80116,-7.63,-3.23,-6.991321349866835
C[C@@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1sccc1C(N)=O,C58613855_decoy,TRY1,Decoy,0,-8.03985,-7.04,-3.07,-7.659862970055948
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)Nc1cc(F)ccc1F,C58997457_decoy,TRY1,Decoy,0,-9.06983,-7.77,-1.19,-7.48283774051718
O=C(CCCNC(=O)NC1CCCCC1)NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1,C59412053_decoy,TRY1,Decoy,0,-9.08549,-7.05,-2.66,-7.167567852812175
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3cccc4ccccc34)n2N)cn1,C59830061_decoy,TRY1,Decoy,0,-7.7059,-7.5,-2.77,-6.0508628540749605
COc1cccc(CNC(=O)CSc2n[nH]c(N/N=C(\C)c3ccccc3O)n2)c1OC,C59830293_decoy,TRY1,Decoy,0,-9.27881,-8.45,-3.03,-7.6486980932113875
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C59834980_decoy,TRY1,Decoy,0,-8.68502,-6.97,-1.26,-6.190117719664748
CC(C)C(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1,C59878980_decoy,TRY1,Decoy,0,-9.21792,-7.03,-2.08,-8.64629159738802
CC(C)C(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2cccc(Cl)c2Cl)n1,C59879252_decoy,TRY1,Decoy,0,-9.60486,-6.95,-2.07,-6.612834808845799
Cc1[nH]cnc1CSCCNC(=O)C(=O)Nc1ccc2c(c1)N[C@H](C(F)(F)F)N2C,C63807270_decoy,TRY1,Decoy,0,-8.04141,-5.56,-3.04,-4.786272278308197
Cc1[nH]cnc1CSCCNC(=O)C(=O)Nc1ccc2c(c1)N[C@@H](C(F)(F)F)N2C,C63807271_decoy,TRY1,Decoy,0,-8.40025,-6.95,-3.13,-6.418379899531369
O=C(C[C@@H]([NH2+]CCNc1ccccc1[N+](=O)[O-])C(=O)[O-])Nc1cccc(Cl)c1Cl,C65090383_decoy,TRY1,Decoy,0,-5.16755,-6.68,-4.78,-5.214961610050452
CCN(CC)c1nc(SCCNC(=O)Nc2ccc(Cl)c(Cl)c2)nc(N(CC)CC)n1,C06512267_decoy,TRY1,Decoy,0,-10.451,-7.21,-3.33,-7.849080771999689
CCCOc1ccc([C@H]2CN3C(=O)CN(CCCCCO)C(=O)[C@]3(C)c3[nH]c4ccccc4c32)cc1OCC,C08789680_decoy,TRY1,Decoy,0,-9.42488,-6.74,-3.52,-8.305222381598654
CCCCCN1C(=O)/C(=C/c2c(NCCOCCO)nc3ccc(C)cn3c2=O)SC1=S,C08858359_decoy,TRY1,Decoy,0,-10.4823,-5.85,-2.04,-8.623584056666214
COc1cc(/C=C/C(=O)OCC(=O)Nc2ccccc2C(=O)NCC(C)C)cc(Cl)c1OC,C09438409_decoy,TRY1,Decoy,0,-8.55254,-6.94,-1.44,-6.901808100734767
CCOC(=O)[C@@H](C)Oc1ccc(/C=N/NC(=O)[C@@H](NC(=O)c2ccc(Cl)cc2Cl)C(C)C)cc1,C10040132_decoy,TRY1,Decoy,0,-9.51303,-7.58,-3.24,-7.178514132274411
CCOC(=O)c1ccsc1NC(=O)CSc1nnc(Nc2ccccc2OCC)s1,C09804640_decoy,TRY1,Decoy,0,-8.24091,-6.24,-3.14,-5.728118561465972
CCOC(=O)c1c(NC(=O)[C@@H](C)OC(=O)C[C@@H](NC(C)=O)c2cccs2)sc2c1CCCC2,C12174635_decoy,TRY1,Decoy,0,-10.6213,-7.13,-4.23,-9.162560509000238
CCOc1ccc(N(C(=O)CNC(=O)c2ccco2)[C@H](C(=O)NC(C)(C)C)c2ccc(C(C)C)cc2)cc1,C12488273_decoy,TRY1,Decoy,0,-7.42279,-6.66,-3.23,-6.428259390056435
CCC(C)(C)NC(=O)[C@@H](c1cccc(OC)c1)N(C(=O)CNC(=O)c1cccs1)c1ccccc1OC,C12488648_decoy,TRY1,Decoy,0,-7.74202,-7.28,-2.71,-6.890713210537899
CCOc1ccccc1N(C(=O)CNC(=O)c1cccs1)[C@H](C(=O)NC[C@H]1CCCO1)c1ccccc1,C12489952_decoy,TRY1,Decoy,0,-7.70999,-7.3,-2.25,-7.44541144305338
CCOc1ccc(N(C(=O)CNC(=O)c2cccs2)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccccc2)cc1,C12490001_decoy,TRY1,Decoy,0,-9.19005,-7.04,-3.05,-7.151298735965699
CCC[C@@H]1C[C@](C)(c2csc(NCCNc3nc([C@]4(C)C[C@@H](CCC)C(=O)O4)cs3)n2)OC1=O,C12652723_decoy,TRY1,Decoy,0,-10.819,-6.02,-2.96,-7.400384547576781
CCOC(=O)C1=C(COC(=O)COc2cc(C)ccc2C(C)C)NC(=O)N[C@H]1c1cccs1,C12720093_decoy,TRY1,Decoy,0,-8.22799,-7.12,-3.28,-6.149945336285416
C=CCc1ccc(OC[C@H](O)CN2C(=O)N[C@](C)(c3ccc(OC(F)F)cc3)C2=O)c(OC)c1,C12849395_decoy,TRY1,Decoy,0,-7.35789,-7.25,-3.86,-5.6918300046584775
CCOC(=O)c1c(NC(=O)COC(=O)c2ccccc2Nc2ccccc2)sc(C(C)=O)c1C,C13141778_decoy,TRY1,Decoy,0,-9.49281,-7.63,-3.84,-7.801792570373577
COCCN(C(=O)CCC(=O)Nc1nc(C)cs1)[C@@H](C(=O)NC1CCCC1)c1ccccc1,C13505636_decoy,TRY1,Decoy,0,-8.9894,-7.09,-2.85,-7.409076279968989
COCC(=O)Nc1c(C(=O)OC)n(CCC(C)C)c2ncc(NCc3cc(F)cc(F)c3)cc12,C14532071_decoy,TRY1,Decoy,0,-8.74844,-6.62,-3.18,-7.994325287643613
C=C(C)CC[C@@H](C)Nc1cnc2c(c1)c(NC(=O)[C@H]1CCCO1)c(C(=O)OC)n2Cc1ccccc1,C14744205_decoy,TRY1,Decoy,0,-7.99808,-5.95,-3.78,-5.502517442818283
CCOC(=O)Cc1csc(NC(=O)CSc2nnc(NCc3ccc(F)cc3)s2)n1,C16335210_decoy,TRY1,Decoy,0,-9.12169,-7.75,-3.41,-6.5540855620500205
COCCCN1C(=O)C(O)=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@H]1c1ccc(O)c(OC)c1,C16742387_decoy,TRY1,Decoy,0,-8.99445,-7.51,-2.14,-6.625952186967746
COc1cc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCC[NH+](C)C)ccc1O,C09334053_decoy,TRY1,Decoy,0,-9.07742,-5.87,-0.73,-6.273317917063893
CCOc1cc([C@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CC[NH+](CC)CC)ccc1O,C13427532_decoy,TRY1,Decoy,0,-7.51522,-6.58,-1.86,-6.966732089988929
COc1cc2cc(CN(Cc3cccs3)C(=S)NCCCN3CCOCC3)c(=O)[nH]c2cc1OC,C19941027_decoy,TRY1,Decoy,0,-9.27221,-5.38,-3.2,-6.3064058595701455
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1cccs1,C20219358_decoy,TRY1,Decoy,0,-8.05155,-4.69,-2.84,-5.0693266079734
CCCOc1c(Br)cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1OC,C23568654_decoy,TRY1,Decoy,0,-8.80338,-6.16,-2.51,-7.077546019699209
CCOc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=S)NCCN2CCOCC2)cc1Cl,C14359816_decoy,TRY1,Decoy,0,-10.1315,-7.46,-1.62,-8.904364215448476
CCN(CC)S(=O)(=O)c1cccc(N[C@H](NC(=O)OC[C@@H]2CCCO2)C(Cl)(Cl)Cl)c1,C26779971_decoy,TRY1,Decoy,0,-9.5834,-6.96,-1.72,-7.986283511645229
CCOCCCN(CC(=O)Nc1ccon1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1,C33853326_decoy,TRY1,Decoy,0,-6.60941,-6.13,-3.05,-5.952239435992061
COCCN(CCC(=O)Nc1ccc(F)cc1)C(=O)c1csc(Nc2ccccc2OC)n1,C35612751_decoy,TRY1,Decoy,0,-8.28141,-7.33,-3.94,-7.188847875498138
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC[NH+](C)C)N2[C@H]1c1ccc(OC)cc1,C35697046_decoy,TRY1,Decoy,0,-7.98589,-4.58,-4.52,-4.770609970931079
COc1ccc([C@H]2C(C(=O)OC(C)C)=C(C(F)(F)F)N=C3SC=C(/C=C(\[O-])NCC[NH+](C)C)N32)cc1,C35704700_decoy,TRY1,Decoy,0,-7.94274,-4.78,-4.3,-4.703821970009434
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC[NH+](C)C)N2[C@H]1c1ccc(C)cc1C,C36061191_decoy,TRY1,Decoy,0,-6.95455,-5.8,-3.93,-5.453679618903563
CCCN(C(=O)[C@@H](OC)c1ccccc1)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccccc1O,C36561214_decoy,TRY1,Decoy,0,-7.19733,-7.39,-4.07,-7.115689716738356
CCOc1cc(C#N)ccc1OCC(=O)Nc1sc2c(c1C(=O)NCCCOC)CCCC2,C36791033_decoy,TRY1,Decoy,0,-11.4988,-6.28,-2.36,-7.639893349744864
CCCCN(C(=O)CCC(=O)Nc1cc(C)on1)[C@@H](C(=O)NC(C)(C)C)c1ccccc1Cl,C12491829_decoy,TRY1,Decoy,0,-7.94507,-6.45,-2.29,-7.517102103804754
CCCCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(OC)c2OC)cc1,C38658871_decoy,TRY1,Decoy,0,-8.56173,-7.13,-3.0,-6.770858190265597
CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cc(C)cc(C)c4)ccc32)cc1OC,C38660157_decoy,TRY1,Decoy,0,-8.64659,-6.23,-3.28,-5.774731643578654
CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C(C)C)cc4)ccc32)cc1OCC,C38679376_decoy,TRY1,Decoy,0,-9.03165,-5.1,-3.15,-5.714273100870242
CCCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1OC,C38681944_decoy,TRY1,Decoy,0,-9.18909,-7.36,-0.77,-6.979439072202836
CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1OCC,C38684000_decoy,TRY1,Decoy,0,-8.79029,-6.24,-2.7,-5.888621746743909
CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(OCC(C)C)c(OC)c2)cc1,C38684251_decoy,TRY1,Decoy,0,-9.40572,-9.28,-1.64,-9.753546432226676
C=CCn1c(CCC(=O)Nc2ccccc2Cl)nnc1S[C@@H](CC)C(=O)Nc1nccs1,C39760895_decoy,TRY1,Decoy,0,-10.0191,-7.42,-2.1,-7.196656150378548
CCCCCCC(=O)NCCC1=c2ccccc2=[NH+][C@@H]1/C=C1/C(=O)N=C([O-])N(c2ccc(C(C)C)cc2)C1=O,C39928132_decoy,TRY1,Decoy,0,-10.5748,-7.74,-3.15,-8.830071558940388
CCCCCCOc1ccc([C@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2Cc2ccco2)cc1OC,C39912247_decoy,TRY1,Decoy,0,-7.6844,-5.49,-2.74,-5.8291222368762
CCCCOc1ccc([C@H]2c3c(-c4cc(Cl)c(C)cc4O)n[nH]c3C(=O)N2CCOC)cc1OCC,C39914101_decoy,TRY1,Decoy,0,-8.33528,-4.56,-1.12,-6.0284333788202025
CCCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4OC)ccc32)c1,C40530227_decoy,TRY1,Decoy,0,-8.92658,-6.74,-3.01,-6.709963798507213
CCCCOc1ccc([C@@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCOC)cc1OC,C09409067_decoy,TRY1,Decoy,0,-8.06351,-6.57,-1.47,-6.553320847331503
C=C(NNC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1CC)c1ccc(OC(C)=O)cc1,C01834209_decoy,TRY1,Decoy,0,-9.20932,-6.55,-1.81,-6.381192219802823
CCC[C@@H](c1nnnn1Cc1ccc(F)cc1)N(CCCO)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13501045_decoy,TRY1,Decoy,0,-8.59491,-6.54,-1.82,-6.189949022154252
CCCCOc1ccc([C@H]2C3=C(c4cc(C)ccc4O)N=N[C@H]3C(=O)N2CCCO)cc1OCC,C27749153_decoy,TRY1,Decoy,0,-8.10582,-5.46,-1.9,-6.767833875117929
C[C@H]1C[C@H](C)CN(C(=O)C(F)(F)F)C1,C06253776_decoy,TRY1,Decoy,0,-5.25683,-4.49,-1.88,-3.221569260128885
C#CCSc1nc(C)cc(C)c1C#N,C02981314_decoy,TRY1,Decoy,0,-6.0154,-3.94,-1.37,-3.533553353566241
O=CC(=O)c1ccc(Br)s1,C04204400_decoy,TRY1,Decoy,0,-6.36127,-4.01,0.04,-3.884365223124404
O=N[C@H]1[C@@H](Br)[C@H]2C=C[C@@H]1C2,C05031310_decoy,TRY1,Decoy,0,-6.03966,-3.68,-2.09,-2.972079267509249
CCN1C(=O)C(=C2CCCC2)SC1=S,C01505464_decoy,TRY1,Decoy,0,-6.92287,-3.28,-0.51,-2.797797704694404
COc1nc(C)ccc1Br,C08698261_decoy,TRY1,Decoy,0,-5.9956,-4.75,-0.77,-5.43030619682107
O=[P@@]1(CCl)COCc2ccccc21,C00064033_decoy,TRY1,Decoy,0,-4.71782,-3.34,-1.25,-2.8602348429657347
N#Cc1ccccc1N1CCSCC1,C20257348_decoy,TRY1,Decoy,0,-5.62949,-3.83,-1.95,-2.7661753370878506
COc1nccc(C)c1Br,C21981986_decoy,TRY1,Decoy,0,-6.10729,-4.23,-0.53,-5.147916226834378
C=C(Br)CCC1OCCO1,C21990735_decoy,TRY1,Decoy,0,-6.05875,-3.28,-1.24,-3.741441755923436
N#C[C@]1(N2CCCCCC2)CCSC1,C38086110_decoy,TRY1,Decoy,0,-7.39384,-4.12,-2.72,-3.30043344362361
C[C@H]1CC2(CCC(C(C)(C)C)CC2)OC1=O,C38648396_decoy,TRY1,Decoy,0,-6.64172,-3.97,-0.6,-3.090977260684432
CC(C)[C@H]1C[C@H](C(=O)CCl)CCO1,C39055385_decoy,TRY1,Decoy,0,-6.92523,-5.49,-3.1,-5.935351210569072
CC(C)[C@H]1C[C@@H](C(=O)CCl)CCO1,C39055387_decoy,TRY1,Decoy,0,-6.77167,-3.21,-1.1,-3.471652393330296
CC[C@@]1(C)OC[C@@H](CBr)O1,C39101397_decoy,TRY1,Decoy,0,-6.32641,-3.92,-0.56,-5.266134875910122
CC(=O)CC[C@]12O[C@@]1(C)CCC2(C)C,C39112551_decoy,TRY1,Decoy,0,-6.09325,-4.15,-0.79,-3.570317616682199
CC1=NC(=S)[C@@H](C#N)C(c2cccs2)=C1,C39323386_decoy,TRY1,Decoy,0,-8.1246,-5.72,-0.6,-5.5889725610325325
N#Cc1cccc(C2=CC3=CC=N[C@H]3C=C2)c1,C39328632_decoy,TRY1,Decoy,0,-6.49446,-6.59,-0.01,-6.766075224622395
CON1C[C@@H](Cl)C[C@@]12CC[C@H](F)C2,C39504079_decoy,TRY1,Decoy,0,-6.14508,-3.97,-1.4,-3.0749449815939545
CCO[C@H]1CC[C@]2(C1)C[C@H](SC)CN2F,C39505489_decoy,TRY1,Decoy,0,-7.13139,-3.95,-1.29,-3.978147328944832
CCO[C@H]1CC[C@]2(C[C@H](F)CN2F)C1,C39505591_decoy,TRY1,Decoy,0,-5.06603,-4.0,-1.08,-2.994170902345361
CCO[C@H]1CC[C@@]2(C[C@H](Cl)CN2F)C1,C39505633_decoy,TRY1,Decoy,0,-6.25139,-4.65,-1.14,-3.638901024347696
CO[C@@H]1CN(Cl)[C@@]2(CC[C@H](F)C2)C1,C39505993_decoy,TRY1,Decoy,0,-6.45993,-3.83,-1.74,-3.2418436981148
CO[C@H]1CC[C@@]2(C1)[C@H](F)CCCN2Cl,C39511080_decoy,TRY1,Decoy,0,-6.82786,-3.85,-0.83,-3.395760680347607
CC(C)c1cc(Br)ncn1,C40766576_decoy,TRY1,Decoy,0,-6.07407,-3.15,-0.34,-2.572395881461285
C[C@@H]1CN(CCCBr)C[C@@H](C)O1,C40989689_decoy,TRY1,Decoy,0,-6.7191,-3.5,-1.24,-3.344771969777212
CC1(C)CN(CCBr)CCO1,C40991207_decoy,TRY1,Decoy,0,-6.23038,-3.09,-0.41,-3.2454307800790687
C[C@@H]1C[C@H](C)CN(C(=O)CBr)C1,C41706863_decoy,TRY1,Decoy,0,-6.30965,-4.79,-0.97,-3.513750133948046
CC1(C)COCCN1CCBr,C42462843_decoy,TRY1,Decoy,0,-6.39821,-3.57,-0.8,-3.27374369798118
CC(C)[C@@H](Cl)[C@H]1CCS(=O)(=O)C1,C43302147_decoy,TRY1,Decoy,0,-6.4874,-4.2,-1.22,-3.928052853689192
O=S1(=O)CC[C@H]([C@H](Cl)C2CC2)C1,C43302161_decoy,TRY1,Decoy,0,-6.64057,-4.0,-2.21,-3.981786703494135
N#C/C=C/c1ccc(Br)o1,C43559173_decoy,TRY1,Decoy,0,-5.83282,-5.03,-0.28,-4.758373211170592
CC[C@H]([C@@H]1CCS(=O)(=O)C1)[C@@H](C)Cl,C43661857_decoy,TRY1,Decoy,0,-6.66685,-3.36,-1.48,-3.959213418265568
CC(C)[C@@H](Cl)C[C@@H]1CCS(=O)(=O)C1,C43662071_decoy,TRY1,Decoy,0,-6.72368,-4.14,-0.58,-4.174046634806438
C[C@H]([C@H]1CCS(=O)(=O)C1)[C@@H](C)Cl,C43662260_decoy,TRY1,Decoy,0,-6.95431,-4.11,-1.15,-4.191938220146885
Brc1cnc(N2CCCC2)s1,C44116974_decoy,TRY1,Decoy,0,-6.95495,-2.98,-0.34,-2.766938481732057
CCN(C)c1cc(Br)ccn1,C44118409_decoy,TRY1,Decoy,0,-5.92575,-3.33,-1.1,-2.647177597142606
Fc1ccc(F)c(C2OCCO2)c1F,C44228125_decoy,TRY1,Decoy,0,-6.23011,-4.15,-0.4,-3.0422361759870884
Cc1nn(CC2CC2)c(C)c1Br,C50594425_decoy,TRY1,Decoy,0,-6.47957,-3.88,-2.67,-3.1774326151859937
CC(C)(C)n1ccnc1Br,C57491434_decoy,TRY1,Decoy,0,-5.66916,-2.92,-1.65,-2.775891727502972
O=C1CCN(c2cc(F)c(F)cc2F)C1,C61094203_decoy,TRY1,Decoy,0,-6.45068,-4.76,-0.36,-3.154189591892925
N#C[C@@]1(N2CCCCC2)CCCSC1,C32189848_decoy,TRY1,Decoy,0,-6.80922,-4.36,-2.39,-3.5649552427823816
O=Cc1nc2c(s1)CCc1sccc1-2,C61798546_decoy,TRY1,Decoy,0,-7.04929,-5.04,-0.79,-6.551628282489748
Cc1ccnc([C@H](C(C)C)[C@H](C)Cl)n1,C63040841_decoy,TRY1,Decoy,0,-6.58685,-4.7,-0.65,-5.896463397688911
CC[C@H](c1ccc(C)nn1)[C@H](C)Cl,C63042203_decoy,TRY1,Decoy,0,-6.32418,-3.29,-2.89,-3.112363127790206
Cc1cc([C@H](C)[C@H](C)Br)ncn1,C63046139_decoy,TRY1,Decoy,0,-6.51528,-5.2,-0.46,-6.632706098341664
C[C@H](c1ccncn1)[C@@H](C)Br,C63046169_decoy,TRY1,Decoy,0,-5.85742,-4.96,-0.72,-5.606992721666625
Cc1cnc([C@@H](C(C)C)[C@H](C)Cl)nc1,C63049529_decoy,TRY1,Decoy,0,-5.92314,-4.61,-0.97,-3.539014170303512
CC[C@@H](c1ncc(C)cn1)[C@H](C)Cl,C63049541_decoy,TRY1,Decoy,0,-5.64699,-4.21,-1.36,-5.474968086422166
C[C@@H]1CN(C(=O)C2(C)CCCC2)CCS1,C67301152_decoy,TRY1,Decoy,0,-6.16663,-4.58,-1.59,-4.005833491097326
O=S(=O)(/N=C1\C=C2[NH+](CCO)CCO[C@]2(O)c2ccccc21)c1ccc(Br)cc1,C01926241_decoy,TRY1,Decoy,0,-8.87411,-6.24,-1.29,-5.955108637894779
COc1ccc(/C=N/n2c(O)nc3c([nH]c4ccc(Cl)cc43)c2=O)cc1C[NH+]1CCCCC1,C08767824_decoy,TRY1,Decoy,0,-9.22984,-7.23,-1.97,-7.845712171867742
Cc1ccc2c(c1C)NC(=O)[C@]21[C@@H](C(=O)c2ccco2)[C@]2(C(=O)Nc3ccccc32)[C@@H]2CCC[NH+]21,C08789616_decoy,TRY1,Decoy,0,-7.09388,-8.37,-2.48,-6.277654056071036
COc1ccc(-n2c3c(c(=O)[nH]c2=O)C(C(F)(F)F)(C(F)(F)F)[NH+]=C(c2ccco2)N3)cc1,C08868870_decoy,TRY1,Decoy,0,-7.22483,-6.63,-1.79,-5.157392600836671
Cc1ccc(C(=O)[C@@H]2[C@H]3CCC[NH+]3[C@]3(C(=O)Nc4c(C)cccc43)[C@@]23C(=O)Nc2ccccc23)cc1,C08876676_decoy,TRY1,Decoy,0,-7.27511,-8.0,-0.99,-7.169312911826676
C[C@H](Oc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C08792378_decoy,TRY1,Decoy,0,-5.98035,-8.27,-3.62,-4.763949553221646
COc1cc([C@H]2N=C(O)c3c(sc4c3CC[NH+](C(C)C)C4)N2)cc(Br)c1OC,C08923433_decoy,TRY1,Decoy,0,-8.47068,-4.81,-2.35,-4.398204314368934
O=C(c1cccc([N+](=O)[O-])c1)[C@@H]1[C@]2(C(=O)Nc3ccccc32)[C@@H]2CCC[NH+]2[C@@]12C(=O)Nc1ccccc12,C09353303_decoy,TRY1,Decoy,0,-7.03337,-7.7,-1.42,-5.680440723444699
COc1c2c(cc3c1[C@H](c1c(O)n(-c4ccc(C(C)C)cc4)c(=O)[nH]c1=O)[NH+](C)CC3)OCO2,C02106948_decoy,TRY1,Decoy,0,-6.91937,-5.35,-4.66,-4.27488593179676
COc1cc([C@@H]2c3cc4c(cc3[C@@H](Nc3cccc[nH+]3)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O,C13473807_decoy,TRY1,Decoy,0,-9.36191,-6.2,-4.84,-5.580581498622628
O=C(c1cccc([N+](=O)[O-])c1)[C@@H]1[C@@]2(C(=O)Nc3ccccc32)[C@@H]2CCC[NH+]2[C@]12C(=O)Nc1ccccc12,C16042025_decoy,TRY1,Decoy,0,-6.71803,-6.99,-1.33,-5.225986543497172
O=C(c1cccc([N+](=O)[O-])c1)[C@@H]1[C@]2(C(=O)Nc3ccccc32)[C@H]2CCC[NH+]2[C@]12C(=O)Nc1ccccc12,C16042028_decoy,TRY1,Decoy,0,-5.83162,-6.55,-1.97,-4.42273702999691
CSCC[C@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3C)C(=O)[C@H]21,C09316520_decoy,TRY1,Decoy,0,-7.53806,-5.95,-1.86,-5.167662190125695
CSCC[C@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@@H]12,C02091540_decoy,TRY1,Decoy,0,-9.16487,-6.3,-4.16,-5.786673938395974
CN1Cc2c(N3CCOCC3)[nH+]c3sc(C(=O)c4ccc(Cl)cc4)c(N)c3c2CC1(C)C,C20263506_decoy,TRY1,Decoy,0,-8.84745,-6.95,-1.53,-6.088444888466543
COC(=O)c1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)sc2c1CC(C)(C)[NH2+]C2(C)C,C33825621_decoy,TRY1,Decoy,0,-8.67349,-5.85,-1.97,-4.747490321833629
CC[NH+]1CCN(c2ncc(-c3cc(=O)[nH]c(Nc4nc(C)c5ccc(C)cc5n4)n3)c(C)n2)CC1,C36235774_decoy,TRY1,Decoy,0,-10.1056,-9.87,-1.65,-9.489510283630166
C[NH2+][C@H]1C[C@H]2O[C@@](C)([C@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4,C04095791_decoy,TRY1,Decoy,0,-7.10876,-6.35,-3.05,-1.6760859258396994
N[C@@H]1[C@@H](S(=O)(=O)c2ccccc2)c2nc3ccccc3nc2N1/N=C/C1=c2ccccc2=[NH+]C1,C38576468_decoy,TRY1,Decoy,0,-8.65425,-6.85,-3.66,-5.426465504366361
CC1(C)SC(=S)N(/N=C/C2=c3ccccc3=[NH+]C2)[C@H]1N(O)C(=O)Nc1ccc(Cl)cc1,C38582670_decoy,TRY1,Decoy,0,-7.75164,-6.88,-2.95,-5.579610724531318
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1NN(Cc2ccc(Br)cc2)C=C1Br,C39167742_decoy,TRY1,Decoy,0,-8.49355,-7.78,-3.08,-6.726627693474047
O=C([C@H]1C[C@H](c2ccccc2O)C2=[NH+]c3ccccc3CN21)N(c1ccccc1)c1ccccc1O,C39545108_decoy,TRY1,Decoy,0,-8.45911,-8.62,-0.66,-9.714446885220152
Cc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)cc1,C39639376_decoy,TRY1,Decoy,0,-7.99449,-7.05,-1.59,-5.865294208645486
CC1(C)OC[C@H](CNC(=O)[C@H]2CN(C(=O)c3ccc(Cl)cc3Cl)CC23CC[NH2+]CC3)O1,C39658870_decoy,TRY1,Decoy,0,-8.71132,-7.43,-2.24,-5.93560460854925
CC1(C)OC[C@@H](CNC(=O)[C@@H]2CN(C(=O)c3cccc(Cl)c3Cl)CC23CC[NH2+]CC3)O1,C39659327_decoy,TRY1,Decoy,0,-9.28292,-6.18,-3.18,-6.014590833086462
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NC[C@@H]3COC(C)(C)O3)C3(CC[NH2+]CC3)C2)c1F,C39659353_decoy,TRY1,Decoy,0,-8.48136,-5.57,-2.26,-5.3832409616546535
COc1c(C(=O)N2C[C@H](C(=O)NCc3cn4ccccc4n3)C3(CC[NH2+]CC3)C2)csc1Cl,C39672032_decoy,TRY1,Decoy,0,-8.03191,-7.16,-2.56,-5.862841694383902
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674246_decoy,TRY1,Decoy,0,-8.51328,-5.72,-2.4,-5.751696919236175
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3c(Cl)ccc(C)c3F)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674357_decoy,TRY1,Decoy,0,-9.13791,-6.82,-1.93,-5.623149878855125
COc1c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)C3=C(C)N=N[C@H]3C)C3(CC[NH2+]CC3)C2)csc1Cl,C39674453_decoy,TRY1,Decoy,0,-8.39065,-5.85,-3.59,-5.412472335286099
CC1=NN(C(C)(C)C)[C@H](C(=O)N2C[C@@H](C(=O)N[C@@H](C)C3=C(C)N=N[C@H]3C)C3(CC[NH2+]CC3)C2)C1,C39674457_decoy,TRY1,Decoy,0,-8.15536,-7.08,-1.91,-6.601156058175388
C[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2)c1ccncc1,C39680867_decoy,TRY1,Decoy,0,-7.88615,-7.62,-2.1,-6.408285597305061
C[C@@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2)c1ccncc1,C39680868_decoy,TRY1,Decoy,0,-8.67371,-7.15,-1.33,-5.787681923368767
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)C(C)(C)C)C3(CC[NH2+]CC3)C2)cc1Cl,C39684665_decoy,TRY1,Decoy,0,-9.06638,-4.62,-4.65,-6.189199594803041
C[NH+]1C(C)(C)CC(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCc3c([nH]c4ccccc34)C2)CC1(C)C,C44940449_decoy,TRY1,Decoy,0,-8.30917,-7.81,-1.01,-5.9136933711580575
C[NH+]1C(C)(C)CC(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCc3c([nH]c4ccccc34)C2)CC1(C)C,C44940453_decoy,TRY1,Decoy,0,-8.40643,-9.16,-1.73,-6.190587828752152
C[NH+]1C(C)(C)CC(NC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCc3c([nH]c4ccccc34)C2)CC1(C)C,C44940463_decoy,TRY1,Decoy,0,-7.53018,-7.61,-2.16,-6.374918209179739
C[C@@H](C(=O)Nc1nc(-c2ccccc2Cl)cs1)[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1,C45841275_decoy,TRY1,Decoy,0,-9.95792,-7.5,-3.15,-6.225723729547849
CC(C)[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(-c4cc([N+](=O)[O-])ccc4Cl)o2)N3)C1,C15947061_decoy,TRY1,Decoy,0,-8.09407,-6.44,-2.56,-5.174728231491721
C[C@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)N1CCNC1=O,C39938798_decoy,TRY1,Decoy,0,-8.64095,-6.4,-1.94,-6.307894745343246
O=C(CNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1)N1CCC(O)(c2ccc(Cl)cc2)CC1,C63294458_decoy,TRY1,Decoy,0,-7.81055,-6.01,-1.41,-6.264675227590231
O=C(CCCNC(=O)N1CCC2=c3cc(Cl)ccc3=[NH+][C@@H]2C1)Nc1ccc2c(c1)OCCO2,C63295074_decoy,TRY1,Decoy,0,-9.0415,-9.95,-3.27,-7.2020141074088295
CCCCN1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C63376157_decoy,TRY1,Decoy,0,-8.87234,-7.42,-1.8,-7.038138811403309
CC(C)(C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccc(Cl)cc21,C63478577_decoy,TRY1,Decoy,0,-9.52035,-6.89,-0.41,-5.601823703774127
Cc1cccc2c1NC(=O)[C@]21N[C@@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C63480283_decoy,TRY1,Decoy,0,-8.48661,-8.5,-0.77,-7.048551077260071
CC1=[NH+]C(C(F)(F)F)(C(F)(F)F)[C@@H]2C([O-])=NC(=O)N(CCC3=c4ccccc4=[NH+][C@H]3C)[C@@H]2N1,C63514076_decoy,TRY1,Decoy,0,-7.20029,-7.73,-3.05,-5.655385770043236
COCCN1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4c(C)cc(C)cc43)[C@H]2C1=O,C63376195_decoy,TRY1,Decoy,0,-9.10482,-7.9,-1.99,-6.6390085717407
O=c1[nH]c2cc([C@@H]3[NH+]=C(c4ccc(Cl)c(F)c4)NO3)ccc2c(=O)n1Cc1ccc(F)cc1,C64392101_decoy,TRY1,Decoy,0,-7.89287,-9.41,-3.24,-7.462039284227611
C[C@H](NC(=O)N1CCN(C(=O)[C@H]2C=c3ccccc3=[NH+]2)CC1)C(=O)Nc1ccc2c(c1)OCCO2,C64480003_decoy,TRY1,Decoy,0,-7.91688,-7.51,-1.38,-5.888616080281655
Cc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3N[C@@H]4CC(C)(C)CC(=O)[C@@H]4S3)CC1=O)C[NH+]=2,C64538151_decoy,TRY1,Decoy,0,-7.05492,-7.1,-1.84,-4.663760611186802
Cc1cccc2c1NC(=O)[C@]21[NH+]2CCC[C@H]2[C@@H](C(=O)c2ccc3c(c2)OCO3)[C@]12C(=O)Nc1ccccc12,C08790850_decoy,TRY1,Decoy,0,-7.54705,-7.27,-2.99,-5.277161877086402
Cc1c(C[NH+]2CCC(O)(c3ccc4oc(C(=O)Nc5ccc6c(c5)OCO6)cc4c3)CC2)cnn1C,C12161354_decoy,TRY1,Decoy,0,-9.78566,-8.65,-4.77,-6.418959658184356
Cc1c(Br)c(=O)n(C2CCCC2)c2nc(Nc3ccc(N4CCC[NH2+]CC4)cn3)ncc12,C13641661_decoy,TRY1,Decoy,0,-9.29419,-7.96,-2.55,-5.759120076259436
Cc1ccc2c(c1C)NC(=O)[C@]21[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)[C@]2(C(=O)Nc3ccccc32)[C@@H]2CCC[NH+]21,C16012234_decoy,TRY1,Decoy,0,-6.31129,-8.88,-0.95,-5.774505919819815
C[NH2+][C@@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)N[C@@H]4O,C16957523_decoy,TRY1,Decoy,0,-7.8467,-7.0,-2.61,-1.8489508106044272
C[C@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+]1CCN(c2oc(-c3ccco3)nc2C#N)CC1,C27104436_decoy,TRY1,Decoy,0,-7.53903,-7.73,-3.08,-6.272234560131834
CC1(C)Cc2c(sc3nc(N4CC[NH+](CC(N)=O)CC4)n(CC(=O)N4CCCCC4)c(=O)c23)CO1,C34734974_decoy,TRY1,Decoy,0,-9.14074,-7.95,-2.05,-7.23139545956804
Cc1sc2[nH]c(C[NH+]3CCN(CC(=O)Nc4sc5c(c4C#N)CCC5)CC3)nc(=O)c2c1C,C22791533_decoy,TRY1,Decoy,0,-9.95383,-6.89,-2.51,-6.18107471903092
CCOc1ccccc1C(=O)[C@H]1[C@H]2CCC[NH+]2[C@@]2(C(=O)Nc3c(C)cccc32)[C@]12C(=O)Nc1ccccc12,C35806813_decoy,TRY1,Decoy,0,-6.89265,-5.56,-2.34,-4.521241017864823
CCOc1ccccc1C(=O)[C@H]1[C@H]2CCC[NH+]2[C@@]2(C(=O)Nc3ccc(C)cc32)[C@]12C(=O)Nc1ccccc12,C35807164_decoy,TRY1,Decoy,0,-7.42936,-5.91,-1.52,-5.377135011303658
[H]/N=C1/Nc2[nH+]c3cc4c(cc3n2[C@@H](c2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)N1)OCCCO4,C19354109_decoy,TRY1,Decoy,0,-9.06525,-6.34,-1.31,-5.66250358524135
O=C(Nc1ccc2c(c1)OCCO2)C1=CC2=[NH+][C@@H](c3ccc4c(c3)OCO4)C[C@@H](C(F)(F)F)N2N1,C01326717_decoy,TRY1,Decoy,0,-8.37773,-9.67,-2.2,-7.4175465168783505
Cc1ccc(S(=O)(=O)[C@H]2c3nc4ccccc4nc3N(/N=C/C3=c4ccccc4=[NH+]C3)[C@@H]2N)cc1C,C38598543_decoy,TRY1,Decoy,0,-9.13637,-8.58,-3.14,-7.839838579986303
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@H]3C=C(S(=O)(=O)Oc4ccccc4)C(F)=C[C@H]3C[C@H]2CO1,C39467371_decoy,TRY1,Decoy,0,-7.59159,-8.34,-1.61,-5.827892247611577
COC1=C[C@@H]2C[NH+]3N[P@@](=O)(c4ccccc4O)OC[C@@H]3C[C@@H]2C=C1S(=O)(=O)Oc1ccccc1,C39467569_decoy,TRY1,Decoy,0,-7.05107,-5.96,-2.18,-5.475731265510475
CS[P@]1(=O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(S(=O)(=O)Oc4ccccc4)=C[C@@H]3C[C@@H]2CO1,C39468675_decoy,TRY1,Decoy,0,-7.95253,-6.61,-2.98,-5.60710388059441
CN1C(=O)[C@]23C[C@H]4C(C)(C)[C@@]5(C[C@@]41C[NH+]2CC[C@@]3(C)O)C(=O)Nc1c5ccc2c1OC=CC(C)(C)O2,C14637263_decoy,TRY1,Decoy,0,-7.23463,-8.8,-1.05,-3.482772911153356
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)N[C@@H](C)c4ccccc4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39597046_decoy,TRY1,Decoy,0,-8.23223,-7.76,-2.25,-5.989611447479296
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)NCc2cc(F)cc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39600602_decoy,TRY1,Decoy,0,-8.40914,-6.36,-1.27,-6.691767307964867
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCc2cc(F)cc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39600604_decoy,TRY1,Decoy,0,-7.83966,-6.89,-1.3,-5.614879979147609
Cc1cc(C(=O)N2C[C@@H](C(=O)NCc3cc(F)cc(C(F)(F)F)c3)C3(CC[NH2+]CC3)C2)nn1C,C39600641_decoy,TRY1,Decoy,0,-8.29878,-6.58,-3.1,-5.943125469409668
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)NCc4ccc5c(c4)OCO5)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39610380_decoy,TRY1,Decoy,0,-9.08287,-7.64,-1.98,-5.713999414244615
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)N[C@H]3CCC[C@H](C)[C@@H]3C)C3(CC[NH2+]CC3)C2)no1,C39637428_decoy,TRY1,Decoy,0,-8.76458,-6.07,-2.22,-6.112178817453184
Cc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(N4CCOCC4)nc3)CC23CC[NH2+]CC3)cc1,C39639396_decoy,TRY1,Decoy,0,-10.5201,-6.53,-3.2,-6.297745976281359
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)N[C@H](C)c2ccc(Br)cc2)C2(CC[NH2+]CC2)C1,C39657166_decoy,TRY1,Decoy,0,-8.43074,-5.04,-1.52,-5.548882075118532
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)N[C@@H]4CCSC4=O)C4(CC[NH2+]CC4)C3)cccc12,C39661357_decoy,TRY1,Decoy,0,-8.32221,-7.46,-1.77,-5.680696310766202
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)N[C@@H](C#N)c4ccccc4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39662598_decoy,TRY1,Decoy,0,-8.63749,-5.92,-1.55,-6.245531519591096
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)N[C@H](C#N)c4ccccc4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39662601_decoy,TRY1,Decoy,0,-8.76395,-8.78,-3.13,-7.851028631900279
Cc1cccc(CNC(=O)[C@@H]2CN(C(=O)c3cnc4c(c(C)nn4C)c3Cl)CC23CC[NH2+]CC3)c1C,C39667672_decoy,TRY1,Decoy,0,-9.68341,-7.64,-1.87,-6.692439378465051
CC(C)(CNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2)N1CCOCC1,C39669817_decoy,TRY1,Decoy,0,-9.87893,-7.43,-1.59,-6.685888699920675
Cc1cc(C(=O)N2C[C@H](C(=O)NCC3(N4CCOCC4)CCCCC3)C3(CC[NH2+]CC3)C2)nn1C,C39672974_decoy,TRY1,Decoy,0,-10.0682,-7.97,-2.42,-7.047293134493019
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)N[C@H](C)C3=C(C)N=N[C@@H]3C)C3(CC[NH2+]CC3)C2)[C@@H](C(F)(F)F)O1,C39674476_decoy,TRY1,Decoy,0,-9.12062,-5.53,-2.78,-5.721733511688034
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccccc4F)o3)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674508_decoy,TRY1,Decoy,0,-8.35491,-6.51,-1.51,-6.030451710343371
CC1=C([C@H](C)NC(=O)[C@H]2CN(C(=O)c3cnc4c(c(C)nn4C)c3Cl)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674544_decoy,TRY1,Decoy,0,-8.45151,-7.5,-3.15,-5.935329773564362
Cc1cc(-c2onc(C)c2C(=O)N2C[C@H](C(=O)NCc3sccc3C)C3(CC[NH2+]CC3)C2)no1,C39677283_decoy,TRY1,Decoy,0,-8.80751,-8.23,-2.33,-6.877018209403072
Cc1ccsc1CNC(=O)[C@@H]1CN(C(=O)c2cnc3c(c(C)nn3C)c2Cl)CC12CC[NH2+]CC2,C39677336_decoy,TRY1,Decoy,0,-9.92386,-5.77,-2.14,-6.50412643481308
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2ccncc2)C2(CC[NH2+]CC2)C1,C39680931_decoy,TRY1,Decoy,0,-9.30233,-8.46,-2.73,-7.952356264165378
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NCc4ccc(C#N)cc4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39684976_decoy,TRY1,Decoy,0,-8.51145,-9.06,-2.35,-6.970970963939887
COc1c(C(=O)N2C[C@H](C(=O)NC3CCN(C(=O)C(C)C)CC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39686075_decoy,TRY1,Decoy,0,-9.72103,-6.18,-3.84,-7.606208780423019
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NC3CCN(c4ncccc4Cl)CC3)C3(CC[NH2+]CC3)C2)CC1,C39687813_decoy,TRY1,Decoy,0,-9.02502,-6.29,-1.5,-5.7777548277435935
CCc1ccc([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cnc4c(c(C)nn4C)c3Cl)CC23CC[NH2+]CC3)cc1,C39696290_decoy,TRY1,Decoy,0,-8.84497,-6.23,-3.82,-5.559338133765207
CN1CCO[C@@H](CNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3F)CC23CC[NH2+]CC3)C1,C39696675_decoy,TRY1,Decoy,0,-8.29102,-6.4,-2.4,-5.757990761631766
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C63374735_decoy,TRY1,Decoy,0,-7.75297,-8.83,-2.17,-6.65015024072125
Cc1cccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)c1,C63479956_decoy,TRY1,Decoy,0,-8.69752,-9.47,-1.16,-6.816880800621827
Cc1cccc2c1NC(=O)[C@]21N[C@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@H]21,C63480021_decoy,TRY1,Decoy,0,-8.66877,-7.58,-3.96,-5.610435850049568
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)c1,C63480114_decoy,TRY1,Decoy,0,-7.19808,-8.86,-1.52,-6.7513390711529
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1,C63480126_decoy,TRY1,Decoy,0,-8.26978,-8.43,-2.35,-6.577492990289314
Cc1ncc2c(c1CNC(=O)[C@H]1C=c3ccccc3=[NH+]1)CCN(C(=O)c1cc3c([nH]c1=O)CCCC3)C2,C64007177_decoy,TRY1,Decoy,0,-9.05327,-8.23,-3.47,-6.240663580792157
CC1CC[NH+](c2ccc([C@H]3NO[C@@H](C(=O)N4CCN(C(=O)C5=C[C@H]6N=CC=C6C=C5)CC4)N3)cc2)CC1,C64471141_decoy,TRY1,Decoy,0,-8.81196,-6.34,-2.78,-6.082062446522525
CC1CC[NH+](c2ccc([C@H]3NO[C@@H](C(=O)N4CCN(C(=O)C5=CC=C[C@H]6N=CC=C56)CC4)N3)cc2)CC1,C64649131_decoy,TRY1,Decoy,0,-8.37529,-6.0,-3.26,-5.344468798914615
O=S(=O)(Nc1cccc(-c2nnnn2C2CC2)c1)c1cc(Br)ccc1Br,C08725670_decoy,TRY1,Decoy,0,-8.96266,-7.21,-1.75,-5.884848685021048
COc1ccc(N2C[C@@H](NC(=O)N3CCn4cccc4[C@@H]3c3ccc(Br)cc3)CC2=O)cc1,C09446852_decoy,TRY1,Decoy,0,-8.35002,-6.54,-1.22,-5.565153827870429
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(Br)c1OC(C)C,C01207242_decoy,TRY1,Decoy,0,-8.51608,-5.84,-1.5,-5.359200365305473
CN1C(=O)N(C)[C@]2(c3ccccc3)N=C3SC4=C(C(=O)c5ccccc5C4=O)N3N[C@]12c1ccccc1,C01060133_decoy,TRY1,Decoy,0,-6.65247,-7.69,-1.39,-4.964495824537399
O=C1COc2ccc(C(=O)CSc3nc4sc5c(c4c(=O)n3-c3ccccc3)CCCC5)cc2N1,C13149874_decoy,TRY1,Decoy,0,-9.51267,-7.48,-1.8,-6.369441079643013
Cc1ccc(-n2ncc3c(=O)n4c(nc32)SC[C@H]4CC(=O)Nc2ccc(Cl)c(Cl)c2)c(C)c1,C14014330_decoy,TRY1,Decoy,0,-9.47292,-8.53,-0.74,-7.522726680373437
Cc1cc(/C=C(\C#N)C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)c(C)n1-c1ccc(F)cc1,C14462235_decoy,TRY1,Decoy,0,-7.86505,-7.17,-2.5,-5.124276782085198
Cc1nc(CN(C)C(=O)[C@H]2CC(=O)c3sc(NC(=O)c4c(F)cccc4Cl)nc3C2)cs1,C15070243_decoy,TRY1,Decoy,0,-10.4957,-6.83,-2.52,-6.820928597293327
COc1ccc([C@H]2Oc3ccccc3-n3c(-c4ccc(C)cc4)c4c(=O)n(C)c(=O)n(C)c4c32)cc1O,C15858927_decoy,TRY1,Decoy,0,-8.37505,-9.23,-3.05,-8.485179072632231
CN(C)c1ccc(/C=c2\sc3n(c2=O)[C@@H]2c4ccccc4O[C@](C)(N=3)[C@H]2C(=O)Nc2ccccc2)cc1,C16740732_decoy,TRY1,Decoy,0,-9.50521,-5.88,-0.86,-5.970805623506635
CC1(C)[C@@H]([N+](=O)[O-])[C@@H](c2ccc(Br)cc2)N[C@@H](c2ccc(Br)cc2)[C@@H]1[N+](=O)[O-],C12437014_decoy,TRY1,Decoy,0,-8.52142,-5.96,-1.51,-5.718355741539581
O=S(=O)(c1cccc(Cl)c1)c1nnn2c1nc(Nc1cccc(C(F)(F)F)c1)c1sccc12,C20516501_decoy,TRY1,Decoy,0,-8.81963,-8.85,-2.04,-8.105014467723256
O=C1C[C@H](c2nnc(NC(=O)N3c4ccccc4Sc4ccccc43)s2)CN1c1ccc(F)cc1,C20583687_decoy,TRY1,Decoy,0,-8.14517,-10.05,-2.9,-8.208704529014005
COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3c3n2-c2ccccc2N[C@H]3c2ccccc2Cl)cc1,C20898622_decoy,TRY1,Decoy,0,-6.3576,-7.33,-3.85,-4.695406358736395
Oc1c([C@H](c2ccc(Cl)cc2)N2CCN(c3ccccc3F)CC2)sc2nc(-c3ccco3)nn12,C22851979_decoy,TRY1,Decoy,0,-11.4267,-8.28,-1.29,-8.989556165898817
Oc1c([C@H](c2cccc(F)c2)N2CCN(c3cccc(Cl)c3)CC2)sc2nc(-c3ccco3)nn12,C22852183_decoy,TRY1,Decoy,0,-10.472,-8.11,-2.85,-7.069660995985316
COc1ccc([C@H]2C3=C(Nc4nnnn42)c2ccccc2O[C@@H]3c2ccc(F)c(Br)c2)cc1,C28055976_decoy,TRY1,Decoy,0,-8.15162,-6.3,-4.63,-5.1738766587923335
COc1ccc([C@H]2C3=C(Nc4nnnn42)c2cc(Cl)ccc2O[C@@H]3c2ccc(Cl)c(F)c2)cc1,C28056000_decoy,TRY1,Decoy,0,-7.9319,-6.97,-1.98,-5.265107729573939
Clc1ccc2c(c1)C1=C([C@H](c3cccnc3)n3nnnc3N1)[C@@H](c1cccc(Br)c1)O2,C28060277_decoy,TRY1,Decoy,0,-6.93198,-5.12,-0.08,-4.034407247595689
COc1cc(/C=N\c2ccc3c(c2)OCCOCCOCCOCCO3)cc(Br)c1O,C20615567_decoy,TRY1,Decoy,0,-7.96416,-6.71,-1.92,-5.047624868617832
O=c1c2[nH]c3ccccc3c2nc(SCc2ccc(Br)cc2)n1-c1ccc([N+](=O)[O-])cc1,C34911655_decoy,TRY1,Decoy,0,-8.45479,-7.83,-1.87,-5.927309902055628
Cc1sc2nc([C@H](C)Sc3nc4cc(Cl)ccc4c(=O)n3Cc3ccco3)[nH]c(=O)c2c1C,C21234423_decoy,TRY1,Decoy,0,-8.27501,-5.81,-1.26,-5.176175254131812
Cc1ccc(C(=O)[C@@H]2[C@H](c3cccc([N+](=O)[O-])c3)[C@@H]3CSCN3[C@@]23C(=O)Nc2ccc(C)cc23)cc1,C36316831_decoy,TRY1,Decoy,0,-7.3328,-7.31,-3.92,-5.653187662270658
O=C(/N=c1\[nH]c(C23CC4CC(CC(C4)C2)C3)cs1)[C@H]1C(=O)[C@H]2CCCC[C@H]2N(Cc2ccco2)C1=O,C38925602_decoy,TRY1,Decoy,0,-8.27149,-7.78,-3.6,-5.758185717812017
CC1(C)[C@@H]([N+](=O)[O-])[C@@H](c2ccc(Br)cc2)N[C@H](c2ccc(Br)cc2)[C@H]1[N+](=O)[O-],C33929618_decoy,TRY1,Decoy,0,-8.32652,-5.74,-1.81,-5.272628235209148
CCOc1cc2c(cc1I)[C@H]1CO[P@@](=O)(S(=O)(=O)C(C)C)NN1CC2,C39466375_decoy,TRY1,Decoy,0,-6.83089,-6.01,-0.97,-4.447662836799331
Cc1cccn2c(=O)c(/C=C(/C#N)C(=O)Nc3cccc(Cl)c3Cl)c(Oc3ccccc3F)nc12,C39858734_decoy,TRY1,Decoy,0,-7.68218,-7.17,-2.95,-5.981841970569052
Clc1ccc(CSc2nnc3c(n2)O[C@H]([C@@H]2C=NN=C2c2ccccc2)Nc2ccccc2-3)cc1,C39960149_decoy,TRY1,Decoy,0,-7.9228,-6.85,-2.19,-5.501937775345656
Clc1ccc(CSc2nnc3c(n2)O[C@@H]([C@@H]2C=NN=C2c2ccccc2)Nc2ccccc2-3)cc1,C39960151_decoy,TRY1,Decoy,0,-10.0586,-8.9,-1.6,-7.997215024006755
C[C@@H]1C[C@H](C)CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)Nc2cccc(Cl)c2Cl)C1,C39993917_decoy,TRY1,Decoy,0,-8.744,-8.01,-1.05,-6.331191677830223
CCOc1ccc2nc(N3C(=O)c4oc5ccc(CC)cc5c(=O)c4[C@H]3c3cccc(O)c3)sc2c1,C40046161_decoy,TRY1,Decoy,0,-9.54753,-6.58,-1.94,-6.419341996708298
Cc1cc(-n2ccc(-c3nccs3)n2)c2[nH]c(=O)n(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c2n1,C40394190_decoy,TRY1,Decoy,0,-9.46294,-9.41,-2.89,-9.075134959348942
COc1ccc(-c2cc(NC(=O)c3sc4cc(C)ccc4c3Cl)n([C@@H]3CCS(=O)(=O)C3)n2)cc1,C41025200_decoy,TRY1,Decoy,0,-10.5354,-6.26,-1.89,-7.385076892559839
[H]/N=C1C(=C/c2cc(C)n(-c3c(C)cccc3C)c2C)/C(=O)N=C2SC(COc3ccccc3C)=NN2/1,C41108329_decoy,TRY1,Decoy,0,-7.61358,-6.35,-1.55,-5.622600076404502
CCC(=O)OCC(=O)[C@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@]12C,C43191477_decoy,TRY1,Decoy,0,-7.92558,-7.3,-2.23,-6.215063257696938
COc1ccc(OC)c([C@@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N([C@H](C)c4ccccc4)CC(=O)N23)c1,C43741653_decoy,TRY1,Decoy,0,-6.9999,-7.52,-0.42,-7.555626539529352
CC(C)C[C@H]1N[C@@]2(c3ccccc3-n3c2nc2ccccc2c3=O)[C@H]2C(=O)N(c3ccccc3F)C(=O)[C@@H]12,C13690472_decoy,TRY1,Decoy,0,-7.61081,-8.82,-0.61,-5.878637364857711
CC(C)[C@H]1N[C@@]2(c3ccccc3-n3c2nc2ccccc2c3=O)[C@H]2C(=O)N(c3ccccc3F)C(=O)[C@@H]12,C13719833_decoy,TRY1,Decoy,0,-8.73348,-6.0,-2.0,-4.755150190211491
CC(C)[C@H]1N[C@@]2(c3ccccc3-n3c2nc2ccccc2c3=O)[C@H]2C(=O)N(c3ccccc3Cl)C(=O)[C@@H]12,C13734213_decoy,TRY1,Decoy,0,-8.06834,-5.91,-1.48,-4.489722221161599
Cn1c(=O)[nH]c(=O)c2c1nc1n2C[C@@H](COc2c(Br)cc(Br)cc2Br)O1,C01242754_decoy,TRY1,Decoy,0,-8.87775,-4.86,-2.06,-5.16373757386649
CSc1ccccc1NC(=O)c1cc(-c2cccs2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1,C57309569_decoy,TRY1,Decoy,0,-9.8342,-6.76,-0.64,-6.891810436747615
COc1ccc([C@@H]2Oc3ccccc3C3=C2[C@@H](c2ccc(C)cc2)n2nc(SC)nc2N3)c(OC)c1,C13811355_decoy,TRY1,Decoy,0,-7.53001,-6.02,-3.68,-5.018634817345982
[H]/N=C1C(=C/c2ccc(OCc3ccc(Cl)cc3Cl)cc2)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C09192143_decoy,TRY1,Decoy,0,-8.36966,-6.28,-3.6,-5.146500891712449
[H]/N=C1C(=C\c2cc(C)n(-c3cccc(Br)c3)c2C)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C09281248_decoy,TRY1,Decoy,0,-8.55721,-5.96,-1.19,-4.77543894943206
[H]/N=C1C(=C\c2cc(C)n(-c3ccc(C)cc3C)c2C)/C(=O)N=C2SC(COc3ccccc3C)=NN2/1,C09293365_decoy,TRY1,Decoy,0,-8.7548,-6.18,-1.8,-5.351374705607682
O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCN(S(=O)(=O)c2cccc(Br)c2)CC1,C11337926_decoy,TRY1,Decoy,0,-8.46326,-7.07,-2.15,-5.315123119716265
[H]/N=C1C(=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C33756585_decoy,TRY1,Decoy,0,-8.68975,-6.51,-1.43,-5.563978362169178
Cc1cccc(N2CCN(C(=O)CC3(CC4=NS(=O)(=O)c5ccccc5N4)CCCC3)C[C@H]2C)c1,C32961405_decoy,TRY1,Decoy,0,-9.25276,-8.63,-1.72,-7.655789252050272
Cc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2c4ccccc4C=NN2[C@@H]3C(=O)Nc2ccc(Cl)cc2)c(C)c1,C18066605_decoy,TRY1,Decoy,0,-9.55719,-8.4,-1.89,-6.794062938816976
Cc1ccc2c(c1)NC(=O)c1cc(S(=O)(=O)N(C)C)c(Oc3ccc(Br)cc3)cc1O2,C64986688_decoy,TRY1,Decoy,0,-7.77012,-7.14,-1.5,-6.390490705473365
COc1cc([C@@H]2Oc3c(O)cc([C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O)cc3[C@H]2CO)ccc1O,C03793048_decoy,TRY1,Decoy,0,-12.1763,-7.63,-1.55,-7.702047338555185
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c(O)c1C2=O,C03881814_decoy,TRY1,Decoy,0,-7.62353,-8.42,-3.03,-5.184948328311921
Nc1nc2c(nc(SCc3ccccc3Br)n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C02161250_decoy,TRY1,Decoy,0,-8.91546,-7.75,-2.28,-9.942982467487916
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C04096135_decoy,TRY1,Decoy,0,-9.11605,-7.47,-4.29,-5.617392755047007
CCC(C)(C)NC(=O)[C@@H](c1ccc(C)o1)N(Cc1ccccc1F)C(=O)c1snc(C(N)=O)c1N,C06462118_decoy,TRY1,Decoy,0,-8.48457,-6.99,-3.92,-8.930483725671076
CCOc1ccc([C@H](C(=O)NCCC(C)C)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)cc1,C06601651_decoy,TRY1,Decoy,0,-7.96748,-7.13,-3.24,-7.732728085751185
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@@H]1CCCO1)c1ccc(C)o1,C06631426_decoy,TRY1,Decoy,0,-6.94748,-7.59,-1.61,-7.561911680989094
CC1=C(C2=C(C)[C@H](C(C)C)C3=C(C(=O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@H](O)C2=C([C@@H]1C(C)C)[C@H](O)[C@H](O)C2=O,C08681780_decoy,TRY1,Decoy,0,-8.59338,-7.45,-1.04,-6.688522628306122
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@]1(O)CC[C@H]2C1=CC(=O)OC1,C08739036_decoy,TRY1,Decoy,0,-8.74681,-6.09,-1.79,-5.297323703913785
C[C@]12CC[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@]1(O)CC[C@H]2C1=CC(=O)OC1,C08914903_decoy,TRY1,Decoy,0,-8.46315,-6.5,-1.99,-5.649012080556468
CC1(O)[C@](C)(O)[C@](C)(O)C(C)(O[P@](=O)([O-])Oc2ccc([N+](=O)[O-])cc2)[C@](C)(O)[C@]1(C)O,C09970451_decoy,TRY1,Decoy,0,-6.74512,-6.37,-2.78,-5.134989984268783
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc2ccccc12,C12467480_decoy,TRY1,Decoy,0,-8.60886,-7.71,-1.39,-10.260064548866293
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12477066_decoy,TRY1,Decoy,0,-7.16638,-6.31,-2.92,-5.704214966631856
CCOc1cc(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3)coc2c1,C12654514_decoy,TRY1,Decoy,0,-9.28578,-6.27,-3.93,-5.064430898308656
O=C([O-])c1[nH]nc(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C12656501_decoy,TRY1,Decoy,0,-8.39063,-6.29,-4.09,-5.216099726713205
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(=O)oc2c1C,C12896804_decoy,TRY1,Decoy,0,-7.72352,-7.07,-2.31,-5.651191541833366
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c(O)c1C2=O,C13547732_decoy,TRY1,Decoy,0,-6.95152,-9.02,-2.06,-5.403969178312622
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@H]2C1=CC(=O)OC1,C17057353_decoy,TRY1,Decoy,0,-9.00881,-6.84,-2.09,-5.668898824158073
Cc1c2c(c([O-])c3c(O)ccc(Cl)c13)C(=O)[C@@]1(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@H]1C2,C19899111_decoy,TRY1,Decoy,0,-6.55718,-6.95,-1.96,-4.202747269656073
C=CCc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3Br)n2N)c1O,C20527513_decoy,TRY1,Decoy,0,-9.52285,-8.23,-2.74,-7.44356213751562
O=C([O-])[C@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C21992914_decoy,TRY1,Decoy,0,-6.92251,-7.84,-2.18,-5.999308644735223
C[C@H]1[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)O[C@@H](c2ccc(O)cc2)[C@@]1(C)O,C31164898_decoy,TRY1,Decoy,0,-7.67834,-7.4,-2.27,-7.176239967250641
C[C@@H]1O[C@@H](O[C@@]23C(=O)[C@@H](O)[C@](C)(O)C[C@]2(O)C=CC2=C3C(=O)c3cccc(O)c3C2=O)CC[C@H]1O,C35458031_decoy,TRY1,Decoy,0,-6.70482,-8.65,-1.77,-5.0460709323092585
C[C@@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493878_decoy,TRY1,Decoy,0,-8.28211,-6.03,-2.86,-5.963333350321502
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C35493889_decoy,TRY1,Decoy,0,-7.54811,-5.59,-2.16,-4.900070265229296
O=C([O-])c1[nH]nc(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C08740254_decoy,TRY1,Decoy,0,-8.52372,-7.7,-2.67,-6.947200348218571
Nc1nc2c(nc(Sc3ccccc3N)n2[C@@H]2O[C@@H]3CO[P@@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C36488909_decoy,TRY1,Decoy,0,-7.7761,-8.54,-2.2,-7.244829035083953
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36597689_decoy,TRY1,Decoy,0,-8.91054,-6.38,-1.11,-7.613637163939693
C=C1c2cccc(O)c2C(=O)[C@]2(Cl)C(=O)[C@]3(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@@H]3C[C@H]12,C34881891_decoy,TRY1,Decoy,0,-6.2255,-4.91,-1.45,-4.086957225841515
C=C1c2cccc(O)c2C(=O)[C@]2(Cl)C(=O)[C@]3(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@H]3C[C@H]12,C37246166_decoy,TRY1,Decoy,0,-6.01707,-5.24,-1.07,-3.798668513391356
O=C([O-])c1cc(O)c(O)c(O)c1-c1c(O)c(O)c2oc(=O)c3cc(O)c(O)c4oc(=O)c1c2c43,C15216593_decoy,TRY1,Decoy,0,-8.13105,-9.16,-3.39,-6.904545697933328
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@@H](O)[C@@H]3C[C@@H]12,C36384893_decoy1,TRY1,Decoy,0,-7.15495,-7.56,,-6.497949892767301
COc1c(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccc(O)cc3)cc(=O)c2c1O,C31160567_decoy,TRY1,Decoy,0,-7.59925,-7.89,-2.17,-7.193824757407275
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c(O)c1C2=O,C03830558_decoy,TRY1,Decoy,0,-7.56058,-8.63,-3.46,-5.237957175858474
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c(O)c1C2=O,C03830556_decoy,TRY1,Decoy,0,-6.78018,-7.36,-1.94,-4.292755004022835
O=C([O-])C1=NN=C(c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[C@@H]1c1ccc2c(c1)OCCO2,C38168314_decoy2,TRY1,Decoy,0,-7.28412,-6.85,,-5.6156733073200895
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)c(O)c(O)c21,C39778196_decoy,TRY1,Decoy,0,-8.50474,-7.23,-4.03,-5.4619595472683375
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@@H](O)[C@@H]3C[C@H]12,C42685583_decoy,TRY1,Decoy,0,-6.12194,-5.69,-2.43,-3.460161750494463
C/C(=N\NC(N)=O)[C@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@]4(C)[C@@H]3CC[C@@]12C,C43760900_decoy,TRY1,Decoy,0,-8.51566,-5.91,-1.88,-6.092312715183031
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@H](O)CC[C@]34/C=N/NC(N)=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43867019_decoy,TRY1,Decoy,0,-8.69722,-6.19,-2.33,-5.143985814046321
O=C([O-])[C@@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@H](O)[C@@H]1O,C33949417_decoy,TRY1,Decoy,0,-7.35068,-8.67,-2.06,-5.337252006561391
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@@H](O)[C@H]3C[C@@H]12,C44122690_decoy,TRY1,Decoy,0,-8.3865,-6.88,-1.72,-5.237178313199406
O=[P@@]([O-])(Oc1c[nH]c2ccc(Br)c(Cl)c12)OC1[C@@H](O)[C@H](O)C(O)[C@@H](O)[C@H]1O,C15206025_decoy,TRY1,Decoy,0,-7.79,-5.28,-2.37,-4.843631021446945
O=C([O-])[C@@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C34245013_decoy,TRY1,Decoy,0,-8.52543,-9.13,-3.68,-8.090120772263894
O=C([O-])C1=NN=C(c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[C@H]1c1ccc2c(c1)OCCO2,C38168313_decoy2,TRY1,Decoy,0,-7.64824,-8.91,,-6.269201543904229
CN(C)[C@@H]1C(=O)/C(=C(/O)NCN2CCCC2)C(=O)[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@@H]12,C14880004_decoy,TRY1,Decoy,0,-9.17512,-6.23,-2.54,-6.358824739677029
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@@H]12,C13719769_decoy2,TRY1,Decoy,0,-8.46883,-7.21,,-5.742083312259861
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@H](O)[C@@H]3C[C@@H]12,C36384893_decoy2,TRY1,Decoy,0,-8.34317,-7.49,,-6.132733588301576
Cc1c(C(=O)[O-])c(O)cc2c1C(=O)c1c(O)c(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c1C2=O,C65735197_decoy,TRY1,Decoy,0,-8.13603,-8.44,-4.3,-5.933346021333503
CSc1ccc2c(cc1=O)[C@H](NC(=O)c1cc(O)c(O)c(O)c1)CCc1cc(O)c(O)c(O)c1-2,C05810283_decoy,TRY1,Decoy,0,-11.1187,-7.19,-1.42,-7.64785631240923
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@@H]1CCCO1)c1ccc(C)o1,C06631485_decoy,TRY1,Decoy,0,-7.82715,-4.81,-4.25,-5.549669413274875
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06135946_decoy,TRY1,Decoy,0,-7.9765,-8.2,-3.89,-8.400498217203443
CC1=C(C2=C(C)[C@H](C(C)C)C3=C(C(=O)[C@@H](O)[C@H]3O)[C@H]2O)[C@@H](O)C2=C([C@H]1C(C)C)[C@@H](O)[C@@H](O)C2=O,C08681782_decoy,TRY1,Decoy,0,-8.9424,-6.93,-3.01,-6.4246615957025845
O=C([O-])c1[nH]nc(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C08740130_decoy,TRY1,Decoy,0,-7.96724,-6.37,-3.26,-5.229402918206857
O=C([O-])c1[nH]nc(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C08740131_decoy,TRY1,Decoy,0,-8.44404,-6.46,-3.04,-5.914862473936405
COCCNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(Cl)c1,C12467303_decoy,TRY1,Decoy,0,-7.80183,-7.82,-1.92,-9.223855178073448
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1,C12473251_decoy,TRY1,Decoy,0,-8.44724,-6.94,-2.64,-6.528791907648633
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(C)o2)c1,C12480001_decoy,TRY1,Decoy,0,-8.37886,-6.46,-3.67,-6.68559094963078
O=C([O-])c1[nH]nc(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2O)c1-c1ccc2c(c1)OCCO2,C12656496_decoy,TRY1,Decoy,0,-8.46381,-6.83,-1.71,-7.381221627602892
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@H](O)[C@H](O)C[C@]4(C)[C@@H]3CC[C@]12C,C12868003_decoy,TRY1,Decoy,0,-9.90456,-7.34,-3.43,-5.962186842099911
O=[P@@]([O-])(Oc1c[nH]c2ccc(Br)c(Cl)c12)OC1[C@H](O)[C@H](O)C(O)[C@@H](O)[C@H]1O,C15206019_decoy,TRY1,Decoy,0,-7.97554,-5.75,-1.68,-5.635098972532517
O=[P@@]([O-])(Oc1c[nH]c2cc(Cl)c(Br)cc12)OC1[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]1O,C15206028_decoy,TRY1,Decoy,0,-8.89561,-6.48,-1.35,-5.4680371351425565
CSc1ccc2c(cc1=O)[C@@H](NC(=O)c1cc(O)c(O)c(O)c1)CCc1cc(O)c(O)c(O)c1-2,C17211745_decoy,TRY1,Decoy,0,-11.1795,-5.94,-1.91,-6.3121847731968845
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@@H]3C[C@H]12,C16605480_decoy,TRY1,Decoy,0,-8.09842,-6.96,-1.79,-4.622110883853303
Nc1nc2c(nc(Sc3ccc(Cl)cc3)n2[C@@H]2O[C@H]3CO[PH](O)([S-])O[C@@H]3[C@@H]2O)c(=O)[nH]1,C22309439_decoy,TRY1,Decoy,0,-8.4308,-8.51,,99.0
CC(C)=CCc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc2c(c1O)C(=O)[C@H](O)[C@@H](c1ccc(O)cc1)O2,C31166803_decoy,TRY1,Decoy,0,-10.3654,-6.67,-2.6,-7.010416036184191
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31169836_decoy,TRY1,Decoy,0,-7.82903,-9.25,-1.95,-7.967288383859374
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31169843_decoy,TRY1,Decoy,0,-8.32548,-7.49,-5.06,-5.526270825941045
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]3c2ccc(C#N)cc2)cc1,C33516264_decoy,TRY1,Decoy,0,-9.44995,-6.36,-2.78,-6.827219904996936
C/C(=N\NC(N)=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@@]4(C)[C@@H]3CC[C@]12C,C37246031_decoy,TRY1,Decoy,0,-8.96952,-7.49,-2.02,-6.295369612315543
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)o1,C12715065_decoy,TRY1,Decoy,0,-8.24606,-7.51,-0.9,-7.469172891464074
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]12,C36386996_decoy1,TRY1,Decoy,0,-8.7564,-6.99,,-5.659710420390227
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@H]3C[C@@H]12,C35025000_decoy,TRY1,Decoy,0,-8.97328,-7.68,-2.96,-5.795940529012521
C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)c(CO)c(O)c3c2=O)C(O)(O)C(O)(O)[C@@H]1O,C38652860_decoy,TRY1,Decoy,0,-8.8174,-8.32,-2.71,-5.6269615596962765
[NH-]C1=NC(=O)C2=N[C@@H](N/N=C/c3ccc(Br)cc3)N([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39774489_decoy,TRY1,Decoy,0,-7.37496,-8.37,-0.96,-7.087058819789975
C[C@H]1O[C@@H](O[C@]23C(=O)[C@@H](O)[C@](C)(O)C[C@@]2(O)C=CC2=C3C(=O)c3cccc(O)c3C2=O)CC[C@H]1O,C34000923_decoy,TRY1,Decoy,0,-7.43074,-6.38,-1.9,-4.698281600978183
C[C@H]1O[C@@H](O[C@]23C(=O)[C@@H](O)[C@](C)(O)C[C@@]2(O)C=CC2=C3C(=O)c3cccc(O)c3C2=O)CC[C@@H]1O,C43509853_decoy,TRY1,Decoy,0,-6.7821,-6.92,-1.68,-4.385151385959015
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@]2(O)C3=CC(=O)[C@@]4(O)C[C@H](O)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C43742900_decoy,TRY1,Decoy,0,-9.77556,-7.97,-2.01,-6.6943433630621865
CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@]4(O)C[C@H](O)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C43742902_decoy,TRY1,Decoy,0,-10.9792,-6.63,-3.84,-6.424359696035136
C/C(=N\NC(N)=O)[C@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3CCC4=C/C(=N\NC(N)=O)CC[C@]4(C)[C@H]3CC[C@@]12C,C43760902_decoy,TRY1,Decoy,0,-8.42246,-7.68,-2.49,-5.6279600148129285
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C43875533_decoy1,TRY1,Decoy,0,-8.24728,-5.95,,-4.668012501921891
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@H]3C[C@@H]12,C44019563_decoy,TRY1,Decoy,0,-8.94149,-5.8,-2.61,-4.6105701253073335
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@H]3C[C@H]12,C16968410_decoy,TRY1,Decoy,0,-9.02798,-6.49,-2.34,-4.874771196910349
CC(C)(O)CC[C@@H](O)[C@@](C)(O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@]4(O)C[C@@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C,C44607990_decoy,TRY1,Decoy,0,-11.2465,-7.7,-3.28,-7.036990862195679
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@]2(O)C([O-])=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@@H]3C[C@H]12,C44830179_decoy,TRY1,Decoy,0,-6.24662,-6.02,-3.37,-4.151038691829585
Nc1cc(N)c(/N=N/c2cccc3c(S(=O)(=O)[O-])cccc23)cc1/N=N/c1cc([N+](=O)[O-])ccc1O,C17125363_decoy,TRY1,Decoy,0,-5.61743,-5.77,-3.04,-4.170726580730568
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@H]3C[C@H]12,C34800281_decoy,TRY1,Decoy,0,-8.6082,-7.0,-3.4,-5.00679453619439
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@@H]3C[C@@H]12,C16916308_decoy,TRY1,Decoy,0,-7.53886,-7.21,-2.33,-4.885722913314945
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C34800282_decoy1,TRY1,Decoy,0,-8.5555,-5.9,,-4.559548208090267
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@](C)(O)[C@H]3C[C@@H]12,C44019566_decoy,TRY1,Decoy,0,-8.85003,-7.25,-3.21,-5.141528705854028
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@@H]3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@@H]12,C36372564_decoy,TRY1,Decoy,0,-9.26518,-6.6,-1.69,-4.558463050690326
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)[C@H]3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@@H]3C[C@@H]12,C36372561_decoy,TRY1,Decoy,0,-8.22137,-5.29,-2.51,-4.743926141905489
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12,C36386996_decoy2,TRY1,Decoy,0,-7.85754,-5.92,,-3.875396061962432
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C43769567_decoy,TRY1,Decoy,0,-8.77925,-7.51,-1.08,-6.640700507119249
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C34800282_decoy2,TRY1,Decoy,0,-9.58672,-5.76,,-4.478200347651844
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@@H]12,C36532651_decoy,TRY1,Decoy,0,-7.70885,-5.86,-3.48,-4.311095883472515
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C43875533_decoy2,TRY1,Decoy,0,-9.04408,-5.84,,-4.917906069252312
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@H]12,C44963024_decoy,TRY1,Decoy,0,-7.59495,-5.94,-1.76,-4.073670753945944
O=C1O[C@@H]2[C@@H](O)CO[C@]2(O)[C@]1(O)Cc1cc(O)c(O)c(Br)c1Br,C01612852_decoy,TRY1,Decoy,0,-8.09858,-5.94,-1.95,-5.07282325944633
CC(C)(C)NC(=O)[C@@H](c1cccs1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06074702_decoy,TRY1,Decoy,0,-8.71039,-5.74,-1.78,-7.096376835470666
CC(C)(C)NC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(Cl)cc1,C06075135_decoy,TRY1,Decoy,0,-8.41473,-4.93,-3.23,-5.715648126875401
CCOC(=O)CNC(=O)[C@@H](c1ccc(F)cc1)N(CCOC)C(=O)c1snc(C(N)=O)c1N,C06546634_decoy,TRY1,Decoy,0,-8.50495,-6.66,-2.66,-8.64190293395896
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@H]1CCCO1)c1ccc(C)o1,C06631486_decoy,TRY1,Decoy,0,-7.75842,-7.46,-2.76,-9.037505904419069
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(=O)oc2c1C,C08764219_decoy,TRY1,Decoy,0,-7.96016,-6.75,-3.13,-5.378278890016825
Cc1cc(=O)oc2cc(O[P@](=O)([O-])OC3(C)[C@](C)(O)[C@](C)(O)C(C)(O)[C@](C)(O)[C@]3(C)O)ccc12,C09970416_decoy,TRY1,Decoy,0,-7.32372,-7.97,-1.69,-5.6732842896995965
CC1(O[P@](=O)([O-])Oc2ccc([N+](=O)[O-])cc2)[C@](C)(O)[C@@](C)(O)C(C)(O)[C@@](C)(O)[C@@]1(C)O,C09970453_decoy,TRY1,Decoy,0,-7.40934,-6.81,-4.47,-6.478573066997656
O=C([O-])[C@@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O,C12153629_decoy,TRY1,Decoy,0,-7.95694,-8.45,-1.6,-6.443151271397589
COCCNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(Cl)c1,C12467308_decoy,TRY1,Decoy,0,-7.49867,-5.83,-3.4,-5.748203435804812
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1C,C12473209_decoy,TRY1,Decoy,0,-8.08495,-6.67,-0.4,-6.684107583581255
NC(=O)c1nsc(C(=O)N(c2ccc(Cl)cc2)[C@H](C(=O)NC2CCCC2)c2ccncc2)c1N,C06444839_decoy,TRY1,Decoy,0,-7.6985,-8.3,-1.65,-9.01929777032455
Nc1nc(SCc2cc([N+](=O)[O-])ccc2[O-])c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1,C25782760_decoy,TRY1,Decoy,0,-7.36741,-7.17,-2.49,-6.886238590945646
CC[C@H](C)[C@@H]1NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CSSC[C@@H](NC1=O)C(=O)N2,C31158267_decoy,TRY1,Decoy,0,-7.61455,-6.07,-3.4,-6.454831453850447
COc1c(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c1O,C31168484_decoy,TRY1,Decoy,0,-8.76298,-7.29,-3.86,-5.419453182484027
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31169847_decoy,TRY1,Decoy,0,-7.29708,-8.9,-1.52,-7.956784138403709
COc1c(-c2ccc(O)cc2)cc(OC)c2c1oc1cc(O)c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)cc12,C31170159_decoy,TRY1,Decoy,0,-8.62956,-7.54,-2.41,-6.999225780260289
Nc1ccc(C(=O)N/C(=C\c2ccc3c(c2)OCO3)c2nc3c([O-])[nH]c(=S)nc3[nH]2)cc1,C17190690_decoy,TRY1,Decoy,0,-9.02952,-9.07,-0.88,-8.329259593971212
Nc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)c2nc3c([O-])[nH]c(=S)nc3[nH]2)cc1,C17190705_decoy,TRY1,Decoy,0,-9.14098,-6.12,-1.53,-6.148163416381714
COc1c(O)cc2c(=O)oc3c(O)c(O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)cc4c(=O)oc1c2c34,C33830865_decoy,TRY1,Decoy,0,-8.69647,-7.67,-2.2,-6.060438537426197
CCOc1cc(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3)coc2c1,C04257548_decoy,TRY1,Decoy,0,-7.99526,-8.23,-1.29,-6.060407475920711
Cc1ccc(CN(C(=O)[C@@H]2CCC(=O)N2)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36601087_decoy,TRY1,Decoy,0,-7.41828,-7.33,-1.01,-9.196923901757524
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)o1,C12715069_decoy,TRY1,Decoy,0,-9.03518,-6.86,-2.58,-8.887080939903994
O=C(CS[C@@H]1N[NH2+]NN1c1ccc(C(=O)[O-])cc1)Nc1nc(-c2cccs2)cs1,C38598692_decoy,TRY1,Decoy,0,-10.0932,-7.04,-1.54,-6.82319806590191
Cc1cc(C)c(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)c(C)c1,C39007663_decoy,TRY1,Decoy,0,-9.90133,-10.25,-2.67,-11.2449683850495
[NH-]C1=NC(=O)C2=N[C@H](N/N=C/c3ccc(Br)cc3)N([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39774490_decoy,TRY1,Decoy,0,-8.44024,-8.92,-1.06,-7.376808966548213
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)c(O)c(O)c21,C39778199_decoy,TRY1,Decoy,0,-6.79442,-8.62,-1.51,-6.112982251111811
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@@]1(O)O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C39937477_decoy,TRY1,Decoy,0,-5.25642,-7.61,-4.13,-7.554717244698769
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccccc1O[C@@]1(O)O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C39937479_decoy,TRY1,Decoy,0,-7.44345,-7.02,-2.3,-6.9224286648523305
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@@H]12,C41007165_decoy1,TRY1,Decoy,0,-7.21264,-5.68,,-4.343550051349675
CN(C)c1ccc([O-])c2c1C[C@@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@]3(O)C(=O)[C@H]1C2=O,C35024910_decoy,TRY1,Decoy,0,-8.08493,-5.86,-2.13,-4.033126158653832
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C([O-])[C@@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]12,C43721336_decoy,TRY1,Decoy,0,-8.07753,-7.43,-2.98,-9.081094215029124
O=C([O-])[C@@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@@H](O)[C@H](O)[C@@H]1O,C33949419_decoy,TRY1,Decoy,0,-7.63351,-7.2,-2.03,-5.940987065197996
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C([O-])=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@@H](O)[C@@H]12,C44964060_decoy,TRY1,Decoy,0,-6.70837,-7.32,-3.64,-4.932227487599072
O=C1C[C@@H](c2ccc(O[C@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C45789235_decoy,TRY1,Decoy,0,-7.69029,-6.58,-2.2,-5.567089021319411
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C49180748_decoy,TRY1,Decoy,0,-8.27771,-7.59,-0.88,-6.258172061373811
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@H](O)[C@@H]12,C16890015_decoy,TRY1,Decoy,0,-9.8179,-7.76,-1.06,-5.8278673375979295
CN(C)c1ccc([O-])c2c1C[C@@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@@]3(O)C(=O)[C@H]1C2=O,C35189268_decoy,TRY1,Decoy,0,-8.96354,-5.85,-1.89,-4.3951937921341
CN(C)c1ccc([O-])c2c1C[C@@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@]3(O)C(=O)[C@H]1C2=O,C35024904_decoy,TRY1,Decoy,0,-8.61935,-8.37,-2.09,-5.279892308919426
CN(C)c1ccc([O-])c2c1C[C@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)/C(=C(\N)O)C(=O)[C@]3(O)C(=O)[C@@H]1C2=O,C38657252_decoy,TRY1,Decoy,0,-7.12609,-5.4,-1.07,-4.0527827858365
O=C([O-])[C@@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C34245017_decoy,TRY1,Decoy,0,-6.99552,-8.93,-1.85,-8.344541296310116
O=C1C[C@@H](c2ccc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C65748009_decoy,TRY1,Decoy,0,-7.13815,-7.33,-1.89,-5.514330355152465
O=C1C[C@H](c2ccc(O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C65748011_decoy,TRY1,Decoy,0,-7.48063,-7.38,-1.91,-5.477872462645083
O=C1C[C@H](c2ccc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)cc(O)c21,C65748014_decoy,TRY1,Decoy,0,-7.78432,-7.82,-2.77,-6.687407182505695
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C65748019_decoy,TRY1,Decoy,0,-8.14401,-8.78,-0.67,-5.868702399711132
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C65748024_decoy,TRY1,Decoy,0,-8.6878,-6.92,-1.53,-5.08158575614096
C[NH+]1CC[C@]23c4c5ccc(O[C@@H]6O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]6O)c4O[C@H]2C(=O)CC[C@@]3(O)[C@H]1C5,C65748368_decoy,TRY1,Decoy,0,-5.05243,-6.43,-3.65,-4.220847338360343
CN(C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@@H]12,C41007165_decoy2,TRY1,Decoy,0,-8.40496,-6.54,,-5.244779772592385
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@]2(O)C(=O)[C@@H]3C(=O)c4c([O-])cccc4[C@](C)(O)[C@@H]3[C@H](O)[C@H]12,C67172531_decoy,TRY1,Decoy,0,-7.57628,-5.35,-2.34,-5.1921602707638
C[C@@H]1O[C@H](Nc2ccc(-c3ccc(N[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@@H]4O)cc3)cc2)[C@H](O)[C@H](O)[C@@H]1O,C03995728_decoy,TRY1,Decoy,0,-6.23779,-8.27,-2.4,-6.280316369816331
OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C04102354_decoy,TRY1,Decoy,0,-10.6406,-9.09,-4.71,-8.654904107536588
O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C04349341_decoy,TRY1,Decoy,0,-8.93956,-9.01,-3.02,-7.87419563600417
C[C@H]1O[C@@H](Cc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C04349559_decoy,TRY1,Decoy,0,-9.37956,-9.36,-1.6,-7.93595832049297
O=c1c(O)c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C04349685_decoy,TRY1,Decoy,0,-9.24927,-8.01,-3.41,-6.483078240675342
C[C@H]1C(=O)c2c(cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c2O)O[C@@H]1c1ccc(O)c(O)c1,C05882731_decoy,TRY1,Decoy,0,-9.307,-5.9,-2.48,-4.858786585674005
C[C@]1(OC[C@@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970276_decoy,TRY1,Decoy,0,-5.42017,-5.4,-4.07,-3.575377837155968
CC(=O)N[C@@]1(C)[C@H](C)O[C@](C)(CO)[C@](C)(O)[C@@]1(C)O[C@@]1(C)O[C@@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970307_decoy,TRY1,Decoy,0,-5.9234,-5.6,-4.91,-5.032948513733053
C[C@@]1(OC[C@@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970472_decoy,TRY1,Decoy,0,-6.01231,-5.34,-3.53,-4.110801054917723
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C13424727_decoy,TRY1,Decoy,0,-8.95487,-9.01,-1.89,-8.375561816266837
OC[C@@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@@H](O)[C@H](O)[C@@H]1O,C13434531_decoy,TRY1,Decoy,0,-9.98441,-8.86,-1.24,-8.381460307027313
COc1cc([C@@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C15169007_decoy,TRY1,Decoy,0,-8.83988,-6.05,-2.72,-5.56498628317488
Nc1nc(N)c(/N=N/c2c(Br)cc(S(N)(=O)=O)cc2Br)c(O)n1,C17021130_decoy,TRY1,Decoy,0,-8.28509,-5.44,-1.2,-5.372769692003734
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O,C21992193_decoy,TRY1,Decoy,0,-9.05797,-6.98,-1.49,-6.081753832631662
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O,C21992196_decoy,TRY1,Decoy,0,-10.8315,-8.03,-1.57,-8.821084184506384
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O,C21992198_decoy,TRY1,Decoy,0,-11.5297,-8.59,-2.4,-8.6310190668903
O=c1c(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C21992895_decoy,TRY1,Decoy,0,-8.78763,-8.64,-3.78,-7.883225185486885
O=C([O-])[C@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@H](O)[C@@H](O)[C@@H]1O,C22065424_decoy,TRY1,Decoy,0,-6.12548,-6.03,-4.32,-4.055463543805715
O=C([O-])[C@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@@H](O)[C@@H](O)[C@@H]1O,C22065427_decoy,TRY1,Decoy,0,-7.22512,-7.19,-0.99,-5.348707268908898
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@H](O)[C@@H](O)[C@@H]1O,C22065430_decoy,TRY1,Decoy,0,-5.88433,-6.39,-1.48,-4.736837855690378
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@@H](O)[C@@H](O)[C@@H]1O,C22065433_decoy,TRY1,Decoy,0,-6.07495,-6.64,-2.03,-4.6238664381649
COc1cc([C@@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C31155646_decoy,TRY1,Decoy,0,-8.93938,-6.74,-3.38,-5.894504048544025
O=C1c2c(O)cc(O)cc2O[C@@H](c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)[C@H]1O,C31158671_decoy,TRY1,Decoy,0,-9.43833,-8.62,-2.8,-6.349863045403448
O=C1c2c(cc(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2O)O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C31159749_decoy,TRY1,Decoy,0,-10.1063,-6.5,-3.27,-5.507502792231045
C[C@H]1[C@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)O[C@@H](c2ccc(O)cc2)[C@@]1(C)O,C31164906_decoy,TRY1,Decoy,0,-8.69752,-6.73,-2.25,-6.803451342620414
CC(C)=CCc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc2c(c1O)C(=O)[C@@H](O)[C@H](c1ccc(O)cc1)O2,C31166806_decoy,TRY1,Decoy,0,-9.30233,-8.16,-4.29,-6.912399924194316
COc1cc(C[C@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C31167925_decoy,TRY1,Decoy,0,-9.26257,-7.04,-4.03,-8.233862695830613
Nc1nc2c(nc(N/N=C/c3ccc(Br)cc3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C33379608_decoy,TRY1,Decoy,0,-8.30954,-9.51,-1.7,-10.960621057364204
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O,C35643681_decoy,TRY1,Decoy,0,-8.44834,-8.6,-4.22,-8.166565466890805
COc1c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2c1=O,C36046354_decoy,TRY1,Decoy,0,-7.50023,-9.02,-3.02,-8.206041227601764
CC[C@H](C)[C@H]1OC(=O)CNC(=O)CNC(=O)[C@@H]([C@@H](C)O)NC(=O)[C@@H](C)[C@@H](O)C[C@@H](O)CC/C=C\[C@H]1C,C37538372_decoy,TRY1,Decoy,0,-7.49283,-5.09,-2.66,-4.166821570021932
C[C@@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)COC(=O)C1,C31167122_decoy,TRY1,Decoy,0,-7.96899,-9.97,-3.42,-7.081746710480819
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1,C03870415_decoy,TRY1,Decoy,0,-10.8468,-9.54,-2.52,-10.187557687928484
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1,C03870412_decoy,TRY1,Decoy,0,-9.29993,-9.2,-3.3,-12.259819244378404
C[C@@H]1O[C@H](Nc2ccc(-c3ccc(N[C@@H]4O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]4O)cc3)cc2)[C@H](O)[C@H](O)[C@@H]1O,C03995731_decoy,TRY1,Decoy,0,-6.46585,-6.76,-2.39,-4.589654798736774
O=c1c(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C43465434_decoy,TRY1,Decoy,0,-9.10798,-7.62,-2.07,-6.144363820853174
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C43465473_decoy,TRY1,Decoy,0,-9.74238,-7.14,-4.3,-6.432347629358108
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C33861428_decoy,TRY1,Decoy,0,-9.21139,-7.06,-1.88,-5.77935356539716
O=C(OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]12)c1ccc(O)cc1,C44166798_decoy,TRY1,Decoy,0,-8.40455,-7.55,-2.97,-7.894176003423377
CC(C)CC(CC(C)C)O[C@@H]1O[C@@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168300_decoy,TRY1,Decoy,0,-7.57672,-6.93,-3.33,-5.107297246460063
O=c1c(O)c(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C45108158_decoy,TRY1,Decoy,0,-8.57977,-7.63,-2.7,-6.56094566691408
CN(C)c1cc(N)c(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C([O-])=C(C(N)=O)C(=O)[C@@]3(O)C(O)=C1C2=O,C22016970_decoy,TRY1,Decoy,0,-7.88777,-6.94,-1.01,-4.829065109541243
Cc1occc1-c1nc(N)c(OC[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)cc1-c1cnc2[nH]nc(C)c2n1,C52569916_decoy,TRY1,Decoy,0,-9.05781,-8.82,-1.58,-7.172745117369573
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc([N+](=O)[O-])c4C[C@H]3C[C@@H]12,C30691119_decoy,TRY1,Decoy,0,-6.63187,-6.36,-2.51,-4.627517286585825
Cc1cnc2ccc3c(nc(Nc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@@H](O)[C@H](CO)O4)n3C)c2n1,C33680480_decoy,TRY1,Decoy,0,-8.4778,-9.45,-2.73,-8.715035056403917
O=C([O-])[C@@H]1O[C@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@H](O)[C@H](O)[C@@H]1O,C65748258_decoy,TRY1,Decoy,0,-5.0564,-6.74,-5.02,-4.329644901061447
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@H](O)[C@H](O)[C@@H]1O,C65748259_decoy,TRY1,Decoy,0,-5.22011,-7.47,-3.74,-4.78748942870077
O=C([O-])[C@@H]1O[C@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@@H](O)[C@H](O)[C@@H]1O,C65748261_decoy,TRY1,Decoy,0,-5.10514,-7.43,-2.99,-5.277967728029272
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c4c2O[C@H]2C(=O)CC[C@@]5(O)[C@@H](C3)[NH2+]CC[C@]425)[C@@H](O)[C@H](O)[C@@H]1O,C65748262_decoy,TRY1,Decoy,0,-5.46718,-6.51,-3.02,-4.119795141862428
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C04349256_decoy,TRY1,Decoy,0,-8.51133,-8.3,-2.72,-5.439719215230465
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C04349261_decoy,TRY1,Decoy,0,-7.73963,-7.66,-2.34,-6.5067301023621535
C[C@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C04349556_decoy,TRY1,Decoy,0,-9.81569,-9.48,-1.41,-8.013394450329514
C[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C04349611_decoy,TRY1,Decoy,0,-8.73518,-9.39,-3.7,-7.816082782702194
C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C04349617_decoy,TRY1,Decoy,0,-7.36177,-7.67,-3.07,-4.937503133097348
C[C@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C04692015_decoy,TRY1,Decoy,0,-9.64504,-9.35,-1.62,-8.221888836358374
C[C@@H]1O[C@@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@H]2c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O,C05369366_decoy,TRY1,Decoy,0,-7.7462,-8.11,-2.84,-5.974634899533047
COc1ccc(-c2c(C#N)c(N)n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(=S)c2C#N)cc1,C05540480_decoy,TRY1,Decoy,0,-6.9834,-6.51,-3.0,-4.964094180451418
COc1ccc(-c2c(C#N)c(N)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(=S)c2C#N)cc1,C05540482_decoy,TRY1,Decoy,0,-5.33603,-5.57,-3.2,-3.903671181535608
C[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3O)oc3cc(O)ccc3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C05759364_decoy,TRY1,Decoy,0,-8.78969,-9.03,-2.41,-7.8671194486364575
C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08214759_decoy,TRY1,Decoy,0,-8.46186,-7.45,-3.09,-5.78443801605835
C[C@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@@]5(O)[C@@H]4CC[C@]3(O)C2)[C@@H](O)[C@@H](O)[C@@H]1O,C08214791_decoy,TRY1,Decoy,0,-9.32664,-6.73,-1.89,-5.72277101725266
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)c12,C08551389_decoy,TRY1,Decoy,0,-7.75211,-6.62,-3.33,-5.1080347121736125
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)c12,C08551391_decoy,TRY1,Decoy,0,-8.33832,-6.93,-1.29,-5.514774131280669
C[C@H]1O[C@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@@H]2c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C08952754_decoy,TRY1,Decoy,0,-7.93598,-9.36,-1.55,-7.477281036236319
C[C@@H]1O[C@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C12153441_decoy,TRY1,Decoy,0,-8.92466,-7.36,-1.53,-5.700842799992496
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C13424721_decoy,TRY1,Decoy,0,-9.03171,-7.27,-1.81,-6.732572455219773
C[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C13783864_decoy,TRY1,Decoy,0,-9.88033,-7.87,-6.01,-5.612575334651958
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C14959483_decoy,TRY1,Decoy,0,-10.2515,-8.78,-1.55,-8.41779671066424
CSc1nc(O)c(I)c(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)n1,C16952386_decoy,TRY1,Decoy,0,-7.82777,-5.63,-2.08,-5.140609078626311
COc1ccc(-c2c(C#N)c(N)n([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(=S)c2C#N)cc1,C16958818_decoy,TRY1,Decoy,0,-5.77703,-5.47,-2.22,-4.674884744529757
C[C@@H]1O[C@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@H]1O,C16969255_decoy,TRY1,Decoy,0,-8.48743,-8.92,-1.86,-7.907414167996945
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)c12,C08551392_decoy,TRY1,Decoy,0,-8.58497,-6.29,-1.98,-5.733456114661016
O=C1c2c(cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2O)O[C@H](c2ccc(O)cc2)[C@H]1O,C31159753_decoy,TRY1,Decoy,0,-8.98668,-5.68,-2.29,-4.80851973580811
CSc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)[nH]1,C17175370_decoy,TRY1,Decoy,0,-6.90853,-6.31,-2.67,-5.269771179300574
OC[C@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O,C35643685_decoy,TRY1,Decoy,0,-9.98612,-8.51,-1.97,-8.407522378012532
CNc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@@]3(O)C(=O)[C@H]1C2=O,C35645492_decoy,TRY1,Decoy,0,-5.46001,-6.68,-3.22,-4.468014581364023
C[C@H]1O[C@@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@H]2c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O,C36020291_decoy,TRY1,Decoy,0,-7.96397,-7.86,-1.51,-4.98139201268983
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c21,C37538893_decoy,TRY1,Decoy,0,-8.66788,-6.44,-1.73,-5.577219647342878
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c21,C37538895_decoy,TRY1,Decoy,0,-8.36428,-8.04,-1.76,-6.352617431754182
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c21,C37538897_decoy,TRY1,Decoy,0,-8.55056,-9.34,-3.47,-7.256342850085545
O=C1C[C@H](c2ccc(O)c(O)c2)Oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c21,C37538899_decoy,TRY1,Decoy,0,-7.70708,-8.46,-4.22,-6.663585694567282
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C04349248_decoy,TRY1,Decoy,0,-7.84173,-6.54,-2.46,-5.192104628299056
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C04349262_decoy,TRY1,Decoy,0,-7.8983,-6.38,-3.4,-5.012141584304892
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)c12,C04654605_decoy,TRY1,Decoy,0,-8.03921,-7.07,-2.21,-5.518673333849059
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C04654606_decoy,TRY1,Decoy,0,-8.04839,-6.32,-4.16,-5.573761392513911
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C04654607_decoy,TRY1,Decoy,0,-8.29436,-8.92,-2.05,-6.951052844773426
C[C@@H]1O[C@@H](Oc2ccc([C@H]3Oc4cc(O)cc(O)c4C(=O)[C@@H]3O)cc2O)[C@H](O)[C@H](O)[C@H]1O,C31159345_decoy,TRY1,Decoy,0,-7.68121,-6.35,-2.28,-5.680333827908552
C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C04098556_decoy,TRY1,Decoy,0,-9.68108,-9.02,-3.02,-8.01153659907986
CNc1ccc(O)c2c1C[C@@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@H]1C2=O,C43328756_decoy,TRY1,Decoy,0,-9.04294,-7.8,-2.24,-6.872595001595716
CNc1ccc(O)c2c1C[C@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)C(=O)[C@@H]1C2=O,C43328758_decoy,TRY1,Decoy,0,-7.11697,-6.64,-4.07,-8.08753679547425
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C43465425_decoy,TRY1,Decoy,0,-7.96701,-6.74,-1.27,-4.895015481547351
C[C@]1(O[C@]2(C)[C@H](CO)O[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)O[C@H](CO)[C@](C)(O)[C@](C)(O)[C@]1(C)O,C43509307_decoy,TRY1,Decoy,0,-6.09647,-5.58,-4.63,-4.738126825112376
CC1(C)O[C@](O)(CO)[C@](C)(O[C@]2(C)O[C@@H](CO)[C@@](C)(O)[C@H](O)[C@@]2(C)O)[C@@](C)(O)[C@@]1(C)O,C43509432_decoy,TRY1,Decoy,0,-5.16099,-5.55,-3.75,-3.4054881278399787
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C44962848_decoy,TRY1,Decoy,0,-8.42549,-8.4,-2.05,-8.580715247121423
N#CC1=C(N)NC(S[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)=C(C#N)[C@@H]1c1ccc2ccccc2c1,C49048690_decoy,TRY1,Decoy,0,-6.37642,-7.67,-1.75,-5.083029677326413
N#CC1=C(N)NC(S[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)=C(C#N)[C@H]1c1ccc2ccccc2c1,C49048694_decoy,TRY1,Decoy,0,-6.0264,-7.08,-2.0,-4.6044380262482445
N#Cc1c(N)nc(S[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)c(C#N)c1-c1ccc2ccccc2c1,C49048706_decoy,TRY1,Decoy,0,-6.63893,-6.5,-2.01,-4.362594859816391
N#Cc1c(N)nc(S[C@@H]2O[C@H](O)[C@H](O)[C@H](O)[C@H]2O)c(C#N)c1-c1ccc2ccccc2c1,C49109829_decoy,TRY1,Decoy,0,-5.97374,-7.46,-4.47,-4.34915066266633
C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C04416344_decoy,TRY1,Decoy,0,-9.23213,-9.16,-2.46,-8.0769022938584
C[NH2+][C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)N[C@@H]4O,C03814435_decoy,TRY1,Decoy,0,-6.69414,-6.21,-1.3,-1.6069122917542689
C[NH+]1CCC[C@H](C(=O)OCC(=O)[C@]2(O)CC[C@@H]3[C@H]4CCC5=CC(=O)CC[C@@]5(C)[C@@H]4[C@@H](O)C[C@]32C)C1,C03953907_decoy,TRY1,Decoy,0,-10.0349,-9.35,-2.55,-7.370867836597629
Cc1ccc(C2=N[C@@H](c3ccc(Cl)c([N+](=O)[O-])c3)[NH2+][C@@H](c3cc(Br)ccc3O)C2)cc1,C02936370_decoy,TRY1,Decoy,0,-7.99011,-6.59,-1.8,-6.005698873259082
Cc1cc(Cl)cc2c1NC(=O)[C@]21[NH+]2CCC[C@H]2[C@@H](C(=O)c2ccccc2)[C@]12C(=O)Nc1ccccc12,C08790410_decoy,TRY1,Decoy,0,-7.33463,-6.49,-2.01,-4.995239201431852
Cc1cc(C)c2c(c1)[C@]1(C(=O)N2)[NH+]2CCC[C@H]2[C@@H](C(=O)c2cccs2)[C@]12C(=O)Nc1ccccc12,C08791233_decoy,TRY1,Decoy,0,-5.96764,-5.57,-2.98,-3.97768409116277
COc1c2c(cc3c1[C@@H](c1c(O)n(-c4cccc(C(F)(F)F)c4)c(=O)[nH]c1=O)[NH+](C)CC3)OCO2,C02114788_decoy,TRY1,Decoy,0,-6.83476,-5.54,-1.06,-4.074074110175158
COc1c2c(cc3c1[C@@H](c1c(O)n(-c4cccc(C(F)(F)F)c4)c(=S)[nH]c1=O)[NH+](C)CC3)OCO2,C02121571_decoy,TRY1,Decoy,0,-7.51289,-5.72,-2.61,-3.758451448472625
Cc1cccc2c1NC(=O)[C@]21[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)[C@]2(C(=O)Nc3ccccc32)[C@@H]2CCC[NH+]21,C09123840_decoy,TRY1,Decoy,0,-6.78427,-8.27,-3.78,-5.947269061783383
C=CCOc1ccc(C(=O)[C@@H]2[C@@H]3CCC[NH+]3[C@@]3(C(=O)Nc4ccccc43)[C@]23C(=O)Nc2ccccc23)cc1,C09233744_decoy,TRY1,Decoy,0,-7.68193,-7.7,-2.4,-5.900442371532067
CCOc1ccccc1C(=O)[C@@H]1[C@H]2CCC[NH+]2[C@@]2(C(=O)Nc3ccccc32)[C@]12C(=O)Nc1ccccc12,C09235727_decoy,TRY1,Decoy,0,-6.88298,-6.35,-1.0,-5.347106545050649
Cc1ccc2c(c1C)NC(=O)[C@]21[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)[C@]2(C(=O)Nc3ccccc32)[C@H]2CCC[NH+]21,C09331834_decoy,TRY1,Decoy,0,-6.70605,-7.55,-1.15,-5.487021126549234
Cc1ccc2c(c1)[C@@]1(C(=O)N2)[NH+]2CCC[C@@H]2[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)[C@]12C(=O)Nc1ccccc12,C09357626_decoy,TRY1,Decoy,0,-6.50476,-6.97,-3.85,-5.0191102373992615
O=C(c1ccccc1Cl)[C@@H]1[C@@H]2CCC[NH+]2[C@]2(C(=O)Nc3c(Cl)cccc32)[C@@]12C(=O)Nc1ccccc12,C09451569_decoy,TRY1,Decoy,0,-7.62038,-6.06,-1.51,-4.603113957092669
Cc1cccc2c1NC(=O)[C@]21[NH+]2CCC[C@H]2[C@@H](C(=O)c2ccccc2Cl)[C@]12C(=O)Nc1ccccc12,C09487658_decoy,TRY1,Decoy,0,-7.55019,-5.98,-1.35,-4.567560375644792
C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)C[NH+]1CC(=O)N[C@]1(C)CCS(=O)(=O)C1,C10217107_decoy,TRY1,Decoy,0,-7.88298,-6.84,-1.4,-5.919600637019559
COC(=O)[C@]1(c2ccccc2)[NH2+][C@@H](c2ccc(O)cc2)[C@H]2C(=O)N(c3ccc4c(c3)OCO4)C(=O)[C@@H]21,C12498372_decoy,TRY1,Decoy,0,-8.76616,-5.75,-2.12,-5.587755408160094
CC(C)c1ccc([C@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C4CC(C)(C)[NH2+]C(C)(C)C4)CC(=O)N23)cc1,C16042460_decoy,TRY1,Decoy,0,-7.37486,-6.31,-0.32,-5.629518495632044
COc1cc([C@@H]2CC(=O)C3=C(C2)Nc2[nH+]c4ccccc4n2[C@H]3c2c[nH]c3ccccc23)cc(OC)c1OC,C22844976_decoy,TRY1,Decoy,0,-7.17112,-8.19,-2.07,-5.593941891873548
Cc1ccc(NC(=O)NC(=O)[C@H](C)[NH+]2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c(C)c1,C29296399_decoy,TRY1,Decoy,0,-8.43498,-8.19,-3.09,-7.128237792046035
O=C(Nc1ccc2c(c1)OCCO2)Nc1ccc2[nH+]c(-c3ccccc3)cc(N3CCOCC3)c2c1,C33292753_decoy,TRY1,Decoy,0,-8.51326,-6.8,-1.6,-6.121949744005126
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H]([NH+]3CC[C@@H](O)C3)C[C@@H](c3ccc(F)c(F)c3)N12,C12603047_decoy,TRY1,Decoy,0,-10.1102,-9.01,-0.68,-6.8622729547384935
CC(C)[NH+]1CCN(c2nc(-c3cccc(F)c3F)c3c(N)n(-c4ccc(Cl)cc4)nc3n2)CC1,C35578382_decoy,TRY1,Decoy,0,-9.1692,-6.44,-2.48,-5.829547927900031
COc1ccccc1C(=O)[C@@H]1[C@H]2CCC[NH+]2[C@]2(C(=O)Nc3c2ccc(C)c3C)[C@@]12C(=O)Nc1ccccc12,C35807119_decoy,TRY1,Decoy,0,-5.7876,-7.04,-2.92,-5.060921889516889
O=C1NC2(CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)Nc2ccc(I)cc21,C35937957_decoy,TRY1,Decoy,0,-9.52679,-6.11,-1.97,-4.696691673884963
COc1ccccc1-c1nc(N2CCN(c3cccc[nH+]3)CC2)nc2nn(-c3cccc(F)c3)c(N)c12,C37357912_decoy,TRY1,Decoy,0,-8.94211,-8.75,-1.95,-7.674466875265226
CC1(C)SC(=S)N(/N=C/C2=c3ccccc3=[NH+]C2)[C@H]1N(O)C(=O)Nc1ccc(Cl)c(Cl)c1,C38582585_decoy,TRY1,Decoy,0,-8.57371,-5.83,-2.55,-5.614685720241284
CCc1cc2c(c(C[NH+]3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)c1O)O[C@H](C)[C@H](c1nc3ccccc3[nH]1)C2=O,C39345059_decoy,TRY1,Decoy,0,-8.11683,-6.92,-2.59,-7.054905588847859
CCOC1=C[C@@H]2C[C@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1I,C39467524_decoy,TRY1,Decoy,0,-6.4182,-4.94,-4.92,-4.0910772299645455
O=[P@@]1(S(=O)(=O)Oc2ccccc2)N[NH+]2C[C@@H]3C=C(O)C(Cc4ccccc4)=C[C@@H]3C[C@H]2CO1,C39469600_decoy,TRY1,Decoy,0,-7.23339,-5.78,-1.41,-4.827954919576614
O=S(=O)(Oc1ccccc1)[C@@H]1CN(c2ccc(Br)cc2-c2ccccc2O)CC[NH2+]1,C39530134_decoy,TRY1,Decoy,0,-8.34565,-6.17,-2.72,-6.705097672436327
O=S(=O)(Oc1ccccc1)c1cc(Br)ccc1N1CC[NH2+][C@H](c2ccccc2O)C1,C39530557_decoy,TRY1,Decoy,0,-8.33831,-6.11,-1.02,-5.5385170632404295
Cc1ccc([C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC23CC[NH2+]CC3)cc1,C39639411_decoy,TRY1,Decoy,0,-8.85471,-8.93,-1.83,-6.971089915660995
CC1(C)CC(Nc2ncnc(Oc3ccc(Br)c4cccnc34)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645247_decoy,TRY1,Decoy,0,-7.69972,-7.6,-1.96,-5.552279009612046
CC(C)C[C@H]1[NH2+][C@]2(C(=O)Nc3ccc(Br)cc32)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]12,C16024820_decoy,TRY1,Decoy,0,-8.37349,-6.83,-3.67,-5.641190985318835
COc1ccc([C@@H]2NCCc3c2[nH]c2ccccc32)cc1C[NH+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C43736828_decoy,TRY1,Decoy,0,-8.69592,-8.13,-2.17,-6.375872556983693
Cc1ccc(NC(=O)C[C@@H]2C(=O)Nc3ccccc3N2C(=O)C[NH+]2CCc3sccc3C2)c(C)c1,C45867954_decoy,TRY1,Decoy,0,-7.71903,-6.13,-0.48,-5.307712875688657
Oc1cccc(-c2c(-c3ccncc3)nn3c(-c4ccc(N[C@H]5C[NH+]6CCC5CC6)cc4)ccnc23)c1,C49109945_decoy,TRY1,Decoy,0,-8.94541,-7.54,-2.79,-6.0652423724895765
COc1ccc(Cl)cc1N1/C(=N/C2=NC3=c4ccccc4=NC3=[NH+]2)N[C@@]12C(=O)Nc1ccccc12,C02214670_decoy,TRY1,Decoy,0,-9.0349,-6.69,-1.94,-5.9106488761347125
O=C(CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1)N1CCC(O)(c2ccc(Cl)cc2)CC1,C63294916_decoy,TRY1,Decoy,0,-9.69725,-7.46,-1.56,-6.656787145668639
O=C([O-])c1ccc(Cl)cc1N[C@@H]1[NH+]=c2ccccc2=[NH+]/C1=N\S(=O)(=O)c1ccc(Cl)cc1,C39984301_decoy,TRY1,Decoy,0,-8.69489,-8.29,-1.7,-9.095532056736245
Cc1cc(Cl)cc2c1NC(=O)[C@]21N[C@@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C63375759_decoy,TRY1,Decoy,0,-8.80074,-7.34,-1.35,-6.028585809194535
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C63376020_decoy,TRY1,Decoy,0,-8.16123,-7.85,-2.62,-6.861012213209108
Cc1ccc2c(c1C)NC(=O)[C@@]21N[C@@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C63479976_decoy,TRY1,Decoy,0,-7.97778,-9.19,-2.84,-5.829156707629124
Cc1cccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@@]4(C(=O)Nc5ccc(C)cc54)[C@@H]3C2=O)c1,C63480086_decoy,TRY1,Decoy,0,-8.51003,-8.51,-2.13,-7.334860067066284
COC(=O)C1=C2CCCC[C@H]2S[C@@H]1NC(=O)Nc1ccc([C@@H]2C=c3cc(Cl)ccc3=[NH+]2)cc1,C63743889_decoy,TRY1,Decoy,0,-7.84933,-6.45,-2.61,-6.106643907323847
COC(=O)C1=C2CCCC[C@@H]2S[C@H]1NC(=O)Nc1ccc([C@@H]2C=c3cc(Cl)ccc3=[NH+]2)cc1,C63743890_decoy,TRY1,Decoy,0,-8.18409,-6.13,-2.72,-5.725370702683317
Cc1ccc(C)c(NC(=O)Nc2cc(C)cc3c2=[NH+][C@H](C(=O)N2CCOCC2)C=3c2ccccc2)c1,C63746595_decoy,TRY1,Decoy,0,-7.3084,-6.5,-1.78,-6.948198218462037
COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC3=c4ccccc4=[NH+]C3)C(=O)Nc3ccccc32)cc1,C63766868_decoy,TRY1,Decoy,0,-8.76536,-6.84,-1.39,-6.32851717983977
O=C1NC(=S)N=[NH+][C@H]1c1ccccc1/N=C/c1cc(Br)cc(Br)c1O,C40006027_decoy,TRY1,Decoy,0,-6.714,-7.8,-1.66,-6.427451553947247
O=C1[C@@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccccc21,C63480119_decoy,TRY1,Decoy,0,-9.06567,-8.79,-1.0,-6.402673918306964
CCOc1ccc2[nH+]c(NCCCNC(=S)NCCOC)c(C#N)cc2c1,C04937097_decoy,TRY1,Decoy,0,-9.44687,-5.01,-3.69,-6.42322043446084
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+](C)CC(=O)NC(C)C)C1=O,C07796655_decoy,TRY1,Decoy,0,-6.886,-6.72,-1.86,-6.777883291732293
CC(C)NC(=O)C[NH+](C)CC(=O)Nc1ccccc1C(=O)NCc1ccco1,C07796730_decoy,TRY1,Decoy,0,-6.5471,-6.75,-4.3,-5.586814724729187
CCOc1cc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)cc(OCC)c1OCC,C11667749_decoy,TRY1,Decoy,0,-9.03571,-5.01,-3.74,-5.65369434350427
COc1ccccc1[C@@H](CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])[NH+](C)C,C12521935_decoy,TRY1,Decoy,0,-7.10323,-4.82,-2.98,-4.803534359214612
COc1ccccc1[C@H](CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])[NH+](C)C,C12521936_decoy,TRY1,Decoy,0,-7.17695,-6.17,-2.18,-5.197763868146969
C[NH+](CCOc1ccccc1F)CCC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C14079370_decoy,TRY1,Decoy,0,-11.0962,-5.93,-2.36,-7.414292640041311
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)C2CCCCCC2)c(=O)[nH]c1=O,C14705248_decoy,TRY1,Decoy,0,-7.76548,-6.0,-0.75,-6.095205612096604
CC[C@@H](Sc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1cccc(Cl)c1)C(=O)NCCOC,C03959589_decoy,TRY1,Decoy,0,-8.93439,-6.36,-1.46,-7.862670369110254
CC[NH+](CCC(=O)Nc1ccc(F)c(F)c1)CC(=O)Nc1ccc(NC(C)=O)cc1,C24896850_decoy,TRY1,Decoy,0,-7.11696,-7.14,-4.88,-6.57831111618741
CCCNC(=O)C[NH+]1CCC(NC(=O)[C@H](NC(=O)c2ccccc2C)C(C)C)CC1,C31933911_decoy,TRY1,Decoy,0,-7.92909,-7.29,-2.0,-5.883456888579205
CC(C)S(=O)(=O)NC[C@H](c1ccc(S(=O)(=O)C(C)C)cc1)N1CC[NH2+][C@H](c2ccccc2O)C1,C39534453_decoy,TRY1,Decoy,0,-9.57894,-5.98,-4.11,-7.880464846247973
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39601652_decoy,TRY1,Decoy,0,-8.1729,-7.18,-1.77,-6.867625805644985
CN(C)c1cccc(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)c1,C39601785_decoy,TRY1,Decoy,0,-8.18137,-6.68,-1.05,-7.368035189215754
CC(C)[NH+](C)CCCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1,C41715962_decoy,TRY1,Decoy,0,-7.79972,-6.64,-4.48,-5.736269112441265
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1C,C43138199_decoy,TRY1,Decoy,0,-7.64843,-7.01,-4.41,-6.006349137101307
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@H](c2ccco2)[NH+](C)C)c1C,C43138201_decoy,TRY1,Decoy,0,-8.33493,-6.97,-3.1,-5.97233192121851
O=C([O-])[C@H]1[NH2+][C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@H]21,C33928501_decoy,TRY1,Decoy,0,-7.01101,-7.04,-1.93,-5.32271808312447
CC[C@H](Sc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1cccc(Cl)c1)C(=O)NCCOC,C03959583_decoy,TRY1,Decoy,0,-9.72978,-5.65,-1.42,-7.929847235106585
CC[NH+](CC)[C@@H](CNC(=O)NNC(=O)COc1ccccc1C#N)CC(C)C,C45538673_decoy,TRY1,Decoy,0,-8.15026,-6.4,-2.26,-7.126891602651158
C[NH+](C)[C@@H](CNC(=O)NNC(=O)COc1ccccc1C#N)c1ccsc1,C46347221_decoy,TRY1,Decoy,0,-7.95593,-6.5,-4.59,-7.059484820363189
C[NH+](C)[C@H](CNC(=O)NNC(=O)COc1ccccc1C#N)c1ccsc1,C46347222_decoy,TRY1,Decoy,0,-8.19717,-6.6,-3.39,-6.234584632416376
C[NH+](C)[C@H](CNC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccsc1,C46347498_decoy,TRY1,Decoy,0,-7.60491,-6.99,-1.57,-5.617862894494394
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(=O)COc2ccc(C#N)cc2)C1,C46427375_decoy,TRY1,Decoy,0,-7.3511,-6.93,-3.99,-5.555335162882369
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(=O)COc2ccccc2C#N)C1,C46427501_decoy,TRY1,Decoy,0,-7.75976,-7.2,-3.42,-6.389336669023125
C[NH+](CCCNC(=O)NNC(=O)COc1ccccc1C#N)CC(F)(F)F,C46983186_decoy,TRY1,Decoy,0,-6.61229,-5.76,-2.11,-5.114661150831059
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)C(=O)NCCC[NH+](CC)CC)c2)n1,C48668973_decoy,TRY1,Decoy,0,-7.72476,-6.3,-3.87,-5.648990630585615
C=CCNC(=O)c1ccc(NC(=O)NCCCCN2CC[NH+](CC)CC2)cc1,C48160318_decoy,TRY1,Decoy,0,-8.13982,-5.32,-2.67,-5.261699443679284
C=CCNC(=O)c1ccc(NC(=O)C(=O)NC[C@H](C)[NH+]2CCC[C@H](C)C2)cc1,C52679687_decoy,TRY1,Decoy,0,-7.57602,-7.08,-3.29,-5.735995071528447
CCN(CC)C(=O)CN1C(=O)/C(=N\NC(=O)[C@@H]([NH3+])CC(C)C)c2ccccc21,C59151761_decoy,TRY1,Decoy,0,-6.28296,-5.81,-2.71,-5.3097103495382125
COc1cc(C(=O)NC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)cc(OC)c1OCC(N)=O,C59890868_decoy,TRY1,Decoy,0,-8.31527,-5.15,-4.26,-5.52313318673462
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NCCC[NH+](C)CC(F)(F)F,C60649764_decoy,TRY1,Decoy,0,-7.44204,-6.37,-1.02,-6.528274471159151
COc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3NN[C@H](Cc4ccccc4)S3)CC1=O)C[NH+]=2,C63557995_decoy,TRY1,Decoy,0,-8.1724,-6.69,-1.92,-5.477950642659424
COc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)N[C@H]3NN[C@H](Cc4ccccc4)S3)CC1=O)C[NH+]=2,C63557998_decoy,TRY1,Decoy,0,-9.30141,-6.95,-3.14,-6.413551338367229
Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)NCCC[NH+](C)C3CCCCC3)nc21,C63809895_decoy,TRY1,Decoy,0,-7.79069,-6.47,-1.57,-5.338849881187875
O=C(CC1=c2ccccc2=[NH+]C1)NCCNc1ccc(Nc2ccncc2)nn1,C64407699_decoy,TRY1,Decoy,0,-7.65328,-5.57,-0.17,-4.851228755903383
O=C(NCCC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccccc1C(=O)NCc1cccnc1,C64417606_decoy,TRY1,Decoy,0,-8.92071,-7.77,-2.54,-7.301236462116427
COc1ccc(CCC(=O)N[C@H](CCSC)C(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc1,C25108497_decoy,TRY1,Decoy,0,-10.5009,-8.29,-1.11,-9.233994806371811
O=C(COc1cc(Cl)ccc1Cl)NNC(=O)NCCCn1cc[nH+]c1,C64886437_decoy,TRY1,Decoy,0,-8.24612,-6.23,-3.06,-5.734198897064045
CC[C@@]1(C)NC(=O)N(CC(=O)Nc2ccc(NC(=O)CC[NH+](C)C)cc2)C1=O,C65747249_decoy,TRY1,Decoy,0,-7.27945,-7.03,-1.41,-5.591860031359008
CC(C)(C)OC(=O)N(CCCN/C(N)=[NH+]/Cc1ccco1)Cc1cccnc1,C66245500_decoy,TRY1,Decoy,0,-7.93656,-5.61,-3.43,-5.562683939056962
C[C@@H](Cn1cc[nH+]c1)NC(=O)NC[C@H](O)COc1ccc(C(F)(F)F)cc1,C66335178_decoy,TRY1,Decoy,0,-7.78499,-7.06,-1.57,-6.179587908724357
CCCC[NH+]1CCCC[C@H]1CNC(=O)NNC(=O)C[C@@H]1CCS(=O)(=O)C1,C66704663_decoy,TRY1,Decoy,0,-8.45598,-4.99,-1.32,-6.01599582105426
CCN(CC)C(=O)CCC[NH2+]Cc1cc(Cl)c(OCC(N)=O)c(OC)c1,C67120576_decoy,TRY1,Decoy,0,-8.35311,-6.14,-3.63,-7.0498403374239365
CNS(=O)(=O)c1ccc(NC[C@H](O)C[NH+]2CCC(C)CC2)c([N+](=O)[O-])c1,C67373316_decoy,TRY1,Decoy,0,-7.61927,-5.42,-2.13,-5.580148492972255
CC1CC[NH+](C[C@H](O)CNC(=O)NCc2ccccc2Cn2cncn2)CC1,C67616939_decoy,TRY1,Decoy,0,-7.47907,-6.12,-2.94,-5.797085899709739
COc1cc(OC)c(CNC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c(OC)c1,C67629126_decoy,TRY1,Decoy,0,-8.28,-6.6,-2.86,-5.696811502746966
COc1cc(OC)c(CNC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c(OC)c1,C67629128_decoy,TRY1,Decoy,0,-8.83369,-6.4,-2.25,-6.055412652901382
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCS(=O)(=O)N2CCOCC2)CC1,C67638373_decoy,TRY1,Decoy,0,-9.27884,-6.69,-2.5,-6.795752659873168
CCC[C@H](NC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1)c1nnc2ccccn12,C67639577_decoy,TRY1,Decoy,0,-8.90463,-7.85,-4.8,-8.87487542740658
[NH3+][C@H](C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@H]12)c1ccc(O)cc1,C03830401_decoy,TRY1,Decoy,0,-10.095,-7.33,-0.81,-7.9993524176671
[NH3+][C@@H](C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@H]12)c1ccc(O)cc1,C03830402_decoy,TRY1,Decoy,0,-9.35432,-7.75,-2.69,-7.519806927114109
[NH3+][C@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@H]12)c1ccc(O)cc1,C03830403_decoy,TRY1,Decoy,0,-7.6724,-7.28,-2.22,-6.058931792257486
COC(=O)[C@H](NC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(C)cc2)C1)C(C)C,C03838465_decoy,TRY1,Decoy,0,-9.27902,-5.22,-2.67,-6.6796161190275205
[NH3+][C@@H](C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@@H]12)c1ccc(O)cc1,C11616774_decoy,TRY1,Decoy,0,-8.62192,-7.37,-1.65,-7.465167570386999
[NH3+][C@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@@H]12)c1ccc(O)cc1,C11616777_decoy,TRY1,Decoy,0,-8.9457,-7.89,-1.2,-8.55196384938728
COc1cc(C[NH2+]Cc2cccc3[nH]ccc23)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C12433004_decoy,TRY1,Decoy,0,-9.80068,-7.23,-2.97,-6.345720749548486
COc1cc(C[NH2+]Cc2cccc3[nH]ccc23)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C12433006_decoy,TRY1,Decoy,0,-8.57324,-6.79,-2.42,-5.7685581516952364
COCCNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1,C12467198_decoy,TRY1,Decoy,0,-7.64005,-6.1,-1.08,-6.148992154577208
O[C@@H](C[NH2+]Cc1ccccn1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccccn2)cc1,C06475564_decoy,TRY1,Decoy,0,-8.63657,-6.89,-3.48,-6.639066221431747
O[C@H](C[NH2+]Cc1ccccn1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccccn2)cc1,C06475562_decoy,TRY1,Decoy,0,-9.08013,-7.3,-2.37,-7.718506925624996
NC(=O)N[C@@H](CC(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccc(Cl)cc1,C20973350_decoy,TRY1,Decoy,0,-11.0559,-7.85,-2.3,-8.880189008488765
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OCC3CCCCC3)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,C25725098_decoy,TRY1,Decoy,0,-6.84851,-7.67,-3.05,-5.351684665876862
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@H]2CO)ccc1O[C@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C31155660_decoy,TRY1,Decoy,0,-8.53124,-5.59,-3.03,-5.737952312198502
O=C1CCC=C[C@]1(O)C(=O)OCc1cccc(O)c1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31160911_decoy,TRY1,Decoy,0,-7.0557,-7.54,-1.64,-7.161502268816396
CCOc1ccc(/C=N\Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1O,C32455471_decoy,TRY1,Decoy,0,-7.816,-7.98,-2.88,-9.443185065778192
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33687191_decoy,TRY1,Decoy,0,-7.0464,-6.3,-2.84,-5.225927831729871
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33687192_decoy,TRY1,Decoy,0,-5.99847,-4.9,-3.13,-4.366338930772912
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33687193_decoy,TRY1,Decoy,0,-6.93382,-3.82,-3.8,-3.797166546095321
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33687194_decoy,TRY1,Decoy,0,-6.39781,-6.23,-1.49,-4.956933624541912
O=C(OCc1cc(O)ccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c1cccc(O)c1O,C35457485_decoy,TRY1,Decoy,0,-6.98009,-8.37,-2.32,-7.534945614291089
O=C(OCc1cc(O)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c1cccc(O)c1O,C35457489_decoy,TRY1,Decoy,0,-7.51301,-7.79,-3.21,-6.945869605957744
O=C(OCc1cc(O)ccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c1cccc(O)c1O,C35457494_decoy,TRY1,Decoy,0,-7.75773,-7.89,-2.38,-7.467994898726596
O=C(OCc1cc(O)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)c1cccc(O)c1O,C35457498_decoy,TRY1,Decoy,0,-7.24014,-8.58,-2.72,-7.444651274720296
COc1cc2oc(=O)ccc2cc1[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)C(C)(C)O,C35465834_decoy,TRY1,Decoy,0,-8.29915,-8.27,-3.92,-9.159981039523329
CC(C)[NH2+]C[C@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)c2ccccc12,C35644604_decoy,TRY1,Decoy,0,-6.66678,-6.15,-1.15,-4.807252906749167
[N-]=[N+]=Nc1ccc(CC(=O)c2c(O)cc(O)cc2O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1,C36372329_decoy,TRY1,Decoy,0,-7.5042,-6.9,-0.8,-5.888948004036064
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1c(O)cccc1O,C36597477_decoy,TRY1,Decoy,0,-7.10372,-6.61,-3.33,-6.408033811119471
O=C1CCC=C[C@@]1(O)C(=O)OCc1cccc(O)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35457125_decoy,TRY1,Decoy,0,-8.03248,-6.01,-1.78,-5.31984616213763
CC(=N/NC(=S)NCC[NH+]1CCCCC1)/C(C)=N\NC(=S)NCC[NH+]1CCCCC1,C17107946_decoy,TRY1,Decoy,0,-9.22003,-5.45,-1.66,-6.860968399339518
CCOc1ccc([C@H]2[C@H](C(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N[NH2+]N2c2nonc2N)cc1,C38661854_decoy,TRY1,Decoy,0,-8.59764,-8.54,-2.95,-7.600604032949165
CCOc1ccc([C@H]2[C@@H](C(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N[NH2+]N2c2nonc2N)cc1,C38661858_decoy,TRY1,Decoy,0,-8.74312,-6.7,-1.63,-6.396625681247873
CCOC(=O)[C@H]1N[NH2+]N(c2nonc2N)[C@H]1CSC1=N[C@H]2[NH+]=c3ccccc3=C2N=N1,C39205156_decoy,TRY1,Decoy,0,-7.84307,-7.69,-1.65,-7.050343218695383
CCOC(=O)[C@H]1N[NH2+]N(c2nonc2N)[C@@H]1CSC1=N[C@H]2[NH+]=c3ccccc3=C2N=N1,C39205158_decoy,TRY1,Decoy,0,-8.72522,-6.02,-3.54,-6.286997233311153
CC(=O)C[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C44075494_decoy,TRY1,Decoy,0,-8.522,-7.27,-1.69,-8.073695145939766
Cc1ccc([O-])c(Cn2c(NC3CC[NH+](C[C@H]([NH3+])C(C)C)CC3)nc3c(C)ccnc32)[nH+]1,C29134081_decoy,TRY1,Decoy,0,-8.78144,-6.93,-1.95,-8.918222540175162
Cc1ccc([O-])c(Cn2c(NC3CC[NH+](C[C@@H]([NH3+])C(C)C)CC3)nc3c(C)ccnc32)[nH+]1,C29134083_decoy,TRY1,Decoy,0,-9.0727,-7.2,-2.4,-7.750218572738281
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](O)[C@H](O[C@H]2CCCC[C@@H]2O)O[C@H](CO)[C@H]1O,C49601711_decoy,TRY1,Decoy,0,-8.5668,-9.6,-2.0,-9.03957930855188
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@@H]2CCCC[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C49601718_decoy,TRY1,Decoy,0,-8.31344,-8.94,-1.3,-7.226475246036128
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2CCCC[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C49601720_decoy,TRY1,Decoy,0,-8.92639,-9.01,-3.9,-10.700400899595223
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@@H]2CCCC[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C49601722_decoy,TRY1,Decoy,0,-7.85085,-8.63,-3.98,-6.554965155953473
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O[C@H]2CCCC[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,C49601724_decoy,TRY1,Decoy,0,-8.81974,-8.18,-2.11,-9.155688072702436
O=C(CS[C@@H]1N[C@H](c2ccco2)Nc2cc(=O)[nH]n21)NCCC1[NH+]=c2ccccc2=[NH+]1,C63648745_decoy,TRY1,Decoy,0,-8.93886,-7.72,-2.87,-6.651995073707174
O=C(CS[C@H]1N[C@@H](c2ccco2)Nc2cc(=O)[nH]n21)NCCC1[NH+]=c2ccccc2=[NH+]1,C63648748_decoy,TRY1,Decoy,0,-7.95794,-6.56,-3.64,-6.122007064257743
COc1ccc2c(c1)=C(CCNC(=O)[C@H]1[NH+]=C(COc3ccccc3C(N)=O)NO1)C[NH+]=2,C63818886_decoy,TRY1,Decoy,0,-8.36082,-7.89,-2.16,-6.818445036476823
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@@H]1N[NH2+]NN1c1cccc(Cl)c1,C64137068_decoy,TRY1,Decoy,0,-9.04478,-8.29,-3.14,-8.516788056267709
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@H]1N[NH2+]NN1c1cccc(Cl)c1,C64137069_decoy,TRY1,Decoy,0,-9.88511,-8.1,-2.0,-6.885442931541719
COc1ccc2c(c1)=[NH+]CC=2CCNC(=O)CS[C@H]1N[NH2+]NN1c1ccccc1OC,C64164392_decoy,TRY1,Decoy,0,-8.44658,-6.91,-1.27,-7.493816192541417
COc1cccc(N2N[NH2+]N[C@@H]2SCC(=O)NCCC2=c3ccc(OC)cc3=[NH+]C2)c1,C64197111_decoy,TRY1,Decoy,0,-9.43558,-7.76,-2.09,-7.671966086435453
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[C@@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C04217451_decoy,TRY1,Decoy,0,-7.50143,-5.81,-1.5,-5.021683378816875
CC(=O)N[C@H]1[C@@H](OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C=O)O[C@@H](CO)[C@@H](O)[C@@H]1O,C04533998_decoy,TRY1,Decoy,0,-5.97228,-4.59,-2.73,-4.625714818883368
CCCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C05273647_decoy,TRY1,Decoy,0,-4.06921,-3.96,-2.7,-3.216432782746469
CCCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C05273649_decoy,TRY1,Decoy,0,-4.80766,-4.78,-2.2,-3.6790427216536177
O=C(NNc1c(Cl)cc(Cl)cc1Cl)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C05411604_decoy,TRY1,Decoy,0,-10.2495,-7.89,-3.26,-9.005546795458866
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](C[C@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@@H]1O,C11726792_decoy,TRY1,Decoy,0,-7.06646,-7.19,-2.08,-6.632571803691932
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[C@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C13650200_decoy,TRY1,Decoy,0,-8.0373,-7.92,-1.97,-7.164101992879169
COC[C@@H]1O[C@@H](COC[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14984497_decoy,TRY1,Decoy,0,-5.45956,-5.46,-2.73,-4.299709431557974
COC[C@H]1O[C@@H](COC[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14984499_decoy,TRY1,Decoy,0,-5.41187,-5.57,-1.72,-5.038297228326475
COC[C@H]1O[C@H](COC[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14984503_decoy,TRY1,Decoy,0,-4.7453,-5.17,-1.88,-4.053773363458607
C[NH+](C)CCCNC(=O)NCCCCCCNC(=O)NCCC[NH+](C)C,C05197905_decoy,TRY1,Decoy,0,-8.12354,-5.13,-3.95,-6.37920542129648
CCOC(=O)CNC(=O)[C@H](CSC(=O)N(C)O)NC(=O)CC[C@@H]([NH3+])C(=O)[O-],C05729315_decoy,TRY1,Decoy,0,-8.77934,-6.15,-2.98,-7.617720428726576
COCCSc1nnc(NC(=O)CSc2nnc(NN)n2N)s1,C20921853_decoy,TRY1,Decoy,0,-8.86936,-4.93,-1.33,-5.724348412789374
COC(=O)c1c(NC(=O)CSc2nnc(NN)n2N)sc2c1CCC2,C20922434_decoy,TRY1,Decoy,0,-10.2615,-7.77,-1.44,-8.328279242582731
CC(=O)N[C@@H](C(=O)N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C22055756_decoy,TRY1,Decoy,0,-5.99861,-5.23,-4.55,-4.952043133356751
CC(=O)N[C@H](C(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C22055769_decoy,TRY1,Decoy,0,-6.45868,-5.25,-2.46,-4.811185190846084
CC(=O)N[C@@H](C(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)C(C)(C)SN=O,C22059977_decoy,TRY1,Decoy,0,-6.85984,-4.98,-2.89,-4.963740471288539
CC(=O)OC[C@@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22066579_decoy,TRY1,Decoy,0,-4.09228,-5.99,-3.68,-4.237356979333764
CN(CC[C@H]([NH3+])C(=O)[O-])C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,C12503675_decoy,TRY1,Decoy,0,-7.40588,-6.61,-2.18,-5.782961135772076
C[C@@H](O)CC[C@@H]1[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H](O)CC1(C)C,C31156459_decoy,TRY1,Decoy,0,-6.83336,-5.13,-1.88,-4.266192037250673
C[C@@H](O)CC[C@H]1[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H](O)CC1(C)C,C31156466_decoy,TRY1,Decoy,0,-7.4035,-6.33,-4.23,-6.1746848942961705
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C13510939_decoy,TRY1,Decoy,0,-6.943,-6.66,-3.23,-6.69064114258251
Nc1nccc2c1ncn2[C@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C31393798_decoy,TRY1,Decoy,0,-6.92539,-7.65,-1.05,-6.728906357805694
CC(=O)N[C@@H](C(=O)NC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C33782163_decoy,TRY1,Decoy,0,-6.07266,-5.8,-0.56,-5.177598763680691
C[C@H](O)CC[C@@H]1[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H](O)CC1(C)C,C35455110_decoy,TRY1,Decoy,0,-8.45873,-5.38,-2.04,-6.282228192844495
C[C@H](O)CC[C@H]1[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H](O)CC1(C)C,C35455117_decoy,TRY1,Decoy,0,-6.80901,-5.4,-4.84,-5.060498615153639
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C35643699_decoy,TRY1,Decoy,0,-6.2867,-4.78,-3.69,-4.653745936460133
CC(=O)N[C@H](C(=O)N[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C35644447_decoy,TRY1,Decoy,0,-5.2048,-4.34,-2.31,-4.225390261723976
Nc1ncnc2c1ncn2[C@H]1O[C@@H](C[C@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C37253577_decoy,TRY1,Decoy,0,-5.5805,-5.53,-1.34,-4.829416944083519
Nc1ncnc2c1ncn2[C@H]1O[C@@H](C[C@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@@H]1O,C37253583_decoy,TRY1,Decoy,0,-7.48119,-7.81,-1.73,-7.592931691944924
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[C@@H]([NH3+])CC[C@@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C38192472_decoy,TRY1,Decoy,0,-4.80382,-7.14,-2.03,-5.954103182544854
CO[C@H](C(=O)N[C@@H]1CC[C@H](O)CNC1=O)[C@@H](O)[C@H](O)[C@@H](O)/C=C/C(C)(C)C,C38665146_decoy,TRY1,Decoy,0,-9.01169,-6.92,-1.77,-8.679440798068185
O=C(N/N=C/c1ccc(O)cc1)[C@@H](O)[C@@H](O)C(=O)N/N=C/c1ccc(O)cc1,C16666986_decoy,TRY1,Decoy,0,-9.27156,-8.49,-2.04,-10.679751055266706
O=C(N/N=C/c1ccc(O)cc1)[C@H](O)[C@@H](O)C(=O)N/N=C/c1ccc(O)cc1,C04989868_decoy,TRY1,Decoy,0,-9.32116,-8.67,-2.42,-9.675765237761931
O=C(N/N=C/c1ccc(O)cc1)[C@@H](O)[C@H](O)C(=O)N/N=C/c1ccc(O)cc1,C02896207_decoy,TRY1,Decoy,0,-8.75449,-9.22,-4.02,-14.143762332044332
C[NH+](C)CCCN[C@@H]1N=C2C(=O)N=C([NH-])N=C2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39939241_decoy,TRY1,Decoy,0,-6.47659,-6.61,-0.41,-6.936485817243357
COC[C@H]1O[C@@H](COC[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C43889886_decoy,TRY1,Decoy,0,-5.40916,-5.28,-2.85,-4.2775249620882185
COC[C@@H]1O[C@@H](COC[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C43889889_decoy,TRY1,Decoy,0,-4.47896,-5.31,-2.97,-4.224722538204717
COC[C@H]1O[C@@H](COC[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C43889890_decoy,TRY1,Decoy,0,-4.69204,-5.83,-2.48,-4.228934573174539
COC[C@@H]1O[C@@H](COC[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C43889893_decoy,TRY1,Decoy,0,-5.54109,-5.43,-2.4,-4.692006971359241
CC(=O)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C44028865_decoy,TRY1,Decoy,0,-4.6268,-5.58,-2.62,-3.896413271603052
CC(=O)OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C44028867_decoy,TRY1,Decoy,0,-5.22155,-6.0,-2.08,-4.780687006286939
CC(=O)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C44028869_decoy,TRY1,Decoy,0,-6.36099,-5.45,-2.42,-5.373653540601699
CC(=O)OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C44028871_decoy,TRY1,Decoy,0,-4.94819,-4.52,-3.13,-4.391443204443191
CC(=O)N[C@H](C(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O)C(C)(C)SN=O,C44608334_decoy,TRY1,Decoy,0,-6.38659,-5.2,-1.63,-5.165460421927446
NNc1ncc(Br)cc1S(=O)(=O)NCCCS(N)(=O)=O,C45090027_decoy,TRY1,Decoy,0,-9.17344,-6.26,-4.17,-8.958437302915339
Nc1nccc2c1ncn2[C@H]1O[C@H](CSCC[C@@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C49015805_decoy,TRY1,Decoy,0,-7.14836,-7.63,-1.27,-7.683045255854277
C[NH+](C)CC[NH+](C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccsc1,C20464964_decoy,TRY1,Decoy,0,-6.64199,-4.73,-2.42,-5.3462892423953
C[C@@H]1[NH+]=c2ccccc2=C1CCNC(=O)CN1N[NH2+]N[C@H]1CN1CCOCC1,C64103202_decoy,TRY1,Decoy,0,-9.50068,-7.23,-1.56,-6.431380196588605
[NH3+][C@@H](CCCCN1CC=Cc2[nH+]c(NCCC[C@H]([NH3+])C(=O)[O-])[nH]c21)C(=O)[O-],C64859444_decoy,TRY1,Decoy,0,-9.66405,-4.95,-3.7,-5.378432268620575
C=CCNC(=S)Nc1cccc(NC(=O)C[C@H]([NH2+]CCC)C(=O)[O-])c1,C05258984_decoy,TRY1,Decoy,0,-7.23065,-5.9,-2.05,-5.778568804313138
C=CCNC(=S)Nc1cccc(NC(=O)C[C@H]([NH2+]CCCC)C(=O)[O-])c1,C05259005_decoy,TRY1,Decoy,0,-8.42189,-5.77,-3.16,-5.891575720042519
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]CCCCC)C(=O)[O-])c1,C04372268_decoy,TRY1,Decoy,0,-8.42821,-5.53,-2.67,-6.849221310619309
[NH3+]CCCC[NH2+]CCCNC(=O)c1nc(-c2nc(CC[NH3+])sc2Cl)sc1Cl,C05848091_decoy,TRY1,Decoy,0,-11.4048,-5.91,-4.14,-7.187275391621759
COc1ccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)cc1OC[C@@H](O)C[NH+](C)C(C)C,C11664074_decoy,TRY1,Decoy,0,-8.29566,-6.3,-3.2,-5.717282792287308
COc1ccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)cc1OC[C@H](O)C[NH+](C)C(C)C,C11664075_decoy,TRY1,Decoy,0,-8.04425,-6.27,-2.48,-6.170927586388873
COC(=O)C1CC[NH+](C[C@@H](O)COc2ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc2)CC1,C11873753_decoy,TRY1,Decoy,0,-7.58299,-6.06,-2.34,-5.587489358242947
COC(=O)C1CC[NH+](C[C@H](O)COc2ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc2)CC1,C11873754_decoy,TRY1,Decoy,0,-6.66076,-5.91,-2.3,-5.447067274362099
COc1ccc(C[NH2+]CCNC(C)=O)c(OC[C@@H](O)C[NH+]2CCCC2)c1,C12196995_decoy,TRY1,Decoy,0,-7.8815,-5.22,-1.21,-6.265519062844965
COc1ccc(C[NH2+]CCc2c(C)n[nH]c2C)cc1OC[C@@H](O)C[NH+](C)C(C)C,C12315358_decoy,TRY1,Decoy,0,-7.81432,-7.03,-3.04,-6.810757472943327
COc1ccc(C[NH2+]CCc2c(C)n[nH]c2C)cc1OC[C@H](O)C[NH+](C)C(C)C,C12315359_decoy,TRY1,Decoy,0,-7.71773,-5.82,-2.83,-6.509499808042408
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCc2cccnc2)c1,C12303806_decoy,TRY1,Decoy,0,-8.01781,-7.26,-4.36,-8.131253883619834
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCc2cccnc2)c1,C12303807_decoy,TRY1,Decoy,0,-8.06331,-6.79,-2.59,-7.921900562467763
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCOC(C)C)c1,C12459556_decoy,TRY1,Decoy,0,-8.62958,-5.88,-1.99,-8.202140672053858
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCOC(C)C)c1,C12459557_decoy,TRY1,Decoy,0,-8.18833,-6.64,-2.47,-6.314979473457005
COc1ccc(C[NH2+]CCNC(C)=O)c(OC[C@@H](O)C[NH+]2CCCCCCC2)c1,C12586006_decoy,TRY1,Decoy,0,-7.85194,-6.89,-2.21,-8.065276151299553
COc1cc(C[NH2+]CCc2ccc(O)cc2)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C12701872_decoy,TRY1,Decoy,0,-9.72444,-7.04,-3.88,-6.95620025486901
COc1cc(C[NH2+]CCc2ccc(O)cc2)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C12701878_decoy,TRY1,Decoy,0,-7.16859,-6.41,-2.23,-5.428003761158539
COc1cc(C[NH2+]CCc2c[nH]cn2)ccc1OC[C@H](O)C[NH+]1CCSCC1,C11819567_decoy,TRY1,Decoy,0,-8.36353,-6.27,-2.96,-7.142818575581249
CSCC[C@H](NC(=O)[C@@H]([NH3+])CCSC)C(=O)N[C@@H](C)C(=O)[O-],C04899612_decoy,TRY1,Decoy,0,-9.74836,-5.3,-4.01,-6.8709437979147925
COc1cc(C[NH2+]CCOC(C)C)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C15062828_decoy,TRY1,Decoy,0,-8.47657,-5.88,-3.91,-5.51358886012551
O=C(NCCCCCCO)NCCCCCCNC(=O)NCCCCCCO,C04017837_decoy,TRY1,Decoy,0,-10.4373,-5.11,-2.54,-7.455107917387932
[NH3+]CCCC(=O)NCCCCCC[NH2+]CCCCCCNC(=O)CCC[NH3+],C04991083_decoy,TRY1,Decoy,0,-8.64345,-5.36,-3.51,-6.222241902332042
CC(C)C[C@H]([NH3+])C(=O)NCCCCCC[NH2+]CCCCCCNC(=O)[C@@H]([NH3+])CC(C)C,C04964073_decoy,TRY1,Decoy,0,-10.1785,-5.7,-2.65,-7.046326722596061
C=CCC(O)(CC=C)C[NH2+]Cc1ccc(OC)cc1OC[C@@H](O)CN1CC[NH+](C)CC1,C19221829_decoy,TRY1,Decoy,0,-9.12333,-5.91,-3.06,-6.674283653981261
COc1ccc(C[NH2+]CCN2CC[NH+](C)CC2)c(OC[C@@H](O)C[NH+]2CCCC2)c1,C19595258_decoy,TRY1,Decoy,0,-7.94082,-5.09,-3.53,-5.144046405483548
COc1ccc(C[NH2+]CCN2CC[NH+](C)CC2)c(OC[C@H](O)C[NH+]2CCCC2)c1,C19595259_decoy,TRY1,Decoy,0,-8.30107,-4.91,-2.31,-5.6345314037842185
C=CCC(O)(CC=C)C[NH2+]Cc1ccc(OC)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C20166931_decoy,TRY1,Decoy,0,-8.23041,-6.21,-2.66,-6.325520187212857
CCCCC[C@@H](O)C[C@@H](CC(=O)[O-])O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31162641_decoy,TRY1,Decoy,0,-5.82874,-4.48,-3.09,-4.4418118181396125
CCCCC[C@H](O)C[C@@H](CC(=O)[O-])O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31162643_decoy,TRY1,Decoy,0,-5.99911,-6.06,-4.14,-4.932590052460308
CCCCC[C@@H](O)C[C@H](CC(=O)[O-])O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31162647_decoy,TRY1,Decoy,0,-5.13375,-5.9,-4.83,-4.704411649398079
CCCCC[C@H](O)C[C@H](CC(=O)[O-])O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31162651_decoy,TRY1,Decoy,0,-4.21219,-5.71,-3.02,-4.839075135285486
[H]/N=C(/N)N/N=C1/C(=O)N(CCCCCC)C(=O)C1=C([O-])NCCCCCC,C17176635_decoy,TRY1,Decoy,0,-7.63132,-6.06,-2.29,-7.017587126588571
CC(C)C[C@@H]([NH3+])C(=O)NCCCCCC[NH2+]CCCCCCNC(=O)[C@@H]([NH3+])CC(C)C,C17421998_decoy,TRY1,Decoy,0,-7.97911,-5.25,-2.89,-5.861484568440008
CCCCC[C@H](O)C[C@@H](CC(=O)[O-])O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35457914_decoy,TRY1,Decoy,0,-5.62851,-4.89,-3.49,-4.5054110276694015
CCCCC[C@H](O)C[C@H](CC(=O)[O-])O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35457920_decoy,TRY1,Decoy,0,-5.28522,-5.04,-5.03,-4.268303098647587
CCCCC[C@@H](O)C[C@H](CC(=O)[O-])O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35457923_decoy,TRY1,Decoy,0,-5.38662,-5.31,-1.67,-4.770496771643384
CCC(CO)(CO)COCC(CC)(CO)COCC(CC)(CO)CO,C38646504_decoy,TRY1,Decoy,0,-7.14822,-3.95,-3.6,-4.935629503596659
CCOCCCNC(=S)NNC(=O)CCCNC(=O)NC1CCCCC1,C60400616_decoy,TRY1,Decoy,0,-8.40396,-5.31,-1.98,-5.842514732649526
CCCC[NH+](CC(N)=O)CC(=O)NC[C@H](c1ccco1)[NH+](CC)CC,C48048474_decoy,TRY1,Decoy,0,-7.47316,-5.57,-2.19,-5.733173097574529
CCCCC[C@@H](C)CNC(=S)NNC(=O)[C@@H](NC(N)=O)[C@@H](C)CC,C61483814_decoy,TRY1,Decoy,0,-7.15761,-5.98,-4.0,-5.52297783250065
CCCCC[C@@H](C)CNC(=S)NNC(=O)CC[C@@H]1NC(=O)NC1=O,C61484462_decoy,TRY1,Decoy,0,-8.45799,-5.98,-1.33,-7.46567428097933
NC(=O)NCCCCC(=O)NC[C@H](O)COc1ccc(C(F)(F)F)cc1,C62224847_decoy,TRY1,Decoy,0,-7.26183,-7.42,-3.49,-8.153485971172902
Nc1ccc(NC(=O)C[C@H]([NH2+]CCOCCO)C(=O)[O-])cc1[N+](=O)[O-],C65090357_decoy,TRY1,Decoy,0,-5.50396,-6.16,-1.85,-5.749168753764737
Nc1ccc(NC(=O)C[C@@H]([NH2+]CCOCCO)C(=O)[O-])cc1[N+](=O)[O-],C65090359_decoy,TRY1,Decoy,0,-6.29261,-7.1,-2.35,-6.568846272960788
NC(=O)NCCCCC(=O)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1,C66326499_decoy,TRY1,Decoy,0,-7.37621,-5.79,-1.94,-5.5059182717223605
CC[NH+](CC)[C@@H](CNC(=O)[C@@H](CCSC)NC(N)=O)c1ccco1,C67276518_decoy,TRY1,Decoy,0,-7.55533,-4.88,-1.33,-6.807394161609214
CC[NH+](CC)[C@H](CNC(=O)[C@@H](CCSC)NC(N)=O)c1ccco1,C67276519_decoy,TRY1,Decoy,0,-7.68317,-4.94,-2.89,-6.6971157034621465
CC[NH+](CC)[C@@H](CNC(=O)[C@H](CCSC)NC(N)=O)c1ccco1,C67276521_decoy,TRY1,Decoy,0,-8.18568,-4.57,-2.73,-6.052636626054417
CC[NH+](CC)[C@H](CNC(=O)[C@H](CCSC)NC(N)=O)c1ccco1,C67276523_decoy,TRY1,Decoy,0,-8.54334,-5.21,-2.68,-8.639435367187675
CC(C)(C)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]3CC(=O)NCC[NH+]2CCOCC2)cc1,C04222341_decoy,TRY1,Decoy,0,-12.2024,-6.0,-3.81,-7.250088946705281
CC(C)C[C@H](CO)NC(=O)C[C@@H]1c2nc(NC(=O)C(C)(C)C)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222364_decoy,TRY1,Decoy,0,-10.3784,-5.93,-2.12,-7.101230744498305
CC(C)CCNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06134170_decoy,TRY1,Decoy,0,-7.80228,-7.36,-1.61,-7.968070961435344
CC(C)CCNC(=O)[C@@H](c1ccco1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06134287_decoy,TRY1,Decoy,0,-7.45698,-6.07,-1.29,-6.854792531818089
CCC(C)(C)NC(=O)[C@@H](c1ccc(F)cc1)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06462014_decoy,TRY1,Decoy,0,-8.13132,-6.56,-4.18,-7.5595394853995455
CCC(C)(C)NC(=O)[C@@H](c1ccc(C)o1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06462112_decoy,TRY1,Decoy,0,-7.98668,-5.57,-2.25,-6.186878890114261
CCC(C)(C)NC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06077463_decoy,TRY1,Decoy,0,-9.23041,-4.33,-1.49,-5.402251190190111
CCC(C)(C)NC(=O)[C@H](c1ccc(OC)cc1)N(CC(C)C)C(=O)c1snc(C(N)=O)c1N,C06462210_decoy,TRY1,Decoy,0,-8.11684,-7.52,-2.1,-9.68048589067711
CCCC[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C,C06481335_decoy,TRY1,Decoy,0,-9.46251,-5.3,-3.28,-7.51837925970031
CCCC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06481390_decoy,TRY1,Decoy,0,-9.06046,-4.28,-3.56,-5.523968890982803
CCC[C@H](C(=O)NC1CCCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06501437_decoy,TRY1,Decoy,0,-7.86399,-7.65,-0.59,-8.113434086290814
CCC[C@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06501486_decoy,TRY1,Decoy,0,-7.92981,-7.02,-2.74,-9.657223679430963
CCOC(=O)CNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06546691_decoy,TRY1,Decoy,0,-8.18557,-7.42,-2.92,-8.318880193151982
CCOCCCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCC(C)C)c1ccc(O)cc1,C06600143_decoy,TRY1,Decoy,0,-9.24597,-7.22,-3.65,-8.28688415804883
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCOC)c2ccc(C)o2)cc1,C06601061_decoy,TRY1,Decoy,0,-7.27355,-6.59,-1.83,-8.52773882180764
CCOc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C06601656_decoy,TRY1,Decoy,0,-8.05742,-5.3,-3.37,-5.674532948599433
COc1ccc(Nc2nc(N/N=C/c3ccc(O)cc3O)nc(Nc3ccc([N+](=O)[O-])cc3)n2)cc1,C08872707_decoy,TRY1,Decoy,0,-9.19064,-10.02,-0.86,-8.247304656634544
COc1ccc(Nc2nc(N/N=C(\C)c3ccc(N)cc3)nc(Nc3ccc([N+](=O)[O-])cc3)n2)cc1,C08872709_decoy,TRY1,Decoy,0,-9.25855,-8.87,-2.71,-7.053029620600708
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc2ccccc12,C12467476_decoy,TRY1,Decoy,0,-7.17036,-7.01,-3.85,-7.273158958628826
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(OC)cc1OC,C12467520_decoy,TRY1,Decoy,0,-7.5244,-5.12,-1.34,-5.644377451395715
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccc(F)cc2)c1,C12473094_decoy,TRY1,Decoy,0,-8.56706,-8.28,-3.41,-8.70434362127354
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](CC(C)C)C(=O)NCCC(C)C)c1,C12479363_decoy,TRY1,Decoy,0,-8.2458,-5.73,-5.65,-6.105722876272985
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12479561_decoy,TRY1,Decoy,0,-7.0164,-7.45,-3.69,-7.2629648987076285
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2C)cc1,C12479568_decoy,TRY1,Decoy,0,-7.88836,-6.78,-1.46,-7.556115360263089
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1,C12479593_decoy,TRY1,Decoy,0,-7.37135,-4.0,-1.4,-4.582154628702556
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C12479615_decoy,TRY1,Decoy,0,-7.75827,-4.78,-1.41,-5.600672708980082
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(Cl)cc2)c1C,C12479762_decoy,TRY1,Decoy,0,-8.55937,-5.87,-3.5,-6.732489311796933
CCN[C@H]([NH2+]CC)C(=O)COc1ccc([C@@H]2C(C#N)=C(N)Oc3[n-]c(C(F)(F)F)nc32)cc1OC,C19324627_decoy,TRY1,Decoy,0,-7.83902,-7.14,-1.98,-6.644616798962323
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccc(N(CC)CC)cc2O)nnn1-c1nonc1N,C20037860_decoy,TRY1,Decoy,0,-9.44592,-6.87,-3.15,-7.118865323824299
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(O)ccc3ccccc23)n1N,C20806739_decoy,TRY1,Decoy,0,-8.85762,-8.42,-2.98,-7.163924122076165
CCCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(O)ccc3ccccc23)n1N,C20916344_decoy,TRY1,Decoy,0,-9.78892,-8.44,-3.27,-8.901074673645327
CC(C)c1ccc(OCc2nnc(SCc3nc(N)nc(Nc4ccc(Cl)cc4)n3)n2N)cc1,C22019406_decoy,TRY1,Decoy,0,-9.66402,-9.72,-2.38,-8.009558306928058
CC(=O)O[C@H](C[C@@H](O)[C@@](C)(O)CCC=C(C)C)/C(C)=C/COC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C31161894_decoy,TRY1,Decoy,0,-10.997,-6.87,-3.2,-8.413320824888167
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccccc1O,C36497846_decoy,TRY1,Decoy,0,-7.66834,-7.54,-2.27,-8.7741324318819
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500741_decoy,TRY1,Decoy,0,-8.07449,-6.82,-2.09,-6.814179524231383
CCCN(C(=O)c1ccc(O)cc1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36570686_decoy,TRY1,Decoy,0,-7.50521,-7.06,-5.4,-9.14236374735968
Cc1ccc(CN(C(=O)c2ccccc2O)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36595289_decoy,TRY1,Decoy,0,-8.1003,-7.89,-4.61,-11.628625165649224
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)o2)cc1,C06601062_decoy,TRY1,Decoy,0,-7.74275,-7.37,-3.26,-8.348919863416203
CC(=O)O[C@@H](C[C@@H](O)[C@](C)(O)CCC=C(C)C)/C(C)=C/COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C35457524_decoy,TRY1,Decoy,0,-10.4366,-6.86,-3.25,-8.092860814725803
O=C(CSc1nc2ccc(Oc3ccc4c(c3)=[NH+][C@@H](SCC(=O)NC3CC3)[NH+]=4)cc2[nH]1)NC1CC1,C38717063_decoy,TRY1,Decoy,0,-10.363,-7.46,-3.19,-7.394435040125972
CCCCc1ccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C39007202_decoy,TRY1,Decoy,0,-10.2922,-7.1,-1.74,-6.566060377436969
CCCCOc1ccc(Nc2ncnc(NNC(=O)COc3ccc(Cl)cc3Cl)c2N)cc1,C40754878_decoy,TRY1,Decoy,0,-10.1066,-6.48,-2.12,-6.365800766673758
Nc1c(NNC(=O)COc2ccc(Cl)cc2Cl)ncnc1NN(c1ccccc1)c1ccccc1,C40777898_decoy,TRY1,Decoy,0,-9.39951,-7.48,-2.08,-6.678245689532209
CC(C)COC(=O)c1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)cc1,C40782987_decoy,TRY1,Decoy,0,-10.1078,10.71,-3.35,0.2408962524292068
Cc1cc(C)cc(NCc2ccc3[nH+]c(NCCCN4CC[NH+](C)CC4)n(Cc4[nH+]c(C)ccc4[O-])c3c2)c1,C29134214_decoy,TRY1,Decoy,0,-10.0057,-7.52,-0.99,-7.062231695852489
CCc1cccc(CC)c1NC(=O)c1c(NCc2ccco2)sc(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1N,C03244561_decoy,TRY1,Decoy,0,-10.5397,-6.89,-5.26,-7.005472020127719
CC[NH+](CC)CCCNC(=S)NNC(=O)c1cnn2c1N[C@@H](c1ccccc1)C[C@H]2C(F)F,C20613896_decoy,TRY1,Decoy,0,-8.80908,-7.85,-3.99,-9.878871129522375
Cc1ccc(Cl)cc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(CCO)c2C)n1N,C59914581_decoy,TRY1,Decoy,0,-10.1632,-6.98,-3.67,-7.661273909642364
CCOC(=O)C1=C(C)N[C@@H](C)[C@@H]1S(=O)(=O)NCC(=O)Nc1ccc(C2[NH+]=c3ccccc3=[NH+]2)cc1,C63635498_decoy,TRY1,Decoy,0,-7.29372,-6.93,-3.77,-5.341905285414991
O=C(C[NH2+]C(c1ccccc1)c1ccccc1)Nc1ccccc1C(=O)NCc1ccco1,C09219422_decoy,TRY1,Decoy,0,-7.77377,-6.66,-0.71,-5.367749058965203
CCC[NH+]1CCc2c(sc(NC(=O)CCCSc3ccc(F)cc3)c2C(N)=O)C1,C09474784_decoy,TRY1,Decoy,0,-9.38488,-6.84,-1.7,-6.778664078876356
CC(=O)Nc1cccc(NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)[NH+]2CCCC2)c1,C08964209_decoy,TRY1,Decoy,0,-9.75765,-8.71,-1.27,-7.529531744573901
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3cccs3)C[NH+]12)NCc1ccc(F)cc1,C12530428_decoy,TRY1,Decoy,0,-8.47318,-5.38,-1.04,-5.360066621634827
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2,C14459461_decoy,TRY1,Decoy,0,-8.48446,-7.3,-3.2,-5.750663985745308
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14468057_decoy,TRY1,Decoy,0,-9.12435,-6.53,-4.42,-5.4397099282648655
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14468059_decoy,TRY1,Decoy,0,-9.93373,-7.72,-1.67,-6.902981173175562
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14468061_decoy,TRY1,Decoy,0,-8.57602,-5.83,-0.71,-6.028527940017868
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14468063_decoy,TRY1,Decoy,0,-10.9929,-6.65,-0.85,-6.95296876541108
O=C(C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1)Nc1ccccc1SC(F)F,C15044243_decoy,TRY1,Decoy,0,-7.73181,-7.69,-3.26,-7.067336958658804
C[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1ccccc1N1CCCCC1,C15103914_decoy,TRY1,Decoy,0,-10.6387,-7.67,-1.36,-6.838939486226693
Cc1ccc(S(=O)(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2[NH+](C)CCc2ccccn2)cc1,C20465881_decoy,TRY1,Decoy,0,-6.81653,-8.24,-1.62,-6.742869384973281
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(OC)c(O)c1)N2,C20690979_decoy,TRY1,Decoy,0,-8.45216,-8.16,-1.76,-8.410171173825667
CCC[NH+](CC(=O)Nc1ccccc1C)Cc1nc(N)c2c3c(sc2n1)CCCCC3,C23038235_decoy,TRY1,Decoy,0,-8.12885,-7.06,-3.09,-6.007317421785067
CC[NH+](CC)CCCNC(=S)NCCCNc1nc2cc3c(cc2cc1C#N)OCO3,C26401121_decoy,TRY1,Decoy,0,-8.82419,-5.79,-3.21,-6.147759630969474
CC(C)CNC(=O)c1ccccc1NC(=O)C[NH2+][C@H](c1ccc(F)cc1)c1cccs1,C29936397_decoy,TRY1,Decoy,0,-9.14082,-6.74,-1.01,-7.826088716198736
CCCCNC(=O)Nc1cccc([C@@H]2C(C(=O)Nc3ccccc3OC)=C(C)[NH+]=C3SCCCN32)c1,C33749053_decoy,TRY1,Decoy,0,-7.80237,-6.05,-1.7,-5.639473674431214
COc1ccc(N2CCN(c3cc(NCCC[NH+](C)C)c4c(c3N)C(=O)c3ccccc3C4=O)CC2)cc1,C09130692_decoy,TRY1,Decoy,0,-9.85278,-6.61,-0.71,-6.572302893220617
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3-c3cccs3)cc12,C35849752_decoy,TRY1,Decoy,0,-10.7284,-7.96,-3.48,-8.097700859836657
C[NH+](C)CCNc1nc(-c2cccc(Oc3ccccc3)c2)c2c(N)n(C(C)(C)C)nc2n1,C37358368_decoy,TRY1,Decoy,0,-7.77077,-5.85,-1.14,-5.494780527087577
CCC[NH+]1CCc2c(sc(NC(=O)CCS(=O)(=O)c3ccccc3)c2C(N)=O)C1,C09599597_decoy,TRY1,Decoy,0,-8.66523,-7.1,-2.33,-6.386654196601953
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](c2ccc(F)cc2)N2CC[NH+](C)CC2)cc1,C36699383_decoy,TRY1,Decoy,0,-9.21287,-7.71,-1.5,-6.519311517367983
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@H](c2ccc(F)cc2)N2CC[NH+](C)CC2)cc1,C36699384_decoy,TRY1,Decoy,0,-8.19377,-6.93,-1.18,-5.97959425739409
C[C@@H](NC(=O)c1ccc(N2CC[NH2+][C@@H](c3ccccc3)C2)nc1)C(O)(c1ccccc1)c1ccccc1,C39229396_decoy,TRY1,Decoy,0,-9.02515,-7.47,-4.29,-6.120675976776625
COC(=O)[C@H]1[C@H](NC(C)=O)c2cc(NC(C)C)c[nH+]c2N1CCc1c[nH]c2ccccc12,C39352719_decoy,TRY1,Decoy,0,-8.54575,-5.99,-1.09,-6.768035203585234
O=C(NCCOCCO)[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C39601625_decoy,TRY1,Decoy,0,-9.13936,-1.08,-3.4,-4.267595693929025
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C39601627_decoy,TRY1,Decoy,0,-8.81654,-5.94,-1.68,-6.344701165747958
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39631583_decoy,TRY1,Decoy,0,-9.55041,-5.85,-3.53,-7.1723728948987215
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1C,C39631818_decoy,TRY1,Decoy,0,-9.09261,-7.39,-3.62,-8.803464124944496
Cc1ccccc1CC(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632113_decoy,TRY1,Decoy,0,-9.0383,-5.3,-1.69,-6.650838309941292
Cc1ccccc1CC(=O)N1C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632115_decoy,TRY1,Decoy,0,-8.9985,-6.23,-1.3,-6.688556293091397
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655789_decoy,TRY1,Decoy,0,-9.06438,-8.12,-3.21,-7.699336223162554
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1,C39684140_decoy,TRY1,Decoy,0,-8.93837,-8.45,-3.83,-8.426297816648955
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+]C[C@H](c2c[nH]c3ccccc23)[C@@H]2CC=CS2)c1C,C39727272_decoy,TRY1,Decoy,0,-8.81514,-8.14,-1.87,-8.243613125932065
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1ccccc1C(F)(F)F,C40701860_decoy,TRY1,Decoy,0,-7.77227,-6.11,-2.45,-5.870033167715596
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1cccc(C)c1,C40720440_decoy,TRY1,Decoy,0,-8.44843,-5.1,-1.29,-5.409173902661134
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1ccccc1C,C40720449_decoy,TRY1,Decoy,0,-7.80205,-4.52,-1.91,-5.71036183930141
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1ccc(C(F)(F)F)cc1,C40798981_decoy,TRY1,Decoy,0,-8.00359,-7.47,-1.99,-6.612047345603799
CCCCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)NCCOC)[C@@H](O)[C@H]1[C@@H]2C,C43548610_decoy,TRY1,Decoy,0,-8.60771,-6.37,-2.42,-5.948928091326443
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3-c3ccsc3)cc12,C45385227_decoy,TRY1,Decoy,0,-11.0363,-7.87,-2.8,-8.524028755756254
CCc1ccccc1NC(=O)C[NH+](C)CC(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C46560475_decoy,TRY1,Decoy,0,-8.44051,-8.11,-1.7,-6.982358479482231
O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(CC[NH2+]C[C@H](O)c2cccnc2)cc1,C49525768_decoy,TRY1,Decoy,0,-7.53004,-7.65,-3.17,-6.100816098347287
O=C(Cn1c(=O)ncc2ccccc21)Nc1ccc(CC[NH2+]C[C@H](O)c2cccnc2)cc1,C49089699_decoy,TRY1,Decoy,0,-7.82851,-8.15,-1.83,-7.900021066867872
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3c(C(C)C)cccc3C(C)C)sc2[nH+]1,C14151833_decoy,TRY1,Decoy,0,-7.61809,-7.7,-2.91,-7.44354877490534
C=CCN1[C@@H](CC2=c3ccccc3=[NH+]C2)NN[C@H]1SCC(=O)Nc1ccc(C)cc1C,C63730274_decoy,TRY1,Decoy,0,-8.4681,-8.35,-2.17,-7.326137678661107
C=CCN1[C@H](CC2=c3ccccc3=[NH+]C2)NN[C@H]1SCC(=O)Nc1ccc(C)cc1C,C63730280_decoy,TRY1,Decoy,0,-9.1987,-7.58,-3.07,-7.293636043824353
O=C(CC[C@@H]1NN[C@H](C2(c3ccc(Cl)cc3)CCC2)O1)NC[C@H]1C=c2ccccc2=[NH+]1,C64066639_decoy,TRY1,Decoy,0,-9.76878,-7.78,-3.85,-7.146215057377632
O=C(CCC1=N[C@H](NC(=O)Nc2ccccc2)SC1)NCCC1=c2ccccc2=[NH+]C1,C64409162_decoy,TRY1,Decoy,0,-9.00192,-9.05,-0.7,-9.625286250649626
O=C(CCC1=N[C@@H](NC(=O)c2ccc[nH]c2=O)SC1)NCCC1=c2ccccc2=[NH+]C1,C64409328_decoy,TRY1,Decoy,0,-9.15437,-9.0,-2.32,-8.91942969130967
O=C(CCC1=N[C@H](NC(=O)c2ccc[nH]c2=O)SC1)NCCC1=c2ccccc2=[NH+]C1,C64409329_decoy,TRY1,Decoy,0,-8.57512,-8.0,-1.85,-6.329160798656146
CC(=O)[C@@H](C(=O)O[C@@H]1C[C@H](C)CC[C@@H]1C(C)C)[C@H](C)[C@@H](C(C)=O)/C(=N\NC(N)=O)O[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C,C04266913_decoy,TRY1,Decoy,0,-9.19043,-6.64,-4.64,-6.438033002733304
CCOc1ccccc1NC(=S)N(CCC[NH+](CC)CC)Cc1cc2cc(OC)ccc2[nH]c1=O,C06078196_decoy,TRY1,Decoy,0,-8.71871,-6.02,-2.64,-6.096480278370563
CC[NH+](CC)CCCNC(=S)N(Cc1ccc(OC)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C06193190_decoy,TRY1,Decoy,0,-9.30958,-7.28,-1.81,-7.688224472756393
CC[NH+](CC)CCCNC(=S)N(Cc1ccc(OC)cc1)Cc1cc2ccc(OC)cc2[nH]c1=O,C06193192_decoy,TRY1,Decoy,0,-7.1135,-6.65,-3.13,-6.430129825090312
CCOc1ccc(NC(=S)N(CC[NH+](CC)CC)Cc2cc3cc4c(cc3[nH]c2=O)OCO4)cc1,C06078364_decoy,TRY1,Decoy,0,-9.85739,-7.09,-1.62,-7.8087819087907615
CCOCCOc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccccc1[C@@H](C)CC,C09826123_decoy,TRY1,Decoy,0,-8.34509,-6.99,-2.98,-6.786219220893985
CCCC[C@H](CC)CNc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COc1cccc(CC)c1,C10385661_decoy,TRY1,Decoy,0,-8.92679,-6.78,-4.43,-7.0438826618871495
CCCCCOc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccccc1[C@H](C)CC,C14036125_decoy,TRY1,Decoy,0,-7.77749,-6.27,-3.57,-6.254812258539317
CCCCCC(=O)Nc1cccc(NC(=S)NC(=O)c2cc(Br)ccc2OCCOC)c1,C14560436_decoy,TRY1,Decoy,0,-10.3619,-6.81,-1.47,-7.121988587396889
CCCCn1c(N)c(N(CCC(C)C)C(=O)Cc2cc(OC)c(OC)c(OC)c2)c(=O)[nH]c1=O,C14623553_decoy,TRY1,Decoy,0,-8.96486,-6.32,-3.49,-6.3241367190133895
CCCCCN(C(=O)CCCOc1ccccc1OCC)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697792_decoy,TRY1,Decoy,0,-8.12788,-7.04,-3.79,-7.044270559095628
CCCCCN(C(=O)CCn1c(=O)n(CCC)c2ccccc21)c1c(N)n(CCCC)c(=O)[nH]c1=O,C16700245_decoy,TRY1,Decoy,0,-7.82832,-7.55,-2.94,-7.58115965033885
CCCCn1c(N)c(N(CCC(C)C)C(=O)COc2ccc(C#N)cc2OCC)c(=O)[nH]c1=O,C16708925_decoy,TRY1,Decoy,0,-8.38658,-6.63,-1.94,-7.192062860948647
CCCNc1nc(NCCC)nc(OCCCNC(=O)COc2ccc(Cl)cc2Cl)n1,C16848402_decoy,TRY1,Decoy,0,-9.43704,-6.86,-4.05,-7.594773080281048
CC(C)Nc1nc(NC(C)C)nc(OCCCNC(=O)COc2ccc(Cl)cc2Cl)n1,C16848406_decoy,TRY1,Decoy,0,-9.67645,-6.9,-2.72,-7.616373780146891
CCOCCC[NH2+]Cc1cc(Br)c(OC[C@@H](O)c2ccc3c(c2)OCO3)c(OC)c1,C20877035_decoy,TRY1,Decoy,0,-8.96421,-5.59,-1.84,-6.2195243083016365
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(C(=O)OC)cc3)n2)s1,C20905881_decoy,TRY1,Decoy,0,-10.2374,-6.3,-1.41,-6.876847002260687
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(C(=O)OC)cc2)n1,C20905909_decoy,TRY1,Decoy,0,-10.3974,-7.27,-1.83,-7.113121221495388
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cnn(C(C)C)c2)n1,C20910678_decoy,TRY1,Decoy,0,-9.87385,-6.71,-2.45,-6.75040802217192
CCOc1ccccc1Nc1nnc(SCC(=O)NC[C@@H](c2ccco2)[NH+](CC)CC)s1,C24852613_decoy,TRY1,Decoy,0,-9.21448,-6.54,-4.24,-6.978191925205906
C=CCOc1ccc(/C=C/C(=O)N(C)CC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1,C32971957_decoy,TRY1,Decoy,0,-7.97245,-6.16,-2.87,-6.896337821121301
CCCCN(Cc1ccco1)c1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1C(=O)NCCC,C33668857_decoy,TRY1,Decoy,0,-8.95021,-6.54,-4.21,-6.376323875430824
CC[NH+](CC)CCC[C@H](C)NC(=O)Cc1csc(NC(=O)CN(C(=O)c2ccc(C)cc2)C(C)C)n1,C33770825_decoy,TRY1,Decoy,0,-9.47466,-5.41,-3.71,-6.320421646768691
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@@H]2c2ccc(OCC(N)=O)cc2)cc1C,C34917260_decoy,TRY1,Decoy,0,-8.83119,-6.28,-2.63,-7.596594003770279
COCCNC(=O)[C@]1(OCc2ccccc2C)C[C@@H](O)[C@@H](O)[C@@H](OCc2cccc(OC(F)(F)F)c2)C1,C35591912_decoy,TRY1,Decoy,0,-8.53427,-7.14,-2.56,-7.91185534377652
COCCn1c([C@@H](C)N(CCCCCC[NH3+])C(=O)c2ccccc2Br)nc2ccccc2c1=O,C35743779_decoy,TRY1,Decoy,0,-9.7931,-5.85,-2.97,-8.161296313551844
C=CCOC(=O)c1sc2nc(C[NH+](CCCOC)C[C@H](O)COC(C)(C)C)[nH]c(=O)c2c1C,C35746749_decoy,TRY1,Decoy,0,-8.14677,-5.38,-3.21,-6.695082306057931
COCCC[NH+](Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1)C[C@@H](O)COc1ccccc1,C35747458_decoy,TRY1,Decoy,0,-9.51849,-7.85,-3.02,-10.860783165340656
COCCC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCCC3)C[C@@H](O)COCc1ccccc1,C36156756_decoy,TRY1,Decoy,0,-9.54625,-6.11,-1.86,-6.980875844528676
CCCC(=O)OC[C@H](O)C[NH+](CCOC)Cc1nc2scc(-c3ccc(C)cc3)c2c(=O)[nH]1,C36205601_decoy,TRY1,Decoy,0,-8.66,-6.65,-3.63,-8.49067845326341
COc1ccc(-c2csc3nc(C[NH+](CC(C)C)C[C@@H](O)COC(C)C)[nH]c(=O)c23)cc1OC,C36205889_decoy,TRY1,Decoy,0,-9.96302,-6.33,-3.44,-7.187880747271001
CCC[C@H](O)C[NH+](CCC(C)C)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C36206033_decoy,TRY1,Decoy,0,-9.38491,-5.84,-1.87,-6.618298266988851
CCc1c(C(=O)OC)sc2nc(C[NH+](C[C@H](O)COCc3ccccc3)C(C)C)[nH]c(=O)c12,C36206729_decoy,TRY1,Decoy,0,-7.61247,-7.32,-2.2,-6.938383777621334
C=CCOC[C@H](O)C[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)Cc1ccco1,C36207393_decoy,TRY1,Decoy,0,-9.71658,-6.46,-2.94,-6.893234512655739
Cc1c(C(=O)OC(C)C)sc2nc(C[NH+](C[C@H](O)COCc3ccco3)C(C)C)[nH]c(=O)c12,C36207408_decoy,TRY1,Decoy,0,-8.51013,-7.5,-1.85,-6.571543748570966
C=CCOC[C@@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)C(C)C,C36207707_decoy,TRY1,Decoy,0,-9.26616,-6.87,-3.66,-8.698159445181501
C=CCOC[C@@H](O)C[NH+](CCC)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C36207729_decoy,TRY1,Decoy,0,-9.94034,-6.75,-2.14,-6.794084434775573
C#CCOC[C@H](O)C[NH+](CCC(C)C)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C36207742_decoy,TRY1,Decoy,0,-9.58531,-6.21,-2.54,-6.830799983361507
C#CCOC[C@H](O)C[NH+](CCCOC)Cc1nc2scc(-c3cccc(Cl)c3)c2c(=O)[nH]1,C36207941_decoy,TRY1,Decoy,0,-10.0104,-6.06,-1.96,-8.50887366974566
CCCCCCN(C(=O)c1cccc(O)c1O)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36514765_decoy,TRY1,Decoy,0,-8.10947,-7.03,-4.67,-8.557077742531355
CCCCCCN(C(=O)c1cccc(O)c1O)[C@@H](C(=O)NCCCC)c1cc([N+](=O)[O-])ccc1Cl,C36514833_decoy,TRY1,Decoy,0,-8.42553,-6.0,-4.23,-6.66786029574147
CCCCCCN(C(=O)c1cccc(O)c1O)[C@H](C(=O)NCCCC)c1ccc([N+](=O)[O-])cc1,C36514874_decoy,TRY1,Decoy,0,-8.43177,-5.69,-3.97,-7.114759166932466
CCCCC/C=C\C(=O)N(CCC)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36563224_decoy,TRY1,Decoy,0,-8.28001,-6.02,-3.96,-8.075252540102117
CCOc1ccc2[nH]c(=O)c(CN(CC[NH+]3CCCC3)C(=S)Nc3ccccc3OCC)cc2c1,C12833583_decoy,TRY1,Decoy,0,-8.35223,-6.42,-4.21,-6.00246532369042
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NC[C@H](c1ccccc1OC)[NH+]1CCCC1,C12975151_decoy,TRY1,Decoy,0,-9.60738,-6.5,-1.91,-7.577258425572014
Cc1c(C#N)c(NCCCOCCOc2ccccc2)nc(N)c1/N=N\c1ccc([N+](=O)[O-])cc1,C33608981_decoy,TRY1,Decoy,0,-7.66247,-7.39,-1.57,-7.7553384952756
C=CC(C)(C)C1=CC=C(N(C)[C@H](C(=O)OC(C)(C)C)C(C)C)[C@H]2C(C[C@H]([NH3+])C(=O)OCC)=CN=C12,C39568849_decoy,TRY1,Decoy,0,-8.74444,-6.16,-4.09,-6.028358174005752
CCOC[C@H](O)C[NH+](CCC(C)C)Cc1nc2sc3c(c2c(=O)[nH]1)CCN(Cc1ccccc1)C3,C40404262_decoy,TRY1,Decoy,0,-9.58523,-6.62,-2.04,-8.213600320837365
COCC[NH+](Cc1nc2scc(-c3ccc(C)cc3C)c2c(=O)[nH]1)C[C@H](O)COCC(C)C,C40404724_decoy,TRY1,Decoy,0,-8.82755,-6.59,-1.76,-8.189508953699665
CCCCCCOc1ccc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C38706057_decoy,TRY1,Decoy,0,-8.98086,-6.01,-1.33,-7.4249617718413
C=CCNC(=O)O[C@@H]1[C@@H](NC(=O)NCCC)C[C@@](O)(C(=O)NCC(N)=O)C[C@H]1OC(=O)NCC=C,C04200792_decoy,TRY1,Decoy,0,-8.49081,-4.92,-3.21,-6.056839041825748
Cc1cc(NCCC[NH2+]CCCNc2cc(C)[nH+]c3cc(N)ccc23)c2ccc(N)cc2[nH+]1,C01563932_decoy,TRY1,Decoy,0,-8.39863,-9.42,-2.08,-7.470954808770702
CCOCCC(=O)NCC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](Nc2ncnc3[nH]cnc23)O[C@@H]1CO,C05440278_decoy,TRY1,Decoy,0,-6.28757,-5.74,-4.28,-5.968398172892244
CC(C)(CO)[NH2+]CCNc1ccc(NCC[NH2+]CCO)c2c1C(=O)c1ccccc1C2=O,C05545065_decoy,TRY1,Decoy,0,-9.13025,-5.14,-1.54,-5.4665081729461615
O=C(NCCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O)N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C05888707_decoy,TRY1,Decoy,0,-6.29483,-6.93,-3.62,-5.548448899789952
[NH2+]=C(NC(=[NH2+])Nc1ccc(S(=O)(=O)Nc2cnccn2)cc1)Nc1ccc(Br)cc1,C04362781_decoy,TRY1,Decoy,0,-8.95737,-6.71,-4.28,-5.976174268273304
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)ccc1O,C09450074_decoy,TRY1,Decoy,0,-9.26438,-7.46,-2.1,-7.407038119539964
CC(C)(CO)[C@H](O)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)CO,C03874605_decoy,TRY1,Decoy,0,-11.7301,-5.01,-3.6,-8.59604655872576
CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)CO,C03874604_decoy,TRY1,Decoy,0,-10.235,-4.96,-2.86,-7.731760340298408
O=C(OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C12652828_decoy,TRY1,Decoy,0,-5.60919,-7.15,-2.81,-4.783662590660849
OC[C@@H](O)CN(C[C@H](O)CO)c1ccc(Cc2ccc(N(C[C@H](O)CO)C[C@H](O)CO)cc2)cc1,C08926414_decoy,TRY1,Decoy,0,-9.72785,-5.71,-2.71,-6.927703407860332
O=C(N/N=C/[C@H](O)[C@H](O)[C@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@H](O)CO)c1ccccc1Cl,C15775361_decoy,TRY1,Decoy,0,-8.35519,-5.31,-2.77,-5.992763228127283
O=C(N/N=C/[C@H](O)[C@H](O)[C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@H](O)CO)c1ccccc1Cl,C15775365_decoy,TRY1,Decoy,0,-8.72048,-7.52,-2.73,-7.113621623170579
O=C(NCCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O,C16953404_decoy,TRY1,Decoy,0,-6.30846,-5.71,-2.18,-4.850872186072502
CN1C(=O)N/C(=C\c2ccc(S(=O)(=O)N/N=C/[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)cc2)C1=O,C16958904_decoy,TRY1,Decoy,0,-8.76738,-6.98,-2.47,-6.361457040566007
Oc1ccc(CCCC[C@H](CCc2ccc(O)c(O)c2)O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1O,C31155572_decoy,TRY1,Decoy,0,-7.7404,-8.95,-3.98,-7.371480621615528
CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C[C@@H](O)[C@@](O)(CO)[C@@H]12,C31158071_decoy,TRY1,Decoy,0,-7.7549,-5.91,-3.35,-5.667056196583322
CC[C@@H](CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C31164859_decoy,TRY1,Decoy,0,-5.72178,-6.2,-3.39,-5.145142569382761
CC[C@H](CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C31164863_decoy,TRY1,Decoy,0,-6.60028,-7.17,-2.62,-6.415927149707673
COc1cc(C[C@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C31167917_decoy,TRY1,Decoy,0,-9.12405,-7.74,-2.52,-8.56850911258027
O=C(N/N=C/[C@H](O)[C@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1Cl,C33957522_decoy,TRY1,Decoy,0,-8.35859,-8.25,-3.77,-7.25894961908326
O=C(OC[C@H]1O[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O)c1ccc([N+](=O)[O-])cc1,C34798815_decoy,TRY1,Decoy,0,-5.65278,-8.04,-2.7,-5.137184230350039
COc1cc([C@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2ccc(O)c(OC)c2)ccc1O,C35271371_decoy,TRY1,Decoy,0,-8.67759,-6.54,-4.11,-5.958801372986788
COc1cc(C[C@@H](CO)[C@@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)Cc2ccc(O)c(OC)c2)ccc1O,C35455235_decoy,TRY1,Decoy,0,-8.12914,-7.46,-4.75,-8.012924283877984
CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C[C@H](O)[C@](O)(CO)[C@@H]12,C35455795_decoy,TRY1,Decoy,0,-7.87466,-6.56,-3.34,-5.634863537002376
O=C(OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C36367363_decoy,TRY1,Decoy,0,-5.94803,-6.95,-2.86,-4.917953984382907
O=C(C[NH2+]CCCO)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]CCCO)c1Cl,C08403927_decoy,TRY1,Decoy,0,-7.73701,-6.79,-4.01,-6.944288873831447
CC(=O)O[C@@H](C[C@@H](O)[C@@](C)(O)CCC=C(C)C)/C(C)=C/COC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C35457519_decoy,TRY1,Decoy,0,-9.71473,-7.24,-2.39,-7.384999525352505
C[C@@H](CCc1ccc(O)cc1)O[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C31156051_decoy,TRY1,Decoy,0,-6.12543,-6.41,-1.63,-4.879988835210924
C[C@H](CCc1ccc(O)cc1)O[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C31156057_decoy,TRY1,Decoy,0,-6.02,-8.3,-1.61,-6.427177883817017
CC(C)[C@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C)O,C31164879_decoy,TRY1,Decoy,0,-6.47577,-6.83,-3.4,-7.133048258992381
CC(C)[C@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H](C)O,C31164887_decoy,TRY1,Decoy,0,-6.23708,-4.98,-2.22,-4.540041012794815
O=c1cc(-c2ccccc2)oc2c(C[NH+](CCO)CCO)c(O)c(C[NH+](CCO)CCO)c(O)c12,C39987055_decoy,TRY1,Decoy,0,-8.18181,-5.45,-1.57,-5.806496810694153
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193621_decoy,TRY1,Decoy,0,-6.98298,-6.28,-3.27,-5.388788944867639
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193642_decoy,TRY1,Decoy,0,-7.71217,-5.34,-3.31,-5.617024142198205
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193645_decoy,TRY1,Decoy,0,-8.09606,-5.79,-2.56,-5.365465542538011
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193648_decoy,TRY1,Decoy,0,-6.61022,-5.47,-3.23,-4.567137352968311
CCCCCCOc1cc([C@H]([NH3+])CC(N)=O)c(OCCCCCC)cc1[C@H]([NH3+])CC(N)=O,C44253325_decoy,TRY1,Decoy,0,-8.81579,-6.14,-4.66,-0.9215074446644536
CCCCCCOc1cc([C@@H]([NH3+])CC(N)=O)c(OCCCCCC)cc1[C@H]([NH3+])CC(N)=O,C44253328_decoy,TRY1,Decoy,0,-8.46469,-5.45,-4.81,-6.006973558420445
CCCCCCOc1cc([C@@H]([NH3+])CC(N)=O)c(OCCCCCC)cc1[C@@H]([NH3+])CC(N)=O,C44253331_decoy,TRY1,Decoy,0,-8.81047,-5.91,-4.0,-5.265851145655058
C/C(N)=C/C(=O)OC[C@@](C)(OC(=O)/C=C(/C)N)O[C@](C)(COC(=O)/C=C(/C)N)OC(=O)/C=C(/C)N,C44709957_decoy,TRY1,Decoy,0,-7.55734,-6.98,-4.14,-7.558931104295725
CCN1c2c(OCCCC[NH2+]CCc3ncc[nH]3)c[nH+]c(-c3ccccc3)c2N[C@@H]1c1nonc1N,C52565623_decoy,TRY1,Decoy,0,-8.54547,-7.03,-3.28,-6.5688099427729325
CCN1c2c(OCCC[NH2+]CCc3c[nH]cn3)c[nH+]c(-c3cccc(Cl)c3)c2N[C@@H]1c1nonc1N,C52565698_decoy,TRY1,Decoy,0,-10.035,-7.79,-2.15,-8.330806604562348
CCN1c2c(OCCC[NH2+]CCc3c[nH]cn3)c[nH+]c(-c3cccc(Cl)c3)c2N[C@H]1c1nonc1N,C52565700_decoy,TRY1,Decoy,0,-10.4753,-7.18,-2.64,-7.352667007016778
CCc1[nH+]c(N)nc(N)c1-c1ccc(OCCCCNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]23)cc1,C35653069_decoy,TRY1,Decoy,0,-12.3828,-7.48,-1.58,-10.000109714708094
C[C@@H](O)C[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]C[C@@H](C)O)c1Cl,C59382700_decoy,TRY1,Decoy,0,-8.93804,-7.16,-2.44,-7.687923731626441
COc1cc(C[NH2+]CCC2=c3ccccc3=[NH+]C2)ccc1O[C@@H]1N[NH2+]NN1c1ccccc1,C63280122_decoy,TRY1,Decoy,0,-7.30933,-8.59,-2.08,-6.091391357113366
COc1cc(C[NH2+]CCC2=c3ccccc3=[NH+]C2)ccc1O[C@H]1N[NH2+]NN1c1ccccc1,C63280123_decoy,TRY1,Decoy,0,-8.52512,-7.63,-1.66,-6.838354232867303
COCC[NH+](Cc1cccn1Cc1ccc(C(C)(C)C)cc1)C[C@H](O)COc1ccc(OC)cc1,C35498984_decoy,TRY1,Decoy,0,-9.03078,-6.97,-2.41,-6.485771543995292
CCN(CC)c1onc(-c2ccc(F)cc2)c1C[NH+](CCC(C)C)C[C@H](O)COc1ccccc1C,C35760472_decoy,TRY1,Decoy,0,-8.44543,-5.21,-2.87,-5.976546917926296
CC(C)OC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)noc1N(C)Cc1ccccc1)CC1CC1,C35760732_decoy,TRY1,Decoy,0,-7.80859,-6.68,-3.01,-9.914762224627308
C=CCC[C@@H](O)C[NH+](CCOC)CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(C)cc1C,C35779155_decoy,TRY1,Decoy,0,-9.71766,-6.54,-3.22,-8.259265852959194
CC(C)CC[NH+](Cc1c(-c2ccccc2F)noc1N1CCOCC1)C[C@H](O)COCc1ccco1,C35781156_decoy,TRY1,Decoy,0,-7.91272,-6.95,-2.58,-10.451490468766613
C=CCC[C@H](O)C[NH+](CCOC)Cc1c(C)nn(-c2ccc(F)cc2)c1Oc1ccc(F)cc1,C35789422_decoy,TRY1,Decoy,0,-7.25048,-6.53,-2.33,-7.170384833496869
COCCC[NH+](Cc1ccsc1)Cc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(OC)cc2)o1,C36202896_decoy,TRY1,Decoy,0,-10.3043,-6.96,-2.92,-7.510348751079785
COc1ccc(Oc2c(C[NH+](Cc3ccco3)C[C@H](O)COC(C)C)c(C)nn2-c2ccccc2)cc1,C36302479_decoy,TRY1,Decoy,0,-7.50628,-5.98,-2.76,-5.677406401290366
CCc1nn(-c2ccccc2)c(Oc2ccccc2OC)c1C[NH+](C[C@H](O)COCC(C)C)C1CC1,C36302768_decoy,TRY1,Decoy,0,-6.70135,-6.42,-2.97,-6.557607584792071
CCc1nn(-c2ccccc2)c(Oc2ccc(C)cc2)c1C[NH+](CCOC)C[C@H](O)COC(C)(C)C,C36303070_decoy,TRY1,Decoy,0,-7.83316,-5.85,-2.44,-6.601565824111367
C=CCOC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccccc1F)C[C@H]1CCCO1,C36303178_decoy,TRY1,Decoy,0,-7.4552,-5.89,-3.15,-5.854197898532813
C=CCOC[C@H](O)C[NH+](CCOC)Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1,C36303304_decoy,TRY1,Decoy,0,-6.9069,-6.13,-3.52,-6.328120060446121
CCOC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@H]1CCCO1,C36303343_decoy,TRY1,Decoy,0,-6.84021,-6.43,-2.61,-7.094163447139014
C=CCOC[C@H](O)C[NH+](Cc1ccco1)Cc1c(CC)nn(-c2ccc(F)cc2)c1Oc1ccccc1,C36303423_decoy,TRY1,Decoy,0,-8.69128,-6.76,-3.07,-7.5894452604544655
Cc1nn(-c2ccccc2)c(Oc2ccccc2Cl)c1C[NH+](CC1CC1)C[C@H](O)COCC(C)C,C36303590_decoy,TRY1,Decoy,0,-8.5154,-6.51,-1.78,-8.793174000738974
C=CCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccccc1Cl)CC1CC1,C36303610_decoy,TRY1,Decoy,0,-8.7303,-5.23,-2.52,-6.693075105161364
C=CCOC[C@H](O)C[NH+](Cc1ccco1)Cc1c(C)nn(-c2ccccc2)c1Oc1ccccc1OC,C36304413_decoy,TRY1,Decoy,0,-7.21659,-6.9,-3.03,-7.1422929205415775
C=CCC[C@@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(Cl)cc1,C36305090_decoy,TRY1,Decoy,0,-8.8109,-6.83,-2.0,-10.85368623698603
C=CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)[C@H](C)CC,C36305812_decoy,TRY1,Decoy,0,-6.69343,-6.49,-3.55,-6.994708885934672
C=CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)[C@@H](C)CC,C36305815_decoy,TRY1,Decoy,0,-7.59773,-6.33,-1.57,-7.607766571417234
COc1ccccc1Oc1c(C[NH+](C[C@@H](O)COCC(C)C)C2CC2)c(-c2ccccc2)nn1C,C36305838_decoy,TRY1,Decoy,0,-7.97668,-7.05,-3.63,-9.442012646382762
CC(C)COC[C@@H](O)C[NH+](Cc1ccco1)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1,C36307498_decoy,TRY1,Decoy,0,-8.54121,-7.25,-2.33,-7.935609314126528
CCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1)C[C@H](O)COCC(C)C,C36307681_decoy,TRY1,Decoy,0,-8.23814,-7.14,-2.58,-7.823735231581727
C=CCOC[C@@H](O)C[NH+](CC=C)CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(C)cc1C,C36309430_decoy,TRY1,Decoy,0,-8.58469,-6.51,-3.55,-8.331853039809971
CCCC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccccc1F)C[C@@H]1CCCO1,C36313685_decoy,TRY1,Decoy,0,-7.71385,-6.33,-3.25,-7.332292494853809
CCCC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccccc1F)C[C@@H]1CCCO1,C36313687_decoy,TRY1,Decoy,0,-9.25116,-5.87,-3.0,-7.8446669256127
CCCCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)[C@@H](C)CC,C36313785_decoy,TRY1,Decoy,0,-8.10418,-6.26,-4.19,-6.665900159472509
CCCCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)C1CC1,C36313789_decoy,TRY1,Decoy,0,-8.34054,-5.51,-2.52,-5.948061432260182
CCCCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccc(Cl)cc2)c1Oc1ccccc1)CC1CC1,C36313860_decoy,TRY1,Decoy,0,-8.28456,-5.21,-2.87,-5.908134615336714
CCCC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@@H]1CCCO1,C36313883_decoy,TRY1,Decoy,0,-7.87597,-5.71,-3.41,-6.658331388314192
CCCCOC[C@H](O)C[NH+](CCC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1F,C36313897_decoy,TRY1,Decoy,0,-7.69523,-6.32,-4.02,-6.635913678884572
CCCCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccccc1OC)CC1CC1,C36313910_decoy,TRY1,Decoy,0,-7.56752,-6.16,-1.91,-8.44983052947997
CCCCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1F)CC1CC1,C36313969_decoy,TRY1,Decoy,0,-8.39244,-6.56,-4.87,-7.7848089716330335
COCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1F)C[C@@H](O)COC(C)C,C36316120_decoy,TRY1,Decoy,0,-7.7907,-7.12,-4.09,-8.275413607234183
C=CCC[C@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1F,C36316127_decoy,TRY1,Decoy,0,-8.03061,-5.75,-3.33,-6.067150841501452
CCCCOC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(OC)cc1)C(C)C,C36316392_decoy,TRY1,Decoy,0,-8.25574,-6.89,-3.67,-9.689081541988722
C=CCOC[C@@H](O)C[NH+](CCC)Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(OC)cc1,C36316432_decoy,TRY1,Decoy,0,-7.57554,-5.48,-0.47,-6.394630713702961
C=CCOC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccccc1F)C(C)C,C36316464_decoy,TRY1,Decoy,0,-7.48077,-6.2,-2.66,-6.32490289834369
CCC[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@@H](O)COC(C)C,C36316503_decoy,TRY1,Decoy,0,-6.9584,-6.22,-2.34,-6.173159724377648
CCC[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@H](O)COCC(C)C,C36316506_decoy,TRY1,Decoy,0,-7.29742,-6.72,-4.34,-7.824280384140212
C=CCOC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)CC1CC1,C36316533_decoy,TRY1,Decoy,0,-7.23208,-5.19,-3.93,-6.17317244743583
C=CCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@H]1CCCO1,C36342107_decoy,TRY1,Decoy,0,-8.46784,-6.95,-2.49,-6.965811291991751
C=CCOC[C@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1)CC1CC1,C36342127_decoy,TRY1,Decoy,0,-6.85266,-6.66,-2.11,-6.822785879665997
CCCCOC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C(C)C,C36345797_decoy,TRY1,Decoy,0,-7.94388,-6.54,-4.38,-6.4404974165563225
CCC[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(C)cc1)C[C@H](O)COCC(C)C,C36345919_decoy,TRY1,Decoy,0,-6.78223,-6.47,-2.49,-6.744991703176841
C=CCOC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(C)cc1)C[C@@H]1CCCO1,C36346203_decoy,TRY1,Decoy,0,-6.64413,-6.69,-2.61,-7.012320738854935
C=CCOC[C@H](O)C[NH+](Cc1c(C(C)C)nn(-c2ccc(OC)cc2)c1Oc1ccccc1)C(C)C,C36346474_decoy,TRY1,Decoy,0,-7.07686,-6.31,-3.96,-7.218912781849829
C#CCOC[C@H](O)C[NH+](Cc1c(C(C)C)nn(-c2ccc(OC)cc2)c1Oc1ccccc1)C(C)C,C36346476_decoy,TRY1,Decoy,0,-7.73245,-6.58,-2.23,-6.934498074359408
C=CCOC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(OC)cc1)CC(C)C,C36316356_decoy,TRY1,Decoy,0,-7.59556,-6.09,-4.29,-6.782163018616884
C=CCOC[C@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(F)cc1)CC(C)C,C36316501_decoy,TRY1,Decoy,0,-6.86484,-6.17,-2.36,-6.469686397269729
COCCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)cc3)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C09429695_decoy,TRY1,Decoy,0,-7.86065,-8.05,-1.0,-8.68595127167211
COCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C09429697_decoy,TRY1,Decoy,0,-9.27434,-5.97,-0.73,-5.702774566509948
O=S(=O)(NC1=[NH+]CCC1)c1cccc(NC(=S)Nc2ccc(OC(F)F)cc2)c1,C09439355_decoy,TRY1,Decoy,0,-6.9448,-5.64,-3.09,-5.010877082930726
CC(C)[NH+]1CCc2c(sc(NC(=O)CS(=O)(=O)c3ccc(F)cc3)c2C(N)=O)C1,C09630078_decoy,TRY1,Decoy,0,-8.83231,-6.53,-4.32,-5.752166526680044
CCC[NH+]1CCc2c(sc(NC(=O)CS(=O)(=O)c3ccc(F)cc3)c2C(N)=O)C1,C09630089_decoy,TRY1,Decoy,0,-9.18031,-7.48,-4.05,-8.229483298490965
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+]2CCCC2)cc1,C10188282_decoy,TRY1,Decoy,0,-9.2735,-7.63,-2.15,-7.769300568999756
Cn1c(=O)[nH]c(=O)c2c1nc(N1CC[NH2+]CC1)n2C[C@H](O)COc1ccc(Cl)cc1,C10274111_decoy,TRY1,Decoy,0,-8.6185,-7.96,-1.48,-7.676269912672377
Cn1c(=O)[nH]c(=O)c2c1nc(N1CC[NH2+]CC1)n2C[C@@H](O)COc1ccc(Cl)cc1,C10274112_decoy,TRY1,Decoy,0,-8.36465,-8.08,-1.74,-7.248647757793829
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccc(F)cc3F)C[NH+]12,C12530596_decoy,TRY1,Decoy,0,-8.31286,-4.47,-1.84,-5.078945506224628
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C[NH+](C)CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C12820200_decoy,TRY1,Decoy,0,-8.20246,-5.49,-1.09,-5.349474501514185
O=C(CO/N=C/C1=C(O)CCCC1=O)NCCNc1[nH+]cc(C(F)(F)F)cc1Cl,C08733651_decoy,TRY1,Decoy,0,-9.82858,-7.06,-1.99,-6.414485086815935
COc1cc(C(=O)N[C@@H](C)C(=O)N2CCC3(CC2)[NH2+]CCc2[nH]cnc23)cc(OC)c1OC,C09130745_decoy,TRY1,Decoy,0,-7.84171,-6.32,-2.37,-5.877918745505724
O=C1NC[C@@H](CCC(=O)N2CCOCC2)[NH+]2C[C@@H](NC(=S)NCc3ccco3)C[C@@H]12,C15708265_decoy,TRY1,Decoy,0,-8.68409,-6.11,-1.3,-6.12481907439094
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3cccc(Cl)c3)C[NH+]12,C15708649_decoy,TRY1,Decoy,0,-9.00838,-5.51,-2.95,-5.870364455697323
CCn1ncc(C[NH+](C)CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC(C)C)c1C,C17099644_decoy,TRY1,Decoy,0,-8.99011,-6.34,-3.36,-6.79579371488823
Cc1nn(C)c(C)c1C[NH+](C)CC(=O)Nc1sc(C(N)=O)c(C)c1C(=O)OC(C)C,C17099645_decoy,TRY1,Decoy,0,-8.92433,-5.26,-2.0,-6.46987131205987
COCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C09058733_decoy,TRY1,Decoy,0,-8.89133,-8.71,-2.09,-10.044471759390795
COC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](NC(=O)Nc3ccc(OC)cc3)[C@@H]2O)CC1,C20463611_decoy,TRY1,Decoy,0,-8.20739,-7.32,-1.17,-7.257789994010844
CC(=O)N1CCC([NH2+][C@H]2CC(C)(C)[C@@H]3C[C@@](C)(O)CC[C@]23CCC(=O)NCCN2CCOCC2)CC1,C20464601_decoy,TRY1,Decoy,0,-9.7151,-6.99,-2.14,-6.4160020054118485
C[C@@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)C1,C22797985_decoy,TRY1,Decoy,0,-9.36704,-7.01,-2.66,-6.320986493539295
Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCCN1CC[NH+](C)CC1,C23361628_decoy,TRY1,Decoy,0,-8.61854,-6.53,-1.3,-8.806903954611613
C[C@@H]1C[C@@H](C)CN(C(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)C1,C24339022_decoy,TRY1,Decoy,0,-8.47751,-8.08,-2.06,-7.347143771497564
C[C@@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)C1,C24339029_decoy,TRY1,Decoy,0,-8.51343,-8.09,-3.99,-6.240195080389842
C[C@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)C1,C24339040_decoy,TRY1,Decoy,0,-8.2632,-5.5,-1.52,-6.572294472939022
Nc1c(C(=O)C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)c(=O)[nH]c(=O)n1C1CC1,C24573971_decoy,TRY1,Decoy,0,-6.97632,-8.33,-0.72,-9.722280518845656
CC(C)CNC(=O)C[NH+]1CCN(CCC(=O)NN2C(=O)NC3(CCCCC3)C2=O)CC1,C24881194_decoy,TRY1,Decoy,0,-8.31745,-5.81,-1.3,-5.969032853149328
Cc1cc(-c2cc(C(=O)NC3CC[NH+](CC(N)=O)CC3)c3cnn(C(C)C)c3n2)c(C)s1,C25148560_decoy,TRY1,Decoy,0,-10.6516,-7.66,-3.17,-7.793516720125075
COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2(O)[C@@H]3Cc4ccc(O)c5c4[C@]2(CC[NH+]3CC2CC2)[C@@H]1O5,C29489325_decoy,TRY1,Decoy,0,-7.39206,-5.84,-4.08,-5.44868237402652
Cc1csc(Sc2ccc(C(=O)NC3CC[NH+](CC(N)=O)CC3)cc2[N+](=O)[O-])n1,C32908377_decoy,TRY1,Decoy,0,-5.59318,-5.92,-2.18,-4.602182323794046
COC(=O)/C=C/C(=O)N[C@H]1CC[C@@]2(O)[C@@H]3Cc4ccc(O)c5c4[C@]2(CC[NH+]3CC2CC2)[C@@H]1O5,C33954554_decoy,TRY1,Decoy,0,-8.38059,-7.19,-2.51,-6.51424279255835
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)CCCn2c(=O)[nH]c3ccsc3c2=O)CC1,C02601709_decoy,TRY1,Decoy,0,-8.30596,-6.97,-1.9,-5.665425241343561
N#C[C@@H]1CSCN1C(=O)CN(N)C1CC[NH+](CC(=O)Nc2ccc(Cl)cn2)CC1,C38576006_decoy,TRY1,Decoy,0,-8.37609,-5.43,-2.74,-5.052378629901988
Cc1cc(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39601871_decoy,TRY1,Decoy,0,-7.3409,-4.79,-2.42,-4.897232810837672
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632068_decoy,TRY1,Decoy,0,-9.30805,-6.19,-2.89,-5.882376305736077
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cccc(OC(C)=O)c2C)CC12CC[NH2+]CC2,C39683923_decoy,TRY1,Decoy,0,-7.70227,-5.43,-0.97,-5.208151835612981
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(OC(C)=O)c2C)CC12CC[NH2+]CC2,C39683924_decoy,TRY1,Decoy,0,-8.12366,-7.77,-2.61,-6.933633630916377
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685696_decoy,TRY1,Decoy,0,-8.24341,-5.41,-2.7,-5.724809981899921
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685720_decoy,TRY1,Decoy,0,-8.92488,-4.73,-3.18,-5.592254980767215
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685721_decoy,TRY1,Decoy,0,-8.50318,-5.41,-3.87,-6.320550133000992
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685906_decoy,TRY1,Decoy,0,-9.14747,-5.42,-0.86,-5.940856655888189
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685907_decoy,TRY1,Decoy,0,-9.60132,-4.86,-3.09,-5.829260595997491
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39693540_decoy,TRY1,Decoy,0,-8.51927,-5.71,-2.38,-5.724326095456122
CCNc1nc(NCCc2ccncc2)ncc1-c1nnc(CN2C[C@@H](C)[NH2+][C@@H](C)C2)o1,C43196287_decoy,TRY1,Decoy,0,-10.4896,-6.79,-4.2,-6.794550746586399
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C44713827_decoy,TRY1,Decoy,0,-7.46647,-7.05,-2.48,-5.656231016057196
CC(C)OC(=O)N(C)[C@@H]1C[NH2+][C@H](C(=O)N2CC=C(c3ccccc3)CC2)[C@@H](C(=O)NO)C1,C45287299_decoy,TRY1,Decoy,0,-8.26375,-6.43,-1.77,-7.117081277660525
CNc1scc(-c2ccc(O)c(C(N)=O)c2)[n+]1/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2,C45326888_decoy,TRY1,Decoy,0,-8.80427,-7.0,-1.18,-7.969109697711837
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](Cc2ccc(C#N)cc2)CC1,C22804246_decoy,TRY1,Decoy,0,-10.5223,-7.86,-1.49,-6.654566444815594
[NH2+]=C(N/N=C/C1=c2ccccc2=[NH+]C1)S[C@H]1CC(=O)N(c2ccc(C(=O)[O-])cc2)C1=O,C63416387_decoy,TRY1,Decoy,0,-8.53823,-8.18,-4.55,-9.207413337263516
COCc1cc(C)nc2c1[C@@H](N)[C@@H](C(=O)NCCC1=c3cc(OC(F)(F)F)ccc3=[NH+][C@@H]1C)S2,C63514835_decoy,TRY1,Decoy,0,-8.90136,2.09,-2.47,-1.0498810868419086
CCNc1nc(NCC)[n+]2c(n1)SC[C@@]2(O)Nc1c(Cl)cc(Cl)cc1Cl,C67321247_decoy,TRY1,Decoy,0,-9.40567,-5.67,-1.1,-6.159732304337841
[NH3+]CCn1ccc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)nc1=O,C05808456_decoy,TRY1,Decoy,0,-7.22634,-6.62,-1.65,-6.348387481563285
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)Cc1ccc(Cl)c(Cl)c1,C08532258_decoy,TRY1,Decoy,0,-7.95627,-6.77,-1.4,-5.644748497410385
CC1(C)CC(NC(=O)CCNC2=NS(=O)(=O)c3ccccc32)CC(C)(C)[NH2+]1,C11423121_decoy,TRY1,Decoy,0,-8.01448,-6.89,-3.42,-5.677755724555737
COc1ccc([C@@H]2NCC[C@@H]3[NH+]=CN[C@@H]32)cc1CSc1nc2ccccc2[nH]1,C20375431_decoy,TRY1,Decoy,0,-9.13927,-6.88,-3.51,-5.8695193189501005
NC(=O)[C@@H]1Cc2ccccc2C[NH+]1C[C@@H](O)COc1c(Cl)cccc1Cl,C21308856_decoy,TRY1,Decoy,0,-8.97041,-5.65,-3.24,-5.488681587893719
NC(=O)[C@@H]1Cc2ccccc2C[NH+]1C[C@H](O)COc1c(Cl)cccc1Cl,C21308858_decoy,TRY1,Decoy,0,-8.31694,-6.87,-4.19,-5.7188110338690015
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)Cc1ccc(F)cc1F,C22965021_decoy,TRY1,Decoy,0,-9.39677,-6.81,-1.67,-6.845411474228798
O=C(C[NH+]1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Cl)c1)NC(=O)NC1CC1,C26463095_decoy,TRY1,Decoy,0,-8.69121,-6.78,-1.45,-6.841102441053267
O=C(C[NH+]1CCC[C@@H]1C(=O)Nc1cc(Cl)cc(Cl)c1)NC(=O)NC1CC1,C26463101_decoy,TRY1,Decoy,0,-8.43906,-5.61,-1.12,-6.905307594773164
COCCNC(=O)c1cc(N[C@H]2c3ccccc3C[C@@H]2O)c2[nH+]c(C)c(C)n2c1,C28826112_decoy,TRY1,Decoy,0,-8.96332,-6.67,-1.72,-6.064112488456589
CC1CCC2(CC1)NC(=O)N(NC(=O)C[NH2+][C@@H](c1cccs1)C(C)C)C2=O,C29189940_decoy,TRY1,Decoy,0,-8.62881,-7.34,-1.64,-8.737944605995278
CC(C)[NH+]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)c2C(N)=O)C1,C35586189_decoy,TRY1,Decoy,0,-9.16365,-6.67,-1.8,-5.470898887353487
C[NH+](C)CCNS(=O)(=O)c1c(Br)cc(N)cc1Br,C37054690_decoy,TRY1,Decoy,0,-6.05625,-5.18,-1.77,-4.493680671263543
CC[NH+](Cc1c(-c2ccc3c(c2)NC(=O)CO3)nc2ccc(N)cn12)C(C)(C)C,C36270318_decoy,TRY1,Decoy,0,-8.03914,-7.25,-2.42,-7.175005887890965
CCOc1ccc([C@@H]2CN[C@H](NCc3c[nH]c4ccccc34)[NH+]2CCOC)cc1,C39159970_decoy,TRY1,Decoy,0,-7.27316,-6.95,-1.29,-13.272556517491136
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39597969_decoy,TRY1,Decoy,0,-8.0718,-7.61,-2.19,-6.83981878387762
O=C(NCCCO)[C@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39605314_decoy,TRY1,Decoy,0,-8.58235,-5.96,-1.56,-5.63616302370537
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)C(C)C)CC34CC[NH2+]CC4)c2c1,C39655779_decoy,TRY1,Decoy,0,-8.05348,-5.54,-1.47,-5.655541389024783
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4ccc(Cl)cc4)CC34CC[NH2+]CC4)c2c1,C39655891_decoy,TRY1,Decoy,0,-9.50467,-8.77,-2.1,-7.132823400067401
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4ccncc4)CC34CC[NH2+]CC4)c2c1,C39656058_decoy,TRY1,Decoy,0,-8.46826,-8.45,-1.07,-6.741060119501888
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)cc1,C39676365_decoy,TRY1,Decoy,0,-8.77638,-8.7,-1.21,-6.681139219369293
O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@@H]1CN(C(=O)c2ccncc2)CC12CC[NH2+]CC2,C39676470_decoy,TRY1,Decoy,0,-9.52593,-8.14,-1.48,-7.473304410734226
CC[C@@H](CNC(=O)Nc1ccccc1CC(=O)NC)[NH+]1CCc2ccccc2C1,C44178694_decoy,TRY1,Decoy,0,-8.87776,-6.52,-3.86,-5.946106553208372
C[C@H]([NH2+][C@H](C)c1ccc(OC(F)F)cc1)C(=O)NC(=O)NCc1cccs1,C44803488_decoy,TRY1,Decoy,0,-7.39344,-7.56,-3.24,-6.011721873702599
C[NH+](C)[C@@H](CNC(=O)NNc1c(F)c(F)c(F)c(F)c1F)c1ccsc1,C46347532_decoy,TRY1,Decoy,0,-8.76154,-5.92,-1.52,-5.867886282290287
C[NH+](C)[C@H](CNC(=O)NNc1c(F)c(F)c(F)c(F)c1F)c1ccsc1,C46347533_decoy,TRY1,Decoy,0,-8.79869,-6.09,-2.44,-5.779650116885738
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)NNC(=O)c1ccc(Cl)cc1,C54043764_decoy,TRY1,Decoy,0,-9.14893,-6.8,-1.49,-6.420940829497732
CNC(=O)NC(=O)[C@@H](C)[NH+](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C31157995_decoy,TRY1,Decoy,0,-7.29577,-5.88,-2.26,-5.41659235978462
C[C@H](NC(=O)Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(NC(=O)C2CC2)cc1,C48083115_decoy,TRY1,Decoy,0,-9.19149,-6.4,-1.26,-5.420420186209993
CC(C)C[C@@H]([NH3+])C(=O)N/N=C1/C(=O)N(CCOc2ccccc2)c2ccccc21,C06952256_decoy,TRY1,Decoy,0,-8.48699,-7.21,-1.31,-7.463251750910398
O=C(CNc1ccccc1[NH+]1CCC(O)CC1)Nc1ccc(C(F)(F)F)cc1,C55888242_decoy,TRY1,Decoy,0,-7.81262,-8.12,-1.27,-5.630783853385948
O=C(NCCNc1ccc2ccccc2n1)NC[C@@H](c1ccco1)[NH+]1CCCC1,C60343610_decoy,TRY1,Decoy,0,-8.3825,-5.66,-4.15,-5.798057069345529
CC(=O)Nc1cc(NC(=O)NC2CC[NH+](CC3CCCC3)CC2)c(F)cc1F,C63394724_decoy,TRY1,Decoy,0,-8.2073,-7.41,-3.28,-6.02212729387997
CC1=N[C@H](NC(=O)CSc2[nH]c(Cc3ccc(O)cc3)c(C)[nH+]2)[C@H](C#N)[C@H]1C,C63533194_decoy,TRY1,Decoy,0,-8.99383,-7.19,-1.74,-5.926650009754512
CC(C)(C)N1CCC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C64010241_decoy,TRY1,Decoy,0,-10.1975,-7.82,-4.02,-7.23409653726866
C[C@H]1c2c(O)cc(O)cc2OC(=O)[C@H]1CC(=O)NCCC1=c2ccccc2=[NH+]C1,C64137023_decoy,TRY1,Decoy,0,-9.01538,-8.55,-3.04,-7.400580025919657
C[C@@H]1c2ccc(O)c(O)c2OC(=O)[C@H]1CC(=O)NCCC1=c2ccccc2=[NH+]C1,C64165832_decoy,TRY1,Decoy,0,-8.72112,-8.53,-4.55,-7.9289619150697614
O=C(C[NH+]1CCC(NC(=O)C2CCCCC2)CC1)NC(=O)NC1CCCCC1,C65963956_decoy,TRY1,Decoy,0,-8.96471,-8.69,-3.84,-8.534872748240113
CC(C)NC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66390661_decoy,TRY1,Decoy,0,-7.48752,-7.25,-1.28,-6.9590810429492285
NC(=O)C[NH+]1CCC[C@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCCC3)C1,C66449407_decoy,TRY1,Decoy,0,-8.77346,-6.49,-0.15,-5.421675977366814
C[NH+](C)[C@H](CNC(=O)Nc1cccc(-c2ccc(=O)[nH]n2)c1)c1cccc(F)c1,C66679197_decoy,TRY1,Decoy,0,-7.40956,-7.75,-0.69,-5.478685004161743
O=C(CC1CCCCC1)NC1CC[NH+](CC(=O)N[C@@H]2CCCCNC2=O)CC1,C66886270_decoy,TRY1,Decoy,0,-7.88594,-5.4,-1.51,-5.248219334046631
O=C(CC1CCCCC1)NC1CC[NH+](CC(=O)N[C@H]2CCCCNC2=O)CC1,C66886272_decoy,TRY1,Decoy,0,-8.4295,-6.31,-2.12,-6.271212450791537
CC(=O)Nc1cc(NC(=O)NC[C@@H](C(C)C)[NH+]2CCC(C)CC2)c(F)cc1F,C66980990_decoy,TRY1,Decoy,0,-9.24617,-7.29,-3.68,-7.625604046894665
CC(=O)Nc1cc(NC(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)c(F)cc1F,C66981486_decoy,TRY1,Decoy,0,-8.64852,-5.79,-3.37,-5.927212929425952
CC(=O)Nc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@H](C)C2)c(F)cc1F,C66981891_decoy,TRY1,Decoy,0,-7.80094,-5.68,-2.37,-5.330672063667522
CC(=O)Nc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)c(F)cc1F,C66981892_decoy,TRY1,Decoy,0,-7.94905,-5.12,-2.11,-4.733375181247567
CC(=O)Nc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)c(F)cc1F,C66981894_decoy,TRY1,Decoy,0,-8.85692,-5.81,-4.91,-5.219487110094885
C[NH+](C)[C@@H](CNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)C1CCCCC1,C67163815_decoy,TRY1,Decoy,0,-9.58094,-6.86,-2.57,-7.281649667535095
CCCCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67400556_decoy,TRY1,Decoy,0,-8.1729,-4.97,-2.28,-5.264307110448187
O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO,C04756455_decoy,TRY1,Decoy,0,-8.79816,-8.11,-2.48,-9.530848867691116
Cc1cc(NCCSSCCNc2cc(C)nc(N)n2)nc(N)n1,C04784919_decoy,TRY1,Decoy,0,-9.94649,-6.03,-1.65,-8.583501623029779
N#CCC(=[NH2+])NNC(=O)CCCNc1[nH+]cc(C(F)(F)F)cc1Cl,C03116669_decoy,TRY1,Decoy,0,-6.84738,-7.05,-4.21,-7.412889295093305
C=CCNC(=S)Nc1cccc(NC(=O)C[C@H]([NH2+]CCCO)C(=O)[O-])c1,C05258991_decoy,TRY1,Decoy,0,-8.54502,-5.55,-3.81,-5.671451319905825
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]CCCO)C(=O)[O-])c1,C05258992_decoy,TRY1,Decoy,0,-7.92147,-4.54,-2.08,-5.21124768631975
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCCO)ccc(NCCCO)c21,C05386603_decoy,TRY1,Decoy,0,-6.7606,-7.5,-1.95,-7.057118231572676
CC(C)[C@H](NC(N)=O)C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C05937745_decoy,TRY1,Decoy,0,-9.60347,-6.58,-3.06,-7.012139565909826
CC(C)[C@@H](NC(N)=O)C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C05937746_decoy,TRY1,Decoy,0,-9.14356,-6.56,-2.05,-6.394276944692012
O=C1c2ccccc2C(=O)c2c(NC[C@H](O)CO)ccc(NC[C@H](O)CO)c21,C05647234_decoy,TRY1,Decoy,0,-8.7941,-5.61,-1.57,-6.549519482045974
O=C1c2ccccc2C(=O)c2c(NC[C@@H](O)CO)ccc(NC[C@@H](O)CO)c21,C05647242_decoy,TRY1,Decoy,0,-8.50934,-5.21,-0.03,-5.529334886735065
CCc1cccc(C)c1NC(=S)NNC(=O)[C@H](CCSC)NC(N)=O,C07258105_decoy,TRY1,Decoy,0,-8.20335,-6.14,-3.66,-6.210129291628508
Cc1[nH]c(=S)[nH]c(=O)c1CCC(=O)NCCCCCc1n[nH]c(N)c1C#N,C12547793_decoy,TRY1,Decoy,0,-9.19495,-7.28,-2.91,-7.713380561091594
[NH3+][C@@H](CCCCNC(=O)CCCC[C@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)[O-],C01530221_decoy,TRY1,Decoy,0,-8.55323,-6.27,-3.89,-6.730548101515431
CC(CO)(CO)NC(=O)C(F)(F)C(F)(F)C(=O)NC(C)(CO)CO,C02995964_decoy,TRY1,Decoy,0,-6.0779,-5.67,-2.75,-4.98756185384169
COC[C@@H](C)NC(=S)NNC(=O)C(=O)NNC(=S)N[C@@H](C)COC,C16221216_decoy,TRY1,Decoy,0,-8.25481,-4.85,-1.78,-6.343030411489574
CC[C@@H](C)Sc1nnc(NC(=O)CSc2nnc(NN)n2N)s1,C20921954_decoy,TRY1,Decoy,0,-9.85886,-7.59,-2.03,-11.07582628817016
CC(C)CSc1nnc(NC(=O)CSc2nnc(NN)n2N)s1,C21036197_decoy,TRY1,Decoy,0,-8.48027,-6.8,-1.55,-8.013348245823215
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(N)=O)n2N)c(O)c1,C21325661_decoy,TRY1,Decoy,0,-8.57314,-6.92,-1.1,-7.828590431282533
CCCCN(CCC(=O)NC(N)=O)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C22992914_decoy,TRY1,Decoy,0,-7.91425,-4.84,-3.16,-5.6293901956236665
O=C1c2ccccc2C(=O)c2c(NC[C@@H](O)CO)ccc(NC[C@H](O)CO)c21,C17257093_decoy,TRY1,Decoy,0,-8.54449,-5.39,-0.47,-5.926983705304395
[NH3+]CCOCCOCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12,C34505672_decoy,TRY1,Decoy,0,-9.5897,-5.34,-2.22,-6.9620679730790975
[NH3+]CCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C34505675_decoy,TRY1,Decoy,0,-8.83212,-5.46,-2.27,-7.205454137084385
[NH3+]CCOCCOCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C34505678_decoy,TRY1,Decoy,0,-8.58097,-4.93,-2.19,-5.507956932631208
[NH3+]CCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21,C34505681_decoy,TRY1,Decoy,0,-9.33401,-5.67,-3.11,-6.45201409491
NNC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C04534200_decoy,TRY1,Decoy,0,-8.61651,-5.74,-2.12,-5.953455010024463
COCC[NH2+]C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH2+]CCOC)cc1,C38711140_decoy,TRY1,Decoy,0,-7.90233,-4.51,-1.64,-5.60435384250586
COCC[NH2+]C[C@@H](O)COc1ccc(OC[C@H](O)C[NH2+]CCOC)cc1,C38711141_decoy,TRY1,Decoy,0,-9.67755,-5.56,-2.64,-7.393110635288576
COCC[NH2+]C[C@H](O)COc1ccc(OC[C@@H](O)C[NH2+]CCOC)cc1,C38711142_decoy,TRY1,Decoy,0,-8.97645,-4.82,-3.35,-5.764421815069889
CSCC[C@@H](NC(N)=O)C(=O)NNC(=S)Nc1cc(C)ccc1C,C41782300_decoy,TRY1,Decoy,0,-7.41376,-6.84,-4.48,-5.903379636109206
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1cc(C)ccc1C,C41782301_decoy,TRY1,Decoy,0,-8.42135,-6.59,-2.5,-7.156992396597633
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1cccc(C)c1C,C41957884_decoy,TRY1,Decoy,0,-8.36896,-6.53,-2.62,-7.495832707554489
NC(=O)C(NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(N)=O,C42789057_decoy,TRY1,Decoy,0,-5.81766,-6.47,-3.02,-5.0372099035726094
N/C(=N\O)c1ccc(OCCCCCOc2ccc(/C(N)=N\O)cn2)nc1,C43019377_decoy,TRY1,Decoy,0,-9.65044,-8.29,-0.35,-11.66996344418076
C[NH+](C)/C=C(/c1nn(-c2ccccc2)c(Cl)c1[C@H]([NH3+])CC(N)=O)[C@H](N)CC(N)=O,C44253808_decoy,TRY1,Decoy,0,-8.06576,-6.14,-4.43,-5.381362139283017
C[NH+](C)/C=C(/c1nn(-c2ccccc2)c(Cl)c1[C@@H]([NH3+])CC(N)=O)[C@H](N)CC(N)=O,C44253810_decoy,TRY1,Decoy,0,-7.61676,-6.4,-1.06,-7.297023109464907
C[NH+](C)/C=C(/c1nn(-c2ccccc2)c(Cl)c1[C@H]([NH3+])CC(N)=O)[C@@H](N)CC(N)=O,C44253813_decoy,TRY1,Decoy,0,-7.39123,-6.13,-1.51,-5.4227829539094445
C[NH+](C)/C=C(/c1nn(-c2ccccc2)c(Cl)c1[C@@H]([NH3+])CC(N)=O)[C@@H](N)CC(N)=O,C44253816_decoy,TRY1,Decoy,0,-6.88671,-5.69,-2.5,-4.972394141274392
CCCCn1c(N)c(N(C)CC(=O)Nc2sccc2C(N)=O)c(=O)[nH]c1=O,C10432183_decoy,TRY1,Decoy,0,-7.12295,-6.8,-3.23,-5.315739016440945
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1ccc(C)cc1C,C58167321_decoy,TRY1,Decoy,0,-7.45829,-5.37,-1.58,-5.847730743723012
[H]/N=C(/NCCCCCC/N=C(\N)NC#N)N/C(N)=N\c1ccc(Cl)cc1,C22054233_decoy1,TRY1,Decoy,0,-8.53048,-6.8,,-7.074844556050712
NC(=O)C(NC(=O)NCCCOc1ccc(Cl)cc1Cl)C(N)=O,C63330577_decoy,TRY1,Decoy,0,-8.08225,-6.58,-2.0,-7.151639707384005
CCN(CC)C(=O)CS[C@@H]1NN[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684367_decoy,TRY1,Decoy,0,-8.0086,-6.73,-1.66,-6.728771002064131
CCN(CC)C(=O)CS[C@H]1NN[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684370_decoy,TRY1,Decoy,0,-7.94523,-7.39,-1.53,-6.156694366067607
CCN(CC)C(=O)CS[C@@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684373_decoy,TRY1,Decoy,0,-7.70803,-6.76,-1.24,-5.931495335393823
CCN(CC)C(=O)CS[C@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684375_decoy,TRY1,Decoy,0,-9.09377,-4.92,-2.23,-5.2152558633219215
[H]/N=C(\NC#N)NCCCCCCNC(=[NH2+])N/C(=N\[H])Nc1ccc(Cl)cc1,C22054233_decoy2,TRY1,Decoy,0,-8.37598,-6.82,,-7.4988526055342035
CSCC[C@@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C(C)C,C66122771_decoy,TRY1,Decoy,0,-7.89925,-6.78,-4.59,-6.135081337564536
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C(C)C,C66123213_decoy,TRY1,Decoy,0,-8.0582,-5.58,-3.19,-4.816430348226779
CCCNC(=O)C[NH+]1CCC(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)CC1,C67622328_decoy,TRY1,Decoy,0,-8.77444,-6.58,-3.23,-6.1520975704963154
CCCNC(=O)C[NH+]1CCC(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)CC1,C67622333_decoy,TRY1,Decoy,0,-8.3539,-5.51,-3.84,-5.101704054738706
C[C@@H]1O[C@H](Nc2ccc(-c3ccc(N[C@@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@@H]4O)cc3)cc2)[C@H](O)[C@H](O)[C@@H]1O,C03995730_decoy,TRY1,Decoy,0,-6.62594,-8.31,-3.55,-5.263341595783588
O=c1c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C04349347_decoy,TRY1,Decoy,0,-8.89856,-8.94,-1.75,-8.844560937905834
C[C@H]1O[C@H](Cc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C04349562_decoy,TRY1,Decoy,0,-8.91922,-6.91,-3.94,-5.900631888047398
CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C04349592_decoy,TRY1,Decoy,0,-10.4887,-9.27,-2.99,-9.57734667469713
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc(OC)c1O,C04349692_decoy,TRY1,Decoy,0,-10.1229,-8.74,-4.66,-8.898557243589465
C[NH+](C)[C@H]1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(Cl)c4[C@@H](O)[C@H]3C[C@H]12,C04574439_decoy,TRY1,Decoy,0,-7.95695,-6.1,-4.36,-4.57448872200409
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(Cl)c4[C@@H](O)[C@H]3C[C@H]12,C04574440_decoy,TRY1,Decoy,0,-7.71222,-7.39,-0.64,-5.195826653310516
C[C@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@H]1O,C04692013_decoy,TRY1,Decoy,0,-9.14562,-9.28,-1.18,-8.057959595324812
C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C04692016_decoy,TRY1,Decoy,0,-9.35603,-9.27,-1.27,-7.820344834814182
C[C@]1(OC[C@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970277_decoy,TRY1,Decoy,0,-5.71837,-5.23,-2.19,-3.409264698175158
CC(=O)N[C@@]1(C)[C@H](C)O[C@@](C)(CO)[C@](C)(O)[C@@]1(C)O[C@@]1(C)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970308_decoy,TRY1,Decoy,0,-4.75074,-4.66,-2.33,-3.9069034331604007
C[C@@]1(OC[C@@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970473_decoy,TRY1,Decoy,0,-6.33127,-6.45,-3.97,-4.978310809494986
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@@H]12,C11592622_decoy,TRY1,Decoy,0,-9.42188,-6.49,-5.36,-5.137630147444799
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@@H]12,C11592623_decoy,TRY1,Decoy,0,-7.95538,-6.15,-2.69,-4.069649514321239
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@@H]12,C11592647_decoy,TRY1,Decoy,0,-8.59666,-5.46,-1.99,-4.347048693577036
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@H]12,C11592649_decoy,TRY1,Decoy,0,-8.45766,-6.23,-1.76,-4.40901920576103
O=c1cc(-c2cc(O)c(O)c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c12,C12428285_decoy,TRY1,Decoy,0,-8.9889,-9.78,-4.63,-8.269418553281339
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@@H]12,C08034234_decoy,TRY1,Decoy,0,-8.59565,-6.0,-1.78,-5.127164158743008
Nc1ncnc2c1[nH]/c(=N\N=C\c1ccc(Br)cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C08818417_decoy,TRY1,Decoy,0,-8.64306,-8.55,-1.06,-8.422908594018422
O=c1c(O)c(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C13424740_decoy,TRY1,Decoy,0,-9.71437,-7.68,-4.06,-6.514419986510611
O=C1/C(=C\c2cc(O)c(O)c(O)c2)Oc2cc(O)cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c21,C14639621_decoy,TRY1,Decoy,0,-8.2782,-9.49,-1.97,-7.46427196879094
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C15169009_decoy,TRY1,Decoy,0,-8.04777,-7.3,-3.29,-6.229150455915925
O=c1c(O[C@@]2(O)[C@H](CO)O[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15222653_decoy,TRY1,Decoy,0,-9.69136,-9.2,-1.62,-8.83644898017524
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O,C21992201_decoy,TRY1,Decoy,0,-11.1346,-7.94,-1.63,-8.418894722793304
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C31155650_decoy,TRY1,Decoy,0,-9.54406,-8.35,-3.94,-7.562028258856779
O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)[C@H]1O,C31158676_decoy,TRY1,Decoy,0,-9.5499,-6.64,-2.97,-6.305381207507755
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12,C31164737_decoy,TRY1,Decoy,0,-7.59835,-7.08,-4.1,-5.375208245155954
CC(C)=CCc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc2c(c1O)C(=O)[C@H](O)[C@H](c1ccc(O)cc1)O2,C31166810_decoy,TRY1,Decoy,0,-9.08095,-8.79,-3.87,-7.600028873121628
Nc1nc2c(nc(N/N=C/c3ccc(Br)cc3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C33379611_decoy,TRY1,Decoy,0,-8.78402,-9.5,-0.99,-8.76580696878449
O=c1c(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C33831889_decoy,TRY1,Decoy,0,-8.15226,-8.58,-2.03,-8.631567539530684
C[C@@H]1[C@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)O[C@H](c2ccc(O)cc2)[C@@]1(C)O,C35458959_decoy,TRY1,Decoy,0,-6.52193,-7.91,-1.57,-6.3191731565579135
Cc1c2c(c(O)c3c(O)ccc(Cl)c13)C(=O)[C@]1(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@@H]1C2,C33362821_decoy1,TRY1,Decoy,0,-7.36817,-5.7,,-4.107670989983324
CC[C@H](C)[C@@H]1OC(=O)CNC(=O)CNC(=O)[C@@H]([C@@H](C)O)NC(=O)[C@@H](C)[C@@H](O)C[C@@H](O)CC/C=C\[C@H]1C,C37538374_decoy,TRY1,Decoy,0,-7.27981,-4.97,-2.25,-4.4548957679636105
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C14512219_decoy,TRY1,Decoy,0,-10.1761,-9.53,-5.08,-7.58345213107017
COc1c(O)cc2c(c1O)C(=O)O[C@H](C)[C@H](O)c1c(O)c(O)c(OC)c(O)c1C(=O)O[C@@H](C)[C@@H]2O,C31163487_decoy,TRY1,Decoy,0,-8.3377,-9.23,-1.6,-7.650136719240976
C[C@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)[C@@]1(O)COC(=O)C1,C31167118_decoy,TRY1,Decoy,0,-8.44777,-8.41,-3.46,-7.655347798054901
COc1c(O)cc2c(c1O)C(=O)O[C@H](C)[C@H](O)c1c(O)c(O)c(OC)c(O)c1C(=O)O[C@H](C)[C@H]2O,C31163483_decoy,TRY1,Decoy,0,-9.45245,-7.96,-3.5,-7.438144412200273
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1,C03870414_decoy,TRY1,Decoy,0,-11.2263,-9.34,-2.83,-9.011142824028031
N#C/C(=C\c1ccc(/C=C(/C#N)c2nn(CCO)c(N)c2C#N)cc1)c1nn(CCO)c(N)c1C#N,C13124297_decoy,TRY1,Decoy,0,-7.8356,-6.96,-3.6,-5.88519106343804
O=c1c(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C43465435_decoy,TRY1,Decoy,0,-7.91174,-8.58,-1.92,-7.0932959678337015
C[C@H]1O[C@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C43465457_decoy,TRY1,Decoy,0,-7.64242,-9.21,-1.95,-8.180842454036728
O=C(OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]12)c1ccc(O)cc1,C44166803_decoy,TRY1,Decoy,0,-8.33516,-8.66,-2.72,-8.434349181462029
CC(C)CC(CC(C)C)O[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168305_decoy,TRY1,Decoy,0,-5.99648,-5.25,-3.27,-4.569199560317768
O=c1c(O)c(-c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C45108160_decoy,TRY1,Decoy,0,-8.42608,-7.33,-2.51,-6.163159947521154
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@@H]12,C13719195_decoy,TRY1,Decoy,0,-7.91011,-7.56,-1.34,-5.318801277960409
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@@H](O)[C@@H]12,C35947015_decoy,TRY1,Decoy,0,-8.34561,-6.69,-2.46,-5.293789051286922
Cc1c2c(c(O)c3c(O)ccc(Cl)c13)C(=O)[C@]1(O)C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@@H]1C2,C28630644_decoy,TRY1,Decoy,0,-7.16631,-5.36,-4.18,-3.960864073811343
Nc1[nH]c(=S)[nH]c(=O)c1/N=N\c1c(Br)cc(S(N)(=O)=O)cc1Br,C13099280_decoy1,TRY1,Decoy,0,-9.7993,-5.35,,-5.487232291022195
Cc1c2c(c(O)c3c(O)ccc(Cl)c13)C(=O)[C@]1(O)C(=O)C(C(N)=O)=C([O-])[C@H]([NH+](C)C)[C@@H]1C2,C33362821_decoy2,TRY1,Decoy,0,-6.06399,-6.05,,-3.754898778472639
CCCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)cc3)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C05348123_decoy,TRY1,Decoy,0,-8.20519,-6.88,-0.71,-7.279601422356753
NS(=O)(=O)c1ccc(C[NH2+][C@@H]2CC(=O)N(c3cc(Cl)cc(Cl)c3)C2=O)cc1,C06077147_decoy,TRY1,Decoy,0,-9.95728,-5.87,-1.4,-6.209996765204885
NC(=O)c1c(NC(=O)C[NH+]2CCN(c3ccccc3Cl)CC2)sc2c1CCC2,C07433709_decoy,TRY1,Decoy,0,-9.44022,-8.32,-1.5,-6.387475016654885
CC(=O)Nc1ccc2c(c1)Sc1cc(NC(C)=O)ccc1N2CNc1cccc[nH+]1,C08306884_decoy,TRY1,Decoy,0,-7.20301,-7.64,-1.52,-5.779979650730752
CC(C)[NH+]1CCc2c(sc(NC(=O)/C=C/c3ccc([N+](=O)[O-])s3)c2C(N)=O)C1,C08793191_decoy,TRY1,Decoy,0,-8.94468,-4.85,-2.58,-5.360578585766632
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C08970938_decoy,TRY1,Decoy,0,-8.77191,-8.92,-3.87,-9.210102650421744
[NH3+][C@@H](Cc1c[nH]c2ccccc12)c1nnc(SCc2c(Cl)cccc2Cl)o1,C01267706_decoy,TRY1,Decoy,0,-8.08568,-7.63,-2.11,-5.890316103533509
C[NH+]1CCc2c(sc(NC(=O)CCCSc3ccc(Cl)cc3)c2C(N)=O)C1,C09474905_decoy,TRY1,Decoy,0,-8.84495,-6.78,-1.83,-6.595759005223817
C[C@@H]1C[C@@H](C(=O)NCC2([NH+](C)Cc3ccccc3)Cc3ccccc3C2)NC(=S)N1,C12575770_decoy,TRY1,Decoy,0,-7.57197,-8.1,-1.58,-7.943255355463681
CC(C)[NH+]1CCc2c(sc(NC(=O)CSc3ccc(Cl)cc3)c2C(N)=O)C1,C14059304_decoy,TRY1,Decoy,0,-10.3074,-5.84,-3.7,-6.8300625858062425
O=C(Nc1ccc(F)cc1F)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCCCC3)[NH+]2C1,C15708536_decoy,TRY1,Decoy,0,-8.46026,-8.26,-1.73,-6.766229984914815
Cc1cc(Br)c(NC(=O)[C@H]([NH3+])CCS(C)(=O)=O)c(Br)c1,C20504205_decoy,TRY1,Decoy,0,-7.10333,-5.13,-1.94,-4.874443630425987
[NH2+]=c1occ(C(=O)c2cc(Br)ccc2O)cc1C(=O)NC[C@H]1CCCO1,C04489158_decoy,TRY1,Decoy,0,-8.08379,-6.85,-2.63,-6.3275893970923525
Cc1c(C#N)c(NC(=O)C[NH+]2Cc3ccccc3C[C@@H]2C(N)=O)n(C2CCCC2)c1C,C32879149_decoy,TRY1,Decoy,0,-8.94328,-6.06,-1.3,-6.670370870200182
O=c1[nH]cc(NCC[NH+]2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c(=O)[nH]1,C20365241_decoy,TRY1,Decoy,0,-8.11525,-7.06,-1.1,-7.426925271844929
CCOc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4ccccc4F)CC3)n2)cc1,C02359604_decoy,TRY1,Decoy,0,-7.67971,-6.94,-2.05,-6.747546147909441
C[C@H](O)c1cccc(NC(=O)C2=CC3=[NH+][C@H](c4ccco4)C[C@H](C(F)(F)F)N3N2)c1,C00779041_decoy,TRY1,Decoy,0,-8.3422,-7.16,-2.68,-6.2129967890921645
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)C4CCC4)CC34CC[NH2+]CC4)c2c1,C39655928_decoy,TRY1,Decoy,0,-7.97821,-8.06,-1.15,-7.87494788565676
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)C4CCC4)CC34CC[NH2+]CC4)c2c1,C39655930_decoy,TRY1,Decoy,0,-8.82696,-6.81,-1.01,-6.31028053920631
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674104_decoy,TRY1,Decoy,0,-8.94905,-6.85,-2.5,-5.835746654117131
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674105_decoy,TRY1,Decoy,0,-8.47353,-7.95,-1.87,-7.398170027250768
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)CC1,C39684153_decoy,TRY1,Decoy,0,-8.02139,-8.32,-3.09,-6.297684783727816
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1,C39684243_decoy,TRY1,Decoy,0,-8.94449,-5.57,-1.41,-6.0412211236501525
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685774_decoy,TRY1,Decoy,0,-9.39931,-6.2,-0.85,-6.488051173697664
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685775_decoy,TRY1,Decoy,0,-8.13849,-6.66,-2.28,-6.837011616086692
CC[C@@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C39695746_decoy,TRY1,Decoy,0,-8.99144,-5.33,-2.27,-6.293358131981117
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@H]([NH3+])C(C)(C)C,C40464341_decoy,TRY1,Decoy,0,-7.00699,-4.6,-1.52,-4.977061218778069
CNC(=O)NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccccc1C,C44662356_decoy,TRY1,Decoy,0,-8.55303,-8.66,-1.94,-9.026774592723651
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)nn1C,C44695575_decoy,TRY1,Decoy,0,-8.0006,-6.72,-1.79,-6.149147275710128
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)c2c1,C44707866_decoy,TRY1,Decoy,0,-8.47385,-6.62,-1.07,-5.952415708370919
COc1c(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)csc1Cl,C44714086_decoy,TRY1,Decoy,0,-9.19072,-6.05,-1.97,-6.2389010477250855
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44714140_decoy,TRY1,Decoy,0,-8.23488,-7.43,-1.37,-6.130054869243065
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2,C44714224_decoy,TRY1,Decoy,0,-9.8582,-8.43,-2.28,-6.883138326192938
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2,C44714226_decoy,TRY1,Decoy,0,-8.89873,-8.5,-1.55,-6.8581659088766616
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2,C44714230_decoy,TRY1,Decoy,0,-8.0289,-6.98,-1.67,-6.005772227747896
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C44714709_decoy,TRY1,Decoy,0,-8.85893,-7.01,-1.73,-5.769660784891351
CC(C)C(=O)N(C)[C@@H]1C[NH2+][C@H](C(=O)N2CC=C(c3ccccc3)CC2)[C@@H](C(=O)NO)C1,C45254514_decoy,TRY1,Decoy,0,-7.39317,-7.69,-1.38,-5.66675312745058
CN(C(=O)c1ccccc1)[C@H]1C[NH2+][C@H](C(=O)N2CC=C(c3ccccc3)CC2)[C@@H](C(=O)NO)C1,C45258894_decoy,TRY1,Decoy,0,-7.81361,-5.57,-2.81,-6.251553818601031
NS(=O)(=O)c1cccc(C[NH2+]Cc2cc(Br)c(Br)o2)c1,C50360765_decoy,TRY1,Decoy,0,-8.86776,-6.51,-2.07,-7.50514149469041
Nc1cc(Br)cc(Br)c1S(=O)(=O)NCC[NH+]1CCCC1,C54111731_decoy,TRY1,Decoy,0,-7.60847,-6.02,-2.3,-4.966502625964106
C[C@H](O)c1ccc(NC(=O)C2=CNN3C2=[NH+][C@H](c2ccco2)C[C@@H]3C(F)(F)F)cc1,C09780705_decoy,TRY1,Decoy,0,-7.91368,-7.3,-0.8,-6.107235747816836
C[C@H](O)c1ccc(NC(=O)C2=CNN3C2=[NH+][C@@H](c2ccco2)C[C@@H]3C(F)(F)F)cc1,C08662562_decoy,TRY1,Decoy,0,-7.96734,-8.26,-2.65,-6.930771446091004
C[C@@H](O)c1cccc(NC(=O)C2=CC3=[NH+][C@H](c4ccco4)C[C@@H](C(F)(F)F)N3N2)c1,C13452015_decoy,TRY1,Decoy,0,-7.56019,-7.52,-3.45,-5.723280874529791
C[C@H](O)c1cccc(NC(=O)C2=CC3=[NH+][C@H](c4ccco4)C[C@@H](C(F)(F)F)N3N2)c1,C13452020_decoy,TRY1,Decoy,0,-8.44811,-7.77,-2.92,-6.26723344686344
C[C@@H](O)c1ccc(NC(=O)C2=CC3=[NH+][C@@H](c4ccco4)C[C@@H](C(F)(F)F)N3N2)cc1,C13452025_decoy,TRY1,Decoy,0,-8.22365,-6.97,-1.44,-6.8473618610298095
C[C@@H](O)c1ccc(NC(=O)C2=CC3=[NH+][C@H](c4ccco4)C[C@@H](C(F)(F)F)N3N2)cc1,C13452030_decoy,TRY1,Decoy,0,-8.65982,-7.09,-1.03,-6.099251907856065
Cc1ccc(C2=[NH+][C@H](c3c[nH]c4ccc(S(=O)(=O)NC(C)C)cc4c3=O)ON2)cc1,C63440846_decoy,TRY1,Decoy,0,-7.73483,-6.08,-2.44,-5.522992737810784
Cc1ccc(C2=[NH+][C@@H](c3c[nH]c4ccc(S(=O)(=O)NC(C)C)cc4c3=O)ON2)cc1,C63440850_decoy,TRY1,Decoy,0,-8.93762,-7.07,-2.18,-7.818574046488215
NC(=O)N[C@@H](CC(=O)N1CC=C(C2=c3ccccc3=[NH+]C2)CC1)c1ccccc1Cl,C64182123_decoy,TRY1,Decoy,0,-8.38107,-8.75,-1.58,-6.789870497188719
COc1cccc2cc(C(=O)Nc3nccs3)/c(=[NH+]/c3ccc(C(N)=O)cc3)oc12,C67295863_decoy,TRY1,Decoy,0,-8.57263,-6.14,-1.54,-6.503239198399896
C[C@@H](O)[C@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C04084624_decoy,TRY1,Decoy,0,-6.99962,-6.69,-0.55,-5.853823197138691
C[C@H](O)[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C04084625_decoy,TRY1,Decoy,0,-6.63581,-6.79,-2.43,-4.887691302630939
C[C@@H](O)[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C04084627_decoy,TRY1,Decoy,0,-8.22087,-6.56,-0.68,-5.809073796143832
C[NH+]1CCc2c(sc3nc(SCC(=O)Nc4nccs4)nc(N)c23)C1,C02402147_decoy,TRY1,Decoy,0,-8.24875,-7.54,-1.53,-6.227616676330486
CCCCN1C(=O)[C@@H]2[C@@H]([C@@H](C)O)[NH2+][C@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C05350249_decoy,TRY1,Decoy,0,-9.02528,-6.32,-1.16,-5.40620213701545
CCCCN1C(=O)[C@@H]2[C@H]([C@@H](C)O)[NH2+][C@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C05350255_decoy,TRY1,Decoy,0,-8.2103,-6.19,-1.42,-5.568581374745946
C[NH2+]CC(=O)N[C@H]1CCN2C(=O)c3cc(-c4ccsc4)ccc3NC(=O)[C@@H]2C1,C06625967_decoy,TRY1,Decoy,0,-8.6172,-5.98,-2.45,-5.573666138644318
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCN(c2ccccc2Cl)CC1,C08319378_decoy,TRY1,Decoy,0,-7.90147,-6.73,-0.85,-5.473880576963603
Cc1cccc(/N=c2\nc(N)nc(C[NH+]3CCN(c4ccccc4F)CC3)[nH]2)c1,C09111174_decoy,TRY1,Decoy,0,-8.43848,-6.71,-1.04,-4.979156106614701
CC1(C)Cc2c(c(N3CCCC3)[nH+]c3sc(C(=O)NC[C@@H]4CCCO4)c(N)c23)CO1,C09449632_decoy,TRY1,Decoy,0,-9.18308,-5.93,-0.78,-5.548043628392304
C=C(C)C[NH+]1CCN(C(=O)Nc2sc3c(c2C(N)=O)CC(C)(C)OC3)CC1,C09485336_decoy,TRY1,Decoy,0,-7.39388,-5.11,-2.75,-4.962801785294818
C[C@H](O)C[NH2+]Cc1cc2c(-c3cccc(F)c3)nn(-c3ccccc3)c2[nH]c1=O,C12186513_decoy,TRY1,Decoy,0,-7.48217,-8.29,-0.78,-7.621077478070995
C[NH+](C)CCCNC(=O)CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1,C12409175_decoy,TRY1,Decoy,0,-7.81156,-5.82,-0.23,-5.780727021635429
CC[C@@H](O)CNC(=O)c1sc2ncnc(NCC[NH+]3CCCCC3)c2c1C,C14992799_decoy,TRY1,Decoy,0,-8.31187,-5.86,-2.19,-5.184374577487445
CC(=O)Nc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(Cl)ccc2O3)cc1,C19022373_decoy,TRY1,Decoy,0,-9.13318,-8.19,-1.98,-6.221961971908123
CC(=O)Nc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(Cl)ccc2O3)cc1,C19022380_decoy,TRY1,Decoy,0,-9.03299,-6.45,-2.59,-5.664386128695483
CC[NH+](CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(C)cc32)c1C,C21992390_decoy,TRY1,Decoy,0,-7.68338,-5.57,-2.73,-6.3154497790499855
Cc1ccc(NC(=O)NC(=O)[C@@H](C)[NH+]2CCN(c3ccc(O)cc3)CC2)c(C)c1,C22756876_decoy,TRY1,Decoy,0,-7.48964,-7.69,-1.41,-6.287260243088258
C[NH+](Cc1cccc(-c2nc([O-])cc(CC[NH3+])n2)c1)Cc1ccc2c(c1)OCO2,C23398219_decoy,TRY1,Decoy,0,-9.06762,-7.5,-2.92,-7.509431721814717
NS(=O)(=O)c1ccc(C[NH2+]Cc2ccc(I)o2)cc1,C37199372_decoy,TRY1,Decoy,0,-8.46834,-4.56,-3.23,-4.880417594897656
Cc1ccc(C(=O)NCCC(=O)N2CCC3(CC2)[NH2+]CCc2nc[nH]c23)cc1C,C08996931_decoy,TRY1,Decoy,0,-7.99754,-7.76,-2.68,-8.347734003083243
C=CCONC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228407_decoy,TRY1,Decoy,0,-7.84414,-8.25,-0.39,-5.968266409768679
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39683889_decoy,TRY1,Decoy,0,-7.28439,-5.56,-1.54,-5.567888781680798
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39683890_decoy,TRY1,Decoy,0,-7.17221,-6.93,-1.41,-5.474244880738692
C[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@H]1c1cc2ccccc2o1,C39969128_decoy,TRY1,Decoy,0,-7.36095,-6.99,-4.01,-4.340073246979905
C[NH+](CCO)Cc1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40953730_decoy,TRY1,Decoy,0,-8.31699,-7.61,-1.52,-7.110330440395078
CC1(C)C[C@H]([NH2+]C2CCOCC2)[C@]2(CCC(=O)NC3CC3)CC[C@](C)(O)C[C@@H]12,C43548064_decoy,TRY1,Decoy,0,-8.92391,-4.93,-1.72,-5.959715198592378
CNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)NCCOC)[C@H](O)[C@H]1[C@@H]2C,C43548317_decoy,TRY1,Decoy,0,-9.97862,-4.78,-2.15,-6.209554530957551
Cc1cccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44713629_decoy,TRY1,Decoy,0,-7.74013,-7.28,-1.54,-5.3671132037843545
Cc1cccc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44713631_decoy,TRY1,Decoy,0,-8.8103,-6.2,-1.34,-5.806834214728166
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)C1,C46427257_decoy,TRY1,Decoy,0,-6.8695,-7.32,-0.7,-5.524130159376918
C[NH+]1CCC(NS(=O)(=O)c2sccc2Br)(C(N)=S)CC1,C49060917_decoy,TRY1,Decoy,0,-6.89961,-4.57,-3.0,-3.78164124318425
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@H]1C[C@@H]1[NH3+],C50460058_decoy,TRY1,Decoy,0,-7.43997,-4.05,-4.84,-1.925421510862916
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@H]1C[C@H]1[NH3+],C50460062_decoy,TRY1,Decoy,0,-7.98055,-5.49,-2.59,-5.6530347624481845
CCC(=O)N1C[C@H](C(=O)N[C@@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C44737210_decoy,TRY1,Decoy,0,-8.66489,-8.83,-0.64,-7.950962127325475
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55027554_decoy,TRY1,Decoy,0,-7.93672,-5.48,-2.62,-5.934195437130947
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55027558_decoy,TRY1,Decoy,0,-8.19497,-6.24,-2.73,-5.779527681541546
C[NH+](C)[C@@H](CNC(=O)NNC(=O)COc1ccc(F)cc1)c1ccc(F)cc1,C56950053_decoy,TRY1,Decoy,0,-7.88368,-6.36,-1.24,-5.926137627698784
Cc1cccc(C)c1OC[C@@H](O)C[NH+](C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1,C57945367_decoy,TRY1,Decoy,0,-8.38429,-7.31,-3.1,-5.844416530615325
Nc1cc(Cl)cc(S(=O)(=O)NCC[NH+]2CCCCC2)c1Br,C61882385_decoy,TRY1,Decoy,0,-8.53235,-4.51,-1.43,-4.673292878325273
CC(C)c1ccc(NC(=O)C(=O)NCCNC(=O)[C@@H]2C=c3ccccc3=[NH+]2)cc1,C63389376_decoy,TRY1,Decoy,0,-8.62926,-8.17,-1.88,-7.517964929403813
CC(C)c1ccc(NC(=O)C(=O)NCCNC(=O)[C@H]2C=c3ccccc3=[NH+]2)cc1,C63389379_decoy,TRY1,Decoy,0,-8.67907,-8.1,-2.78,-7.234046571374266
C[C@H]1C(C(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)=CNN1c1ccc(Cl)cc1,C64191137_decoy,TRY1,Decoy,0,-9.08765,-6.79,-0.58,-5.35684847158739
CCCNC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O,C64227839_decoy,TRY1,Decoy,0,-7.95195,-7.43,-1.76,-6.194985908553021
N/C(NCC1(c2ccc(Br)cc2)CCOCC1)=[NH+]\Cc1ccco1,C66246674_decoy,TRY1,Decoy,0,-7.86977,-6.63,-1.03,-6.792495365014184
C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2)CCOCC1)C(=O)NC(=O)NC(C)(C)C,C66391891_decoy,TRY1,Decoy,0,-8.18396,-7.28,-1.47,-6.390719167983862
O=C(Cc1ccc(Cl)cc1)NCC(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C20573713_decoy,TRY1,Decoy,0,-9.30356,-5.93,-2.02,-6.241602478952135
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc(-n3cccn3)c(Cl)c2)CC1,C67573413_decoy,TRY1,Decoy,0,-8.28298,-7.32,-3.28,-6.315638501804025
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc(-n3cccn3)c(Cl)c2)CC1,C67573416_decoy,TRY1,Decoy,0,-8.19919,-5.34,-1.56,-6.231527810375131
CC(=O)Nc1ccc(NC(=O)NCC[NH+]2CCc3sccc3C2)c(Cl)c1,C67576161_decoy,TRY1,Decoy,0,-8.71339,-7.52,-3.19,-6.120565357515119
C[NH+]1CCC([NH+]2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)Nc4cccc(F)c4)c(=O)n2C3)CC1,C04260386_decoy,TRY1,Decoy,0,-7.83052,-6.65,-2.3,-6.1800505561936
CC[NH+](CC)CCn1c(=[NH2+])n(C[C@@H](O)c2ccc3c(c2)OCO3)c2ccccc21,C00780170_decoy,TRY1,Decoy,0,-7.47199,-6.89,-1.56,-7.616455677783523
CC1(C)CC([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)=CC(=[N+]2CCCCC2)C1,C03171295_decoy,TRY1,Decoy,0,-8.66982,-6.42,-2.33,-5.83918430569387
COc1cc(OC)c(OC)cc1C[NH+]1CC[C@@H]([NH+]2CCC(O)CC2)[C@H](O)C1,C12701485_decoy,TRY1,Decoy,0,-8.46157,-4.75,-1.79,-5.078413149343897
O=C1C[NH+]([C@@H]2c3ccccc3C3(CC[NH+](Cc4ccoc4)CC3)[C@H]2O)CCN1,C19147622_decoy,TRY1,Decoy,0,-8.04089,-7.87,-1.18,-5.674354337156441
COCCn1cnnc1C[NH+](C)[C@@H]1c2ccccc2C2(CC[NH2+]CC2)[C@H]1O,C19595604_decoy,TRY1,Decoy,0,-7.00898,-5.05,-1.42,-4.729387145579623
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH+]3CCNC(=O)C3)c2)CC1,C20207969_decoy,TRY1,Decoy,0,-8.41267,-6.0,-1.94,-5.86020905717906
C[NH+]1CCC(N2CCC[C@@H](NC(=O)CC3CC(C)(C)[NH2+]C(C)(C)C3)C2)CC1,C20600197_decoy,TRY1,Decoy,0,-9.79853,-6.44,-2.53,-5.881437751345865
C[NH+]1CCC(N2CCC[C@H](NC(=O)CC3CC(C)(C)[NH2+]C(C)(C)C3)C2)CC1,C20600198_decoy,TRY1,Decoy,0,-9.23995,-7.05,-1.39,-5.688021629003613
C[NH+](Cc1ccc2c(c1)OCO2)[C@@H]1c2ccccc2C2(CC[NH2+]CC2)[C@H]1O,C23159495_decoy,TRY1,Decoy,0,-7.86865,-6.86,-1.8,-4.6035347334594885
O[C@H]1[C@H](N2CC[NH+](CCn3ccnc3)CC2)c2ccccc2C12CC[NH2+]CC2,C23478993_decoy,TRY1,Decoy,0,-6.90376,-5.35,-1.38,-4.285900975606515
Cc1cc(N2CC[NH+](Cc3nc(N)c4ccccc4n3)CC2)nc(C(C)C)[nH+]1,C27375091_decoy,TRY1,Decoy,0,-7.31326,-7.63,-1.87,-8.559586784472481
CC[NH+](CC)CC[n+]1cnc2c(c1N)[C@@H](c1ccco1)c1ccc(O)cc1O2,C35392054_decoy,TRY1,Decoy,0,-6.86018,-6.16,-0.87,-5.827270555840736
CC[NH+](CC)CCC[n+]1cnc2c(c1N)[C@H](c1ccco1)c1ccc(O)cc1O2,C35392061_decoy,TRY1,Decoy,0,-7.9404,-5.02,-1.77,-5.471833496010241
CC[NH+](CC)CC[n+]1cnc2c(c1N)[C@H](c1ccc(OC)cc1)c1ccc(O)cc1O2,C35392311_decoy,TRY1,Decoy,0,-8.34252,-4.81,-2.06,-5.121482504998917
C[NH+](C)CCC[n+]1cnc2c(c1N)[C@H](c1ccccc1)c1ccc(O)cc1O2,C35393440_decoy,TRY1,Decoy,0,-7.70362,-5.21,-1.69,-5.0325728388448185
COc1ccc(C)cc1N/C(=[NH+]\c1ccc(C)c(C)c1)[n+]1sc(C)cc1N,C35739946_decoy,TRY1,Decoy,0,-8.51646,-5.96,-1.59,-7.145559266569905
Cc1ccc([C@H]2c3ccc(O)cc3Oc3nc[n+](CCCn4cc[nH+]c4)c(N)c32)cc1,C06660606_decoy,TRY1,Decoy,0,-8.8698,-6.19,-1.8,-6.165294317891277
C[NH+](C)CC[n+]1c(N)n(C[C@H](O)c2ccc(Cl)c(Cl)c2)c2ccccc21,C36047433_decoy,TRY1,Decoy,0,-8.32573,-6.18,-1.28,-9.000232370904433
CCCCCCC(=O)N1C[C@@H](C(=O)NCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39626331_decoy,TRY1,Decoy,0,-9.0693,-6.0,-1.19,-6.690076220980708
COCCC(=O)N1C[C@H](C(=O)NCC[NH+]2CCCCC2)C2(CC[NH2+]CC2)C1,C39628258_decoy,TRY1,Decoy,0,-8.37302,-5.47,-3.91,-5.399298586099247
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCCn2cc[nH+]c2)C2(CC[NH2+]CC2)C1,C39629905_decoy,TRY1,Decoy,0,-8.41081,-7.35,-1.52,-7.777755671287897
O=C(NCCCn1cc[nH+]c1)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39630383_decoy,TRY1,Decoy,0,-9.79634,-5.49,-0.87,-6.55010930944389
COCCC(=O)N1C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39631102_decoy,TRY1,Decoy,0,-8.87046,-6.03,-0.82,-6.221406453968727
Cc1ccsc1C(=O)N1C[C@H](C(=O)N[C@@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663333_decoy,TRY1,Decoy,0,-8.60073,-7.23,-1.4,-6.603633812126387
COCCC(=O)N1C[C@@H](C(=O)N[C@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663364_decoy,TRY1,Decoy,0,-8.56783,-5.53,-3.29,-5.976722536259267
O=C(N[C@@H]1C[NH+]2CCC1CC2)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39663365_decoy,TRY1,Decoy,0,-8.43897,-8.04,-0.76,-6.640694840281719
O=C(N[C@H]1C[NH+]2CCC1CC2)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39663367_decoy,TRY1,Decoy,0,-8.79101,-8.01,-1.39,-7.257499495394499
CCC(=O)N1C[C@H](C(=O)NCc2cn3c(C)cccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670710_decoy,TRY1,Decoy,0,-6.94421,-6.59,-1.08,-4.9449319419372735
CCC(=O)N1C[C@@H](C(=O)NCc2cn3c(C)cccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670711_decoy,TRY1,Decoy,0,-8.17648,-7.4,-1.31,-6.100254377625438
CC[C@H](C)C(=O)N1C[C@H](C(=O)N[C@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39681938_decoy,TRY1,Decoy,0,-7.82558,-5.22,-1.47,-5.497743902016393
Cn1cc[nH+]c1CNC(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39688862_decoy,TRY1,Decoy,0,-7.49523,-5.11,-2.15,-5.186830304832729
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NC[C@@H]2CCC[NH+]2CC)C2(CC[NH2+]CC2)C1,C39695441_decoy,TRY1,Decoy,0,-8.25895,-5.91,-1.41,-6.011643138553224
O[C@H](CN1CCN(C[C@H](O)C[NH+]2CCCCC2)CC1)C[NH+]1CCCCC1,C39987118_decoy,TRY1,Decoy,0,-8.91656,-6.49,-1.45,-6.821617630715537
CSCC[C@H]([NH3+])c1nc(C(=O)N2CCC([NH+]3CCCCC3)CC2)co1,C33905008_decoy,TRY1,Decoy,0,-10.1422,-6.02,-1.98,-6.073123005980007
CC(C)NC(=O)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCc2ccccc2C1,C43527019_decoy,TRY1,Decoy,0,-7.71426,-7.56,-1.94,-5.736395094862283
CC1CC[NH+](Cc2ccccc2CNC(=O)N[C@@H](C)Cn2cc[nH+]c2)CC1,C48808744_decoy,TRY1,Decoy,0,-7.6946,-7.2,-2.87,-6.579368994022224
Cc1cc(-c2c(F)cc3c4nn(C5CCC([NH3+])CC5)c(O)c4c[n+](C4CC4)c3c2F)cc(C)n1,C49823151_decoy,TRY1,Decoy,0,-10.5024,-9.71,-1.51,-9.848215430831477
CCC[NH+]1CCC(N2C[C@H]([NH2+]C3CCCCCC3)C[C@H]2C(=O)NC)CC1,C20600392_decoy,TRY1,Decoy,0,-8.36506,-5.43,-1.62,-5.430825081585955
Cc1[nH+]ccn1CCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1,C32581030_decoy,TRY1,Decoy,0,-8.37063,-6.85,-1.45,-6.589651332814779
Cc1c(C[NH+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](O)C2)[nH]c2ccc(Cl)cc12,C23374985_decoy,TRY1,Decoy,0,-9.08521,-6.83,-1.87,-5.999643008036021
COc1ccc(N2CC(=O)C([C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)c(OC)c1,C63515060_decoy,TRY1,Decoy,0,-7.0461,-7.19,-1.45,-8.573401032390636
Cc1ccc2c(c1)=[NH+][C@@H](C1=C(N)N(c3ccc(N4CCCCC4)cc3)CC1=O)[NH+]=2,C63515085_decoy,TRY1,Decoy,0,-7.10402,-6.0,-1.84,-4.624433376833065
CCN(CC)C(=O)CS[C@H]1N=N[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C64428597_decoy,TRY1,Decoy,0,-8.48046,-7.18,-1.62,-7.821484162787597
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NCCC(=O)N1CC[NH+](C)CC1,C66699346_decoy,TRY1,Decoy,0,-8.29804,-5.76,-1.39,-5.642324063444252
Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122399_decoy,TRY1,Decoy,0,-7.39951,-7.22,-2.49,-5.166969315094072
Cc1nc(COc2ccc(C[NH2+]C[C@H](O)C[NH+]3CCC(C)CC3)cc2)cs1,C67122400_decoy,TRY1,Decoy,0,-9.15916,-6.04,-3.09,-5.603432977558921
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)CC1,C67122424_decoy,TRY1,Decoy,0,-9.28224,-6.77,-1.45,-5.950462164512058
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NC[C@H](c3ccco3)[NH+](C)C)c2C1,C67491394_decoy,TRY1,Decoy,0,-8.11862,-7.92,-3.41,-7.762416801083762
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCCn3cc[nH+]c3C)c2C1,C67529813_decoy,TRY1,Decoy,0,-7.73632,-6.3,-1.78,-6.340922433073592
COc1ccccc1CN1C(=O)[C@@H]2[C@H]([C@H](C)O)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C08789567_decoy,TRY1,Decoy,0,-7.34805,-6.02,-1.4,-4.968928388138772
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1,C09580637_decoy,TRY1,Decoy,0,-7.32181,-9.82,-0.01,-6.46927376526915
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1,C09580639_decoy,TRY1,Decoy,0,-8.6722,-6.91,-0.89,-5.7738562085406775
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1,C09580645_decoy,TRY1,Decoy,0,-9.6015,-7.75,-1.13,-6.113268955563161
O=C(Nc1ccsc1)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCOCC3)[NH+]2C1,C15708244_decoy,TRY1,Decoy,0,-7.62129,-5.61,-1.3,-4.894016308212835
[N-]=[N+]=[NH+][C@H](CI)c1cn([C@H]2C[C@H](O)[C@H](CO)O2)c(=O)[nH]c1=O,C05840975_decoy,TRY1,Decoy,0,-7.58716,-4.7,-3.25,-4.65506710862791
[N-]=[N+]=[NH+][C@H](CI)c1cn([C@@H]2C[C@H](O)[C@H](CO)O2)c(=O)[nH]c1=O,C05840967_decoy,TRY1,Decoy,0,-6.24018,-4.89,-0.94,-4.530063548695248
C[C@H](C(=O)NC(N)=O)[NH+]1CCN(S(=O)(=O)c2ccc(Br)s2)CC1,C31581362_decoy,TRY1,Decoy,0,-8.05445,-6.0,-1.23,-5.493285531352941
NC(=O)c1c(NC(=O)CN2CC[NH+]([C@@H]3CCS(=O)(=O)C3)CC2)sc2c1CCC2,C22804414_decoy,TRY1,Decoy,0,-10.1791,-6.16,-1.22,-7.119923581579784
CCn1c(NNC2=c3cc(Br)ccc3=[NH+]C2=O)nc2c1c(=O)[nH]c(=O)n2C,C05295915_decoy,TRY1,Decoy,0,-7.65464,-7.91,-2.42,-7.160633664156173
C[NH+](C)CCN1c2nc(C#N)c(C#N)nc2[C@@H](c2nc([O-])c3cc(Br)ccc3n2)[C@@H]1[NH3+],C38827322_decoy,TRY1,Decoy,0,-9.86703,-5.17,-2.24,-5.911204927807674
O=C1N=[NH+][C@H](C(=O)NNC(=O)c2c[nH]c(=S)n2-c2ccc(F)cc2)c2ccccc21,C39446732_decoy,TRY1,Decoy,0,-8.55351,-5.97,-2.4,-5.480105468755434
O=C(N[C@H]1N/C(=C\C(=O)N2CCN(c3cccc[nH+]3)CC2)CS1)c1ccc[nH]c1=O,C39590293_decoy1,TRY1,Decoy,0,-9.07877,-6.74,,-5.417311676365241
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39631917_decoy,TRY1,Decoy,0,-8.99068,-5.77,-4.81,-6.37516292645402
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39632137_decoy,TRY1,Decoy,0,-8.91799,-5.66,-1.42,-6.010027846177259
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39632144_decoy,TRY1,Decoy,0,-9.094,-5.75,-1.24,-6.008568805735365
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)N[C@H](C)C3=C(C)N=N[C@@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674576_decoy,TRY1,Decoy,0,-8.13578,-6.22,-2.6,-5.622360429912219
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)N[C@H](C)C3=C(C)N=N[C@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674577_decoy,TRY1,Decoy,0,-6.40497,-5.54,-2.73,-5.1596021574139845
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)N[C@@H](C)C3=C(C)N=N[C@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674579_decoy,TRY1,Decoy,0,-7.39051,-6.36,-1.09,-5.87295082960843
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39683787_decoy,TRY1,Decoy,0,-8.47052,-5.62,-1.58,-5.747635280932705
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C39683845_decoy,TRY1,Decoy,0,-9.3876,-5.23,-1.03,-6.528177743675171
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39683911_decoy,TRY1,Decoy,0,-8.87329,-5.31,-1.73,-5.66566592349301
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2F)CC12CC[NH2+]CC2,C39683913_decoy,TRY1,Decoy,0,-8.83257,-5.38,-2.51,-5.500582232861281
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2csc(Cl)c2OC)CC12CC[NH2+]CC2,C39683959_decoy,TRY1,Decoy,0,-8.95495,-5.92,0.21,-7.132638915717145
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39683985_decoy,TRY1,Decoy,0,-7.35079,-6.82,-1.52,-5.728504632117459
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39684039_decoy,TRY1,Decoy,0,-9.06292,-5.45,-1.51,-5.801662757445824
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cncn4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695861_decoy,TRY1,Decoy,0,-8.72096,-5.95,-1.17,-5.26030211851988
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cncn4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695862_decoy,TRY1,Decoy,0,-8.60082,-8.67,-1.48,-6.991574158745461
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4cncn4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695863_decoy,TRY1,Decoy,0,-8.72972,-7.22,-1.29,-6.393721307097493
CCN1C(=O)[C@@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@H](O)c2ccccc21,C39159896_decoy,TRY1,Decoy,0,-8.36131,-7.3,-0.97,-8.101864230086237
CCN1C(=O)[C@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@@H](O)c2ccccc21,C39159897_decoy,TRY1,Decoy,0,-8.62349,-7.93,-1.75,-7.963958519966503
CCN1C(=O)[C@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@H](O)c2ccccc21,C39159898_decoy,TRY1,Decoy,0,-7.80267,-8.54,-1.72,-10.150492735189008
CNC(=O)c1c(NC(=O)c2cc3c(=O)n4ccccc4nc3[n+](C3CCCC3)c2N)sc2c1CCCC2,C39840981_decoy,TRY1,Decoy,0,-8.93674,-7.62,-1.02,-8.563560454468721
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C44713621_decoy,TRY1,Decoy,0,-7.31445,-6.11,-1.18,-5.522212323442392
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C44713665_decoy,TRY1,Decoy,0,-6.91508,-5.79,-0.91,-5.288871705356175
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C44713667_decoy,TRY1,Decoy,0,-8.59807,-7.88,-0.86,-6.359644077057977
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C44713701_decoy,TRY1,Decoy,0,-8.40274,-5.4,-2.73,-5.548953750688506
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C44713703_decoy,TRY1,Decoy,0,-9.00482,-7.41,-0.76,-6.213852425392196
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cccnc2Cl)CC12CC[NH2+]CC2,C44713756_decoy,TRY1,Decoy,0,-8.38692,-7.19,-0.82,-6.007996145873056
CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)CC1,C44713929_decoy,TRY1,Decoy,0,-9.20097,-5.2,-2.15,-4.912213436598882
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714276_decoy,TRY1,Decoy,0,-7.99509,-5.51,-2.02,-5.2023830590010105
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714278_decoy,TRY1,Decoy,0,-6.8846,-5.0,-1.8,-4.187122626455126
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C44714343_decoy,TRY1,Decoy,0,-8.80502,-5.46,-2.61,-5.903874273445177
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C44714347_decoy,TRY1,Decoy,0,-8.28403,-5.96,-1.31,-5.436612205023456
Cc1cc(C(=O)N2C[C@@H](C(=O)NCc3nc4ccccc4c(=O)[nH]3)C3(CC[NH2+]CC3)C2)nn1C,C44714701_decoy,TRY1,Decoy,0,-8.79424,-8.44,-1.71,-6.167952038817342
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/NCCN1CC[NH2+]CC1,C19362684_decoy,TRY1,Decoy,0,-8.8631,-6.29,-1.97,-5.642242269204532
CCN1C(=O)[C@H]2[C@@H](C1=O)[C@](CC1=c3ccccc3=[NH+]C1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C63205541_decoy,TRY1,Decoy,0,-5.9198,-5.58,-1.93,-3.939424626400206
CCN1C(=O)[C@H]2[C@@H](c3ccccc3O)[NH2+][C@@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]2C1=O,C63205542_decoy,TRY1,Decoy,0,-9.01638,-6.74,-2.5,-6.621935013006252
O=C(N[C@H]1N/C(=C/C(=O)N2CCN(c3cccc[nH+]3)CC2)CS1)c1ccc[nH]c1=O,C39590293_decoy2,TRY1,Decoy,0,-8.92609,-5.84,,-5.692730952947035
O=C1CC=C(C(=O)N[C@H]2N/C(=C\C(=O)NCCC3=c4ccccc4=[NH+]C3)CS2)C=N1,C64661371_decoy,TRY1,Decoy,0,-9.165,-8.52,-1.37,-6.834336403540953
Cc1ccc([C@H](Nc2cccc[nH+]2)c2ccc3ccc(C)nc3c2O)cc1,C01169080_decoy,TRY1,Decoy,0,-9.04909,-7.89,-1.99,-7.9194891086314625
CCOc1cccc([C@@H]2CC(c3ccc(C)cc3)=N[C@H](C(C)C)[NH2+]2)c1O,C04729261_decoy,TRY1,Decoy,0,-8.14387,-6.25,-1.81,-5.570354387010214
CC[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=O)Nc1ccc(Br)cc1,C08300475_decoy,TRY1,Decoy,0,-8.71466,-5.29,-1.82,-5.404063418090341
COc1ccc(CC[NH3+])c(OCCOc2cc(Cl)ccc2Cl)c1,C11823151_decoy,TRY1,Decoy,0,-9.57133,-5.03,-1.44,-5.485460067599764
COc1cccc(C[NH3+])c1OCCOc1cc(C)ccc1C(C)(C)C,C11864622_decoy,TRY1,Decoy,0,-7.44645,-4.98,-2.05,-7.262148118941098
COc1ccc(CC[NH3+])c(OCCOc2cc(C)c(Cl)c(C)c2)c1,C11889509_decoy,TRY1,Decoy,0,-9.54242,-5.26,-1.4,-8.195272510047962
COc1ccc(C[NH3+])c(OCCOc2c(C)cccc2C(C)(C)C)c1,C11957267_decoy,TRY1,Decoy,0,-5.70942,-5.45,-1.97,-4.472296569105253
COc1cccc(CC[NH3+])c1OCCOc1ccc(Cl)cc1Cl,C11994152_decoy,TRY1,Decoy,0,-8.50566,-3.74,-1.83,-5.2649977515949455
COc1cc(C[NH2+]Cc2cc(C)cc3c(C)c(C)[nH]c23)cc(OC)c1,C12074266_decoy,TRY1,Decoy,0,-7.17237,-6.02,-1.01,-4.956133299505796
CC(=O)NC1(c2ccccc2F)CC[NH+](Cc2c(C)[nH]c3c(C)cccc23)CC1,C12344569_decoy,TRY1,Decoy,0,-7.19267,-7.29,-2.46,-5.336753394089224
Cc1c([C@@H](C)[NH2+]Cc2cc3ccccc3[nH]2)cnn1-c1cccc(F)c1,C12597000_decoy,TRY1,Decoy,0,-7.10874,-8.1,-3.52,-5.6972796764349525
c1cc2c(cc1C[NH2+]Cc1ccc3[nH]c4c(c3c1)CCCC4)OCCO2,C12717340_decoy,TRY1,Decoy,0,-8.18927,-7.46,0.22,-5.470298191542488
CC1=C(CCN[C@@H]2C[C@@H](C(=O)NC(C)C)[NH+](C(C)C)C2)C(C)(C)CCC1,C19229444_decoy,TRY1,Decoy,0,-7.76787,-6.58,-1.26,-5.399276469091408
c1ccc2c(c1)CC([NH2+]C1CCN(c3ccc(-c4ccn[nH]4)cc3)CC1)C2,C19595404_decoy,TRY1,Decoy,0,-7.90872,-6.03,-2.2,-5.031897713959306
CC(C)(C)c1cc(C[NH+]2CCN(CCO)CC2)c(O)c(C(C)(C)C)c1,C22916882_decoy,TRY1,Decoy,0,-7.57312,-5.61,-2.2,-5.386141333325971
O=C(NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1)c1ccccc1O,C31896250_decoy,TRY1,Decoy,0,-6.74286,-6.69,-0.96,-5.570396620660325
Cc1cc(C)n2c(NC(C)(C)CC(C)(C)C)c(-c3ccc[nH]3)[nH+]c2c1,C35172382_decoy,TRY1,Decoy,0,-7.23278,-6.13,-0.86,-4.701225988834472
CC[NH2+][C@H](c1cccc(I)c1)c1ccc2[nH]c(=O)oc2c1,C35556567_decoy,TRY1,Decoy,0,-7.40236,-6.18,-0.05,-5.5310703657688585
CC[NH2+][C@H](c1cccc(Br)c1)c1ccc2[nH]c(=O)oc2c1,C35556611_decoy,TRY1,Decoy,0,-7.55654,-6.23,-1.12,-5.045963476086746
CCOc1c(Cl)cc(C[NH2+]C23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)cc1OC,C18158709_decoy,TRY1,Decoy,0,-8.91899,-6.43,-2.11,-5.774158305597495
CC(C)CC[NH2+]Cc1nc2scc(-c3cccc(Cl)c3)c2c(=O)[nH]1,C36154395_decoy,TRY1,Decoy,0,-8.66548,-5.3,-1.07,-6.09919477752149
CCc1ccc([C@@H]2c3cccn3CCC[NH+]2Cc2ccc(O)cc2O)cc1,C36348103_decoy,TRY1,Decoy,0,-8.33887,-7.52,-0.87,-7.29298812301506
Cn1[nH+]c(CCc2ccco2)c(-c2ccc(Br)cc2)c1N,C36937691_decoy,TRY1,Decoy,0,-8.13451,-6.21,-0.75,-5.147652936135944
CC[C@@H](Nc1ccc[nH+]c1N(C)C)c1cc(Br)ccc1O,C37028940_decoy,TRY1,Decoy,0,-6.50128,-5.78,-1.67,-6.496393811969944
Cc1ccc([C@H](Nc2cccc[nH+]2)c2ccc3cccnc3c2O)cc1,C00086493_decoy,TRY1,Decoy,0,-8.04943,-7.9,-0.49,-7.327285835830484
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C05065470_decoy,TRY1,Decoy,0,-7.67528,-5.37,-2.19,-4.814143508926443
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C05065471_decoy,TRY1,Decoy,0,-7.87706,-7.52,-2.41,-5.654725871796713
CC(C)C(=O)NCC[NH2+][C@H](C)c1cc2cc(Br)ccc2o1,C21517100_decoy,TRY1,Decoy,0,-8.23642,-5.73,-1.01,-5.2696273407426615
CC(C)(C)[C@@H]([NH2+]CCC(=O)Nc1sccc1C#N)c1cccs1,C40155751_decoy,TRY1,Decoy,0,-9.51744,-5.27,-2.07,-7.053845611717955
Cc1nn(-c2ccccc2)c(Oc2ccc(Br)cc2)c1C[NH3+],C40449516_decoy,TRY1,Decoy,0,-7.59589,-6.17,-2.45,-7.568047150608667
CC(C)[C@@](C)(C#N)NC(=O)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl,C42979246_decoy,TRY1,Decoy,0,-7.61631,-6.51,-3.93,-5.666507346220116
Cc1cccc(NC(=O)NCC2([NH+]3CCSCC3)CCCC2)c1C,C43135886_decoy,TRY1,Decoy,0,-9.72997,-5.79,-3.1,-5.944766171657367
C=C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=O)Nc1ccc(Br)cc1,C43526312_decoy,TRY1,Decoy,0,-8.71951,-5.93,-1.23,-6.15624144170911
CC[NH+](CC)Cc1ccccc1NC(=O)N[C@H](C)c1ccc(C)s1,C54433842_decoy,TRY1,Decoy,0,-8.5502,-4.64,-1.24,-5.304117817217288
Cc1sc2nc([C@@H](C)[NH2+][C@H](C)c3ccccc3Cl)[nH]c(=O)c2c1C,C57421394_decoy,TRY1,Decoy,0,-7.22699,-6.94,-1.98,-5.071011278567052
CCOc1cccc2cc(C(N)=S)/c(=[NH+]/c3ccc(C)cc3)oc12,C59170761_decoy,TRY1,Decoy,0,-7.91058,-4.66,-1.79,-5.092109530762054
CCc1cccc(CC)c1NC(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C,C48052990_decoy,TRY1,Decoy,0,-8.29041,-5.81,-2.51,-5.673485916437961
C[C@H](Cc1c(F)cccc1F)NC(=O)NC[C@H](c1cccs1)[NH+](C)C,C59852538_decoy,TRY1,Decoy,0,-8.53023,-4.59,-1.55,-5.027424267977955
Cc1ccc(Br)cc1NC(=O)NC1CC[NH+](CC(F)F)CC1,C61771906_decoy,TRY1,Decoy,0,-6.9749,-6.55,-1.54,-5.133357892193456
CCC[NH2+][C@H](c1cn[nH]c1)c1cc(Cl)cc(Br)c1OC,C62776771_decoy,TRY1,Decoy,0,-6.65098,-6.26,-1.33,-6.849032344388708
CC(C)([NH2+]Cc1cc2c(cc1O)OCO2)c1ccc(Br)cc1,C63256033_decoy,TRY1,Decoy,0,-7.67984,-7.08,-2.81,-5.362756131847544
COc1ccccc1NC(=S)NCc1ccc2c(c1)=C1CCCC[C@H]1[NH+]=2,C63486082_decoy,TRY1,Decoy,0,-8.1756,-6.33,-1.23,-5.506341554120777
Cc1ccccc1NC(=S)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccco1,C13471194_decoy,TRY1,Decoy,0,-6.9098,-7.3,-0.94,-4.8643490209221705
C[NH+](C)C1(CNC(=O)c2c[nH]cc2-c2ccc(Cl)s2)CCCC1,C65515076_decoy,TRY1,Decoy,0,-7.76003,-5.27,-2.34,-4.8093028552170605
COc1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H](O)COc1ccccc1,C65889975_decoy,TRY1,Decoy,0,-8.63101,-5.13,-2.36,-5.525094153310861
OCC1CCN(c2ccc(C[NH2+]Cc3cc4ccccc4o3)cc2)CC1,C67247423_decoy,TRY1,Decoy,0,-7.01319,-5.76,-2.04,-5.044751960946099
C[NH+](C)[C@@H](CNC(=O)c1[nH]c2ccccc2c1Cl)c1cccs1,C67286072_decoy,TRY1,Decoy,0,-7.56011,-6.09,-2.19,-5.39229615813832
O[C@@H](c1ccc(Cl)cc1)C1CC[NH+](Cc2nc3c(F)cccc3[nH]2)CC1,C67401037_decoy,TRY1,Decoy,0,-7.86834,-7.86,-1.55,-5.3528462910687855
CC(C)[NH+](C)CCCCNC(=O)NC(C)(C)c1ccc(Cl)cc1,C67410155_decoy,TRY1,Decoy,0,-7.91872,-5.98,-4.42,-5.963973691633857
Cc1ccc2nc(C[NH2+]C[C@@]3(c4ccc(F)cc4)CCOC3)[nH]c2c1C,C67490514_decoy,TRY1,Decoy,0,-7.44328,-6.48,-1.27,-5.919013064581973
CCN(CC)C(=O)COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1OC,C01026232_decoy,TRY1,Decoy,0,-7.91429,-8.4,-2.12,-7.931368321764837
O=C(/C=C/c1ccc(S(=O)(=O)N2CCOCC2)cc1)NC(=S)NCc1ccc2c(c1)OCO2,C03304834_decoy,TRY1,Decoy,0,-9.11849,-8.9,-2.48,-8.151772691445121
CCCNC(=O)NC(=O)COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccccc1F,C03366623_decoy,TRY1,Decoy,0,-8.56332,-8.56,-2.26,-7.32461708711132
O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1ccccc1[N+](=O)[O-],C08820466_decoy,TRY1,Decoy,0,-8.44114,-6.03,-2.42,-6.142865106280804
COc1cc(NC(=O)NCCS(=O)(=O)c2c(C)n(C)c3ccccc23)cc(OC)c1OC,C08808485_decoy,TRY1,Decoy,0,-8.19463,-7.16,-1.99,-6.072776738156283
CC(=O)Nc1ccc(S(=O)(=O)NC[C@@H](c2ccc3c(c2)OCO3)S(=O)(=O)c2cccs2)cc1,C08969530_decoy,TRY1,Decoy,0,-9.00438,-8.2,-2.78,-8.470549641024713
CC(C)c1ccc(S(=O)(=O)[C@H](CNS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c2cccnc2)cc1,C09007386_decoy,TRY1,Decoy,0,-10.284,-8.94,-3.0,-9.600229335603029
Cc1sc(NC(=O)CSc2nnc(CNC(=O)c3ccco3)n2C)nc1-c1ccccc1,C09305379_decoy,TRY1,Decoy,0,-8.90124,-8.33,-1.89,-7.287699313608601
Cc1ccc(N2C[C@H](C(=O)Nc3nnc(SCC(=O)NCc4ccco4)s3)CC2=O)cc1C,C09517972_decoy,TRY1,Decoy,0,-9.69174,-8.18,-4.79,-6.800803015693196
O=C(CNc1cccc(F)c1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1,C09609293_decoy,TRY1,Decoy,0,-7.72712,-8.21,-2.54,-6.553731187740147
COc1ccc(NC(=O)Cc2csc(NC(=O)[C@@H]3CC(=O)N(c4ccc(OC)cc4)C3)n2)cc1,C09700471_decoy,TRY1,Decoy,0,-10.7667,-7.82,-3.32,-7.829785848390974
Cc1ccc(NC(=O)[C@@H](C)Sc2nnc(NC3CC3)s2)cc1S(=O)(=O)N1CCOCC1,C09813533_decoy,TRY1,Decoy,0,-9.52052,-5.29,-3.77,-5.851159626480774
Cc1cc(C(=O)COC(=O)/C=C/c2ccc3c(c2)OCCO3)c(C)n1-c1ccc(S(N)(=O)=O)cc1,C09558548_decoy,TRY1,Decoy,0,-10.6469,-7.97,-3.64,-7.490046509824614
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)CSc3nc(C)cc(C(F)(F)F)c3C#N)C2=O)cc1,C10686460_decoy,TRY1,Decoy,0,-7.32028,-8.16,-2.51,-6.093149309786748
Cc1ccc(/C=C2/SC(=S)N(CCC(=O)NNC(=O)c3ccccc3[N+](=O)[O-])C2=O)cc1,C01836225_decoy,TRY1,Decoy,0,-7.51822,-7.33,-2.46,-6.925212339544774
Cc1cc(C)n(CCNC(=O)c2cn(C[C@H]3CCCO3)cc(C(=O)NC3CCCCCCC3)c2=O)n1,C12325245_decoy,TRY1,Decoy,0,-9.92394,-5.81,-4.52,-6.624754572358089
O=c1[nH]c2cc3c(cc2cc1CN(Cc1ccc2c(c1)OCO2)C(=S)NC[C@H]1CCCO1)OCO3,C06445984_decoy,TRY1,Decoy,0,-9.045,-7.78,-3.0,-6.315885119099857
O=C(CNS(=O)(=O)c1ccccc1F)OCC(=O)N1c2ccccc2NC(=O)C12CCCC2,C14123678_decoy,TRY1,Decoy,0,-5.1489,-8.34,-3.4,-6.624140855199634
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O,C14128601_decoy,TRY1,Decoy,0,-8.64532,-8.24,-2.34,-7.06562451598467
C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)O[C@H](C)C(=O)N1c2ccccc2NC(=O)C1(C)C,C14242119_decoy,TRY1,Decoy,0,-5.29623,-8.35,-2.85,-5.657036903196276
COc1ccc(N2C(=O)CC[C@H](C(=O)NNC(=O)c3cc(C)oc3C)[C@H]2c2ccccc2OC)cc1,C15317677_decoy,TRY1,Decoy,0,-7.05751,-5.57,-2.15,-6.331953784577406
O=[N+]([O-])c1cc(NC(=S)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)ccc1Cl,C15348187_decoy,TRY1,Decoy,0,-8.41159,-6.97,-3.05,-5.642439076567903
CCOc1ccc(/C=C2\SC(=O)N(CCNC(=O)c3cc(O)nc4ccccc34)C2=O)cc1OC,C16596546_decoy,TRY1,Decoy,0,-9.14289,-7.92,-2.46,-6.55607072967099
CCCN(Cc1nnc(-c2cccs2)o1)C(=O)CSc1nnc(-c2cccs2)n1N,C18526762_decoy,TRY1,Decoy,0,-10.3369,-7.17,-4.27,-7.940002083544052
Cn1cccc1[C@@H](CNC(=O)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)N1CCc2ccccc2C1,C21155638_decoy,TRY1,Decoy,0,-8.17508,-9.25,-3.69,-6.828399768805534
C[C@H](CSc1ccc(Cl)cc1)Cn1c(N2CCN(CCO)CC2)nc2c1c(=O)[nH]c(=O)n2C,C21727836_decoy,TRY1,Decoy,0,-9.82237,-6.71,-2.82,-7.468679582392932
COCCNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1C[C@@H]1CCCO1)CC[C@H](C)C3,C22096958_decoy,TRY1,Decoy,0,-9.07793,-7.33,-2.97,-6.629321430013562
COCCNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1C[C@H]1CCCO1)CC[C@H](C)C3,C22096962_decoy,TRY1,Decoy,0,-9.18932,-6.6,-2.23,-6.6115904301554345
CC(=O)N[C@H](CC(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1,C23036827_decoy,TRY1,Decoy,0,-9.25822,-7.8,-2.91,-9.719819518588556
CCc1c(C)sc2nc(SCC(=O)NNC(=O)c3ccco3)n(C[C@H]3CCCO3)c(=O)c12,C23482580_decoy,TRY1,Decoy,0,-8.94871,-6.98,-1.58,-6.236186268098549
NS(=O)(=O)c1ccc(OCCSc2nnc(N3CCOCC3)n2-c2cccc(F)c2)cc1,C24172657_decoy,TRY1,Decoy,0,-10.818,-7.61,-1.81,-7.622667741697704
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(-c3ccco3)sc2C)c1,C29435914_decoy,TRY1,Decoy,0,-8.31637,-6.16,-2.74,-5.306518929007551
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)cc1,C32039008_decoy,TRY1,Decoy,0,-9.27504,-6.38,-2.39,-7.054807399852774
C[C@H](Cc1ccco1)NC(=O)CC1CCN(C(=O)c2nnc(C(=O)Nc3cccc(Cl)c3)s2)CC1,C33024905_decoy,TRY1,Decoy,0,-9.9745,-6.69,-3.67,-6.649195185183784
CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)O[C@H](C)C(=O)Nc1c(C)n(C)n(-c4ccccc4)c1=O)(C3)C2,C20975708_decoy,TRY1,Decoy,0,-8.266,-9.08,-1.55,-9.8533388188539
C[C@@H](NC(=O)c1ccco1)C(=O)OCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1,C39223561_decoy,TRY1,Decoy,0,-7.22012,-8.52,-1.78,-7.571573267079814
CC(C)C[C@@H](C(=O)Nc1cccc(NC(=O)[C@H](C)n2cccn2)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O,C36759799_decoy,TRY1,Decoy,0,-8.70126,-7.64,-1.85,-5.893577642988101
CCn1c(S[C@H](C)C(=O)/N=C2/NCCS2)nnc1[C@@H](C)NC(=O)Cc1ccc(OC)cc1,C39758483_decoy,TRY1,Decoy,0,-9.57547,-7.95,-1.88,-10.567917860206393
CC(C)c1nnc(NC(=O)CSc2nnc(CC(=O)Nc3ccccc3Cl)n2C)s1,C39761671_decoy,TRY1,Decoy,0,-9.18998,-8.91,-2.85,-8.077045132962255
CCc1nnc(NC(=O)[C@H](C)Sc2nnc(CC(=O)Nc3cccc(Cl)c3)n2C)s1,C39767413_decoy,TRY1,Decoy,0,-10.0877,-8.48,-2.68,-8.81885245031816
Cc1c(C(N)=O)cc(C(=O)CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)n1Cc1cccs1,C43254558_decoy,TRY1,Decoy,0,-9.69642,-8.17,-1.72,-7.487052487399654
Cc1nc(-c2ccccc2)sc1-c1ccc(=O)n(CCNS(=O)(=O)c2c(C)n[nH]c2C)n1,C49469786_decoy,TRY1,Decoy,0,-9.69977,-7.89,-2.32,-6.756283545325551
CCN1C(=O)[C@@]2(C(C(=O)OCCOC)=C(C)OC(N)=C2C(=O)OC)c2cc(Br)ccc21,C59293435_decoy,TRY1,Decoy,0,-6.68189,-4.73,-2.44,-5.486964066645854
CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc(COc4ccccc4C#N)o3)n2)o1,C59368030_decoy,TRY1,Decoy,0,-8.74011,-6.57,-3.54,-5.987054794323551
COc1cc(C(=O)N[C@@]2(C(F)(F)F)NC(=O)N(c3ccccc3F)C2=O)cc(OC)c1OC,C09108833_decoy,TRY1,Decoy,0,-8.14493,-6.45,-3.15,-5.836516693782866
COc1cc(C(=O)N[C@]2(C(F)(F)F)NC(=O)N(c3ccccc3F)C2=O)cc(OC)c1OC,C09108834_decoy,TRY1,Decoy,0,-8.28754,-7.31,-1.47,-6.319132949830651
COc1cc([C@H]2[C@@H]3C(=NN=C3c3cc(C)cc(C)c3O)C(=O)N2CCCO)cc(OC)c1OC,C12468495_decoy,TRY1,Decoy,0,-7.2493,-6.29,-2.63,-6.107700541278363
COc1cc([C@H]2C3=C(c4cc(Cl)c(C)cc4O)N=N[C@@H]3C(=O)N2CCO)cc(OC)c1OC,C09446327_decoy,TRY1,Decoy,0,-9.57017,-7.73,-1.01,-7.451353832523049
COc1ccc([C@@H]2C[C@@H]3C(=O)N=N[C@H](SCC(=O)Nc4ccc(F)cc4Cl)N3N2)cc1OC,C64701574_decoy,TRY1,Decoy,0,-9.7038,-7.64,-3.72,-7.495218110384341
CCOC(=O)Cn1c(=O)n(-c2ccc(F)cc2)c2nc(-c3ccc(F)cc3F)nc(C(N)=O)c21,C64966013_decoy,TRY1,Decoy,0,-8.81188,-7.92,-2.48,-7.705059212225355
O=C(CCC(=O)NC1C2CC3CC(C2)CC1C3)NNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1,C09763202_decoy,TRY1,Decoy,0,-7.71557,-7.98,-2.81,-7.064558691044232
CCCOc1ccc([C@@H]2NC(=S)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2cccs2)c(OCCC)c1,C12311890_decoy,TRY1,Decoy,0,-9.16966,-4.34,-2.77,-5.785016406275595
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)[C@@H](Nc1ccc(C(F)(F)F)cc1Cl)C(C)C,C13076141_decoy,TRY1,Decoy,0,-8.28998,-7.04,-1.14,-6.184500431757022
COCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1cccc(NC(=O)C(C)(C)C)c1,C13613892_decoy,TRY1,Decoy,0,-10.2618,-7.13,-2.43,-6.655053926224796
CCCCCCC(=O)NCCc1c(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)[nH]c2ccccc12,C13771003_decoy,TRY1,Decoy,0,-9.49274,-7.51,-2.92,-7.851763328432125
CCCCCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2ccc(Br)c(C)c2)cc1,C14029147_decoy,TRY1,Decoy,0,-9.07202,-7.03,-3.6,-6.581856086975178
CCCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2Br)cc1,C14030209_decoy,TRY1,Decoy,0,-10.7703,-6.69,-2.74,-7.81817312461259
CCCCn1c(N)c(N(CCC(C)C)C(=O)[C@@H](C)Oc2ccc(Br)cc2)c(=O)[nH]c1=O,C14623379_decoy,TRY1,Decoy,0,-8.50324,-7.28,-3.34,-6.717913786492496
COCCOc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccc(Br)cc1Cl,C14660697_decoy,TRY1,Decoy,0,-9.10768,-5.79,-2.27,-6.207194451850442
COCCOc1ccc(C(=O)NNC(=O)CCC(=O)Nc2cccc(Cl)c2C)cc1Br,C14661476_decoy,TRY1,Decoy,0,-10.3952,-7.31,-4.05,-6.868828990555381
COCCOc1ccc(C(=O)NC(=S)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br,C14662134_decoy,TRY1,Decoy,0,-7.58739,-6.53,-2.86,-5.576846387050592
CCCCn1c(N)c(N(CC(C)C)C(=O)CCCOc2ccc(Br)cc2)c(=O)[nH]c1=O,C14670030_decoy,TRY1,Decoy,0,-7.89543,-6.32,-4.38,-5.884374685963702
COc1cccc(OC[C@@H](O)CNC(=O)c2sc3ncnc(NCCc4ccccn4)c3c2C)c1,C14885512_decoy,TRY1,Decoy,0,-8.73853,-6.89,-1.94,-5.964580633211085
CCOc1ccc(Br)cc1S(=O)(=O)Nc1ccc(NC(=S)NC[C@@H]2CCCO2)cc1,C15980570_decoy,TRY1,Decoy,0,-8.6679,-5.96,-4.38,-5.656920482314066
CSCC[C@H](NC(=O)c1ccco1)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12,C16069921_decoy,TRY1,Decoy,0,-8.94285,-8.19,-3.03,-9.22530808256007
C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(NC(=S)NC(=O)CCc2ccccc2Cl)cc1,C20119689_decoy,TRY1,Decoy,0,-10.0589,-6.05,-3.29,-5.808106326364396
C=CCOC(=O)C1=C(C)NC(SCC(=O)Nc2ccc(C)c(C)c2)=C(C#N)[C@@H]1c1ccc(O)c(OC)c1,C20130338_decoy,TRY1,Decoy,0,-7.87541,-7.08,-4.29,-7.003694794478556
O=C(CCCCCn1c(=S)[nH]c2ccc(N3CCOCC3)cc2c1=O)NCCc1c[nH]c2ccccc12,C20644548_decoy,TRY1,Decoy,0,-8.85562,-8.53,-2.78,-7.116315654876476
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(SCCC(=O)Nc2cccc(C(F)(F)F)c2)n[nH]1,C20905220_decoy,TRY1,Decoy,0,-8.86533,-7.57,-3.35,-6.024567205287672
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(F)c(Cl)c3)n[nH]2)cc(OC)c1OC,C20909432_decoy,TRY1,Decoy,0,-9.67215,-7.33,-2.13,-6.816907608584607
CN(C)c1ccc(/C=N/Nc2nc(SCCC(=O)NC(c3ccccc3)c3ccccc3)n[nH]2)cc1,C21076178_decoy,TRY1,Decoy,0,-9.60398,-8.8,-3.85,-8.820430607659972
Cc1cccc(O[C@H](C)C(=O)NNC(=O)/C=C/c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1C,C22616020_decoy,TRY1,Decoy,0,-9.99507,-7.99,-2.88,-6.902577198507832
CCCOC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(CO)C[C@]3(O)C(=O)C(C)=C[C@@H]23)[C@@H]2C(C)(C)[C@]12OC(=O)CCC,C25757772_decoy,TRY1,Decoy,0,-8.45044,-6.53,-3.3,-7.241563234188521
CC(C)OC(=O)CCC/C=C\C[C@@H]1[C@@H](/C=C/[C@H](O)COc2cccc(C(F)(F)F)c2)[C@H](O)C[C@H]1O,C27641823_decoy,TRY1,Decoy,0,-10.6895,-6.49,-2.25,-6.79916295928652
CCCCCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1ccc(CC(=O)NC)cc1,C30835255_decoy,TRY1,Decoy,0,-9.39126,-6.22,-1.95,-6.61222243457682
CCOc1ccccc1NC(=O)Nc1ccc(N2CCc3ccccc3C2)c(C(=O)NCCCOC)c1,C33618782_decoy,TRY1,Decoy,0,-8.49261,-8.39,-3.84,-8.39503142615743
CCCN1C(=O)N[C@H](c2ccc(NC(=O)Nc3ccc(F)c(Cl)c3)cc2)C(C(=O)OCCOC)=C1C,C35711612_decoy,TRY1,Decoy,0,-9.05826,-7.65,-1.73,-7.399303316009671
CCCN1C(=O)N[C@@H](c2cccc(NC(=O)Nc3ccc(F)c(Cl)c3)c2)C(C(=O)OCCOC)=C1C,C35712141_decoy,TRY1,Decoy,0,-9.21446,-5.03,-1.85,-6.075898769713493
C[C@@H](c1ccccc1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500536_decoy,TRY1,Decoy,0,-8.2947,-6.01,-2.83,-6.645382101900472
CCCN(C(=O)c1c(O)cccc1O)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)[C@@H](C)c1ccccc1,C36571014_decoy,TRY1,Decoy,0,-8.60335,-6.28,-2.06,-6.427283069147714
CCCCC[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586797_decoy,TRY1,Decoy,0,-7.50123,-6.69,-2.59,-6.584745819652239
COc1cc([C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccc(C)o2)C(=O)c2ccccc2O)ccc1O,C36595477_decoy,TRY1,Decoy,0,-8.23757,-7.17,-2.58,-8.33351051789318
CCOC(=O)C1=C(CSc2nc3ccccc3c(=O)n2CCCO)NC(=O)N[C@@H]1c1ccccc1,C36627160_decoy,TRY1,Decoy,0,-7.30115,-7.23,-2.91,-5.98986229483566
CC(=O)Nc1ccc(NC(=O)CSc2nnc(CNc3ccc(F)cc3)n2C[C@H]2CCCO2)cc1,C00880730_decoy,TRY1,Decoy,0,-9.49766,-8.9,-1.96,-7.979913537687759
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1,C04177496_decoy,TRY1,Decoy,0,-9.39026,-7.2,-3.31,-6.556243496630374
COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C(=O)NCCCCCCNC(=O)OC(C)(C)C)C2,C39293110_decoy,TRY1,Decoy,0,-10.2801,-6.87,-2.59,-6.743917466912757
CCO[C@@H]1C[NH+]([C@@H](C[N-]S(=O)(=O)Oc2ccccc2)c2ccc(-c3ccccc3O)cc2)CCN1,C39534175_decoy,TRY1,Decoy,0,-8.42895,-6.49,-3.06,-7.282068545419823
Cc1nc(SCC(=O)N[C@H]2SC3=C(CCCC3)[C@H]2C(=O)OC(C)C)[nH]c(=O)c1CCC(=O)O,C39693222_decoy,TRY1,Decoy,0,-9.68855,-7.07,-3.03,-7.3220299354297955
C=CCn1c(S[C@@H](C)C(=O)Nc2nc(C)c(C)s2)nnc1[C@@H](CO)NC(=O)c1ccccc1F,C39763368_decoy,TRY1,Decoy,0,-9.2228,-8.4,-1.23,-7.987600098155571
CCCC[C@]1(c2ccc(F)cc2)NC(=O)N(CC2=C(C(=O)OCC)[C@@H](c3ccco3)NC(=O)N2)C1=O,C45442458_decoy,TRY1,Decoy,0,-7.87589,-6.17,-2.63,-6.539657567554147
CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3Cl)n2)c(C#N)c1C,C59015151_decoy,TRY1,Decoy,0,-10.0694,-7.66,-3.48,-8.111479180592294
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccccc3SCc3ccc(Cl)cc3)n[nH]2)cc1,C59019532_decoy,TRY1,Decoy,0,-10.6114,-9.06,-3.56,-7.955516854865439
C/C(=N/Nc1nc(SCC(=O)Nc2nnc(SCc3ccccc3)s2)n[nH]1)c1ccc(F)cc1,C59021808_decoy,TRY1,Decoy,0,-9.69297,-8.22,-2.73,-7.39454800204766
Cc1nn(C)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2ccccc2SCc2ccccc2)n[nH]1,C59309935_decoy,TRY1,Decoy,0,-9.75571,-7.41,-3.3,-7.28577612819056
CCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(\C)C34CC5CC(CC(C5)C3)C4)n2)s1,C59310760_decoy,TRY1,Decoy,0,-10.8774,-7.98,-2.18,-7.190817746078577
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(\C)C34CC5CC(CC(C5)C3)C4)n2)s1,C59310761_decoy,TRY1,Decoy,0,-9.84919,-7.49,-3.28,-6.856899832716638
CCCCC(=O)N[C@]1(C(F)(F)F)C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccc(OC)c(OC)c1,C01900390_decoy,TRY1,Decoy,0,-7.50318,-7.02,-3.25,-6.272421394283459
C=CCn1c(Cc2csc(NC(=O)Cc3ccc(OCC4=C(C)NO[C@@H]4C)cc3)n2)n[nH]c1=S,C64058046_decoy,TRY1,Decoy,0,-10.7757,-7.78,-3.64,-7.337051791392173
CCOC(=O)CC1=CC(=O)N(CC(=O)Nc2ccc([NH+](CC)CC)cc2C)c2cc(C)c(C)cc2N1,C64491368_decoy,TRY1,Decoy,0,-9.03231,-5.68,-4.33,-6.3519054946031845
CC(C)OC(=O)CCC/C=C/C[C@@H]1[C@H](/C=C/[C@@H](O)COc2cccc(C(F)(F)F)c2)[C@H](O)C[C@@H]1O,C66331653_decoy,TRY1,Decoy,0,-11.5509,-7.95,-4.24,-8.467896678099834
COc1cc(C(=O)O[C@H]2C[C@H]3C[NH+](CCc4c[nH]c5ccccc45)C[C@@H]3C[C@@H]2OC)cc(OC)c1OC,C04802405_decoy,TRY1,Decoy,0,-8.65313,-7.87,-1.91,-6.230799795858393
CCC(C)(C)n1nnnc1[C@@H](c1cc2cc(C)c(C)cc2[nH]c1=O)[NH+]1CCN(c2ccc(OC)cc2)CC1,C06077509_decoy,TRY1,Decoy,0,-8.27334,-6.64,-3.54,-5.776623251163248
CCC(C)(C)n1nnnc1[C@@H](c1cc2ccc(C)cc2[nH]c1=O)[NH+](Cc1ccc(F)cc1)Cc1ccco1,C06149264_decoy,TRY1,Decoy,0,-7.24211,-7.49,-3.36,-6.622957030321273
CCC(C)(C)n1nnnc1[C@H](c1cc2c(C)ccc(C)c2[nH]c1=O)[NH+]1CCN(c2ccccc2OC)CC1,C06077663_decoy,TRY1,Decoy,0,-8.01012,-8.21,-1.98,-6.259171882253692
CCC(C)(C)n1nnnc1[C@H](c1cc2cc(C)ccc2[nH]c1=O)[NH+](Cc1ccc(F)cc1)Cc1ccco1,C06149430_decoy,TRY1,Decoy,0,-7.74782,-7.33,-3.21,-8.67511615014004
CCOc1ccc(C[NH+](Cc2ccco2)[C@H](c2cc3ccc(C)cc3[nH]c2=O)c2nnnn2C(C)(C)C)cc1,C06196307_decoy,TRY1,Decoy,0,-8.37072,-6.83,-2.77,-6.292191861707975
CCOc1ccc2[nH]c(=O)c([C@@H](c3nnnn3Cc3ccc(F)cc3)[NH+]3CCCC4(CCCCC4)C3)cc2c1,C06196859_decoy,TRY1,Decoy,0,-8.69981,-8.58,-3.72,-7.905202742155044
COc1ccc(/C=N/OCC(=O)N/N=C2\C(=O)N(C[NH+]3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)c3ccccc32)cc1,C09428498_decoy,TRY1,Decoy,0,-9.60408,-9.24,-3.43,-8.074890933899217
COc1ccc(OC[C@@H](O)C[NH+]2CCC(CN3C(=O)c4cccc5cccc(c45)C3=O)CC2)c(C(C)(C)C)c1,C11847507_decoy,TRY1,Decoy,0,-9.14741,-8.4,-3.2,-6.331594125697109
O=C1N[C@@](Cc2ccccc2Cl)(C2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)C(=O)N1CC1CC1,C12098185_decoy,TRY1,Decoy,0,-9.29912,-7.0,-3.61,-6.511263841498327
CC[C@H](c1nnnn1C1CCCCC1)[NH+](CCc1ccccc1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C13064850_decoy,TRY1,Decoy,0,-8.93504,-7.94,-1.84,-8.497795871685783
CC[C@H](c1nnnn1Cc1ccccc1)[NH+](CCc1ccccc1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C13064884_decoy,TRY1,Decoy,0,-7.76472,-8.47,-3.06,-7.865552067979147
CC[C@H](c1nnnn1Cc1ccco1)[NH+](CCc1ccccc1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C13064972_decoy,TRY1,Decoy,0,-7.88218,-7.88,-3.91,-7.181047992904322
CC[C@H](c1nnnn1CCc1ccccc1)[NH+](CCc1ccccc1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C13064990_decoy,TRY1,Decoy,0,-9.29162,-8.48,-1.94,-8.876647021155529
CC[C@@H](c1nnnn1C1CCCCC1)[NH+](Cc1ccc2c(c1)OCO2)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C13065205_decoy,TRY1,Decoy,0,-8.25327,-8.6,-2.39,-7.747896663503512
COCCn1nnnc1[C@@H](c1cc2c(C)ccc(C)c2[nH]c1=O)[NH+](CCc1ccccc1)Cc1ccccc1,C06405636_decoy,TRY1,Decoy,0,-6.6664,-6.69,-2.19,-6.002646656322338
CC[C@H](c1nnnn1C(C)(C)CC)[NH+](CCc1cccc(C)c1)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13495938_decoy,TRY1,Decoy,0,-8.00183,-7.68,-2.58,-6.237473685937551
Cc1cc(C)c2cc(C[NH+](C3CCCCC3)[C@H](c3nnnn3Cc3ccccc3)C(C)C)c(=O)[nH]c2c1,C13499057_decoy,TRY1,Decoy,0,-7.04111,-7.11,-2.8,-5.822290919670811
CCC[C@H](c1nnnn1CCc1ccccc1)[NH+](Cc1cc2c(C)cc(C)cc2[nH]c1=O)C1CCCC1,C13499613_decoy,TRY1,Decoy,0,-7.97382,-6.89,-1.89,-6.249395759500437
Cc1ccc2[nH]c(=O)c(C[NH+](C3CCCCC3)[C@H](c3nnnn3CCc3ccccc3)C(C)C)cc2c1,C13500657_decoy,TRY1,Decoy,0,-8.05983,-8.36,-2.58,-6.49227993028011
CCC[C@@H](c1nnnn1C1CCCC1)[NH+](CCc1cccc(C)c1)Cc1cc2cccc(C)c2[nH]c1=O,C13500999_decoy,TRY1,Decoy,0,-7.4807,-7.42,-4.45,-7.344812962520318
CC[C@@H](c1nnnn1CCc1ccccc1)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C1CCCCC1,C13501219_decoy,TRY1,Decoy,0,-8.22388,-8.55,-1.97,-7.246247583071216
C[NH+](CCCN1C(=O)c2cc3occc3n2C[C@]1(C)C(=O)NC1CCCCCCC1)C1CCCCC1,C15675667_decoy,TRY1,Decoy,0,-8.98036,-8.41,-1.66,-8.133949638276775
CC[C@@H](c1nnnn1Cc1ccco1)[NH+](CCc1ccccc1)Cc1cc2ccc(OC)cc2nc1O,C08582581_decoy,TRY1,Decoy,0,-7.45592,-8.04,-2.21,-7.064316510471482
CCOc1ccc2[nH]c(=O)c([C@H](c3nnnn3C3CCCCC3)N3CC[NH+](C4CCCCC4)CC3)cc2c1,C20080445_decoy,TRY1,Decoy,0,-10.0116,-8.82,-1.76,-6.963449302590079
Cc1ccc(C)c2[nH]c(=O)c([C@@H](c3nnnn3CCc3ccccc3)N3CC[NH+](C4CCCCC4)CC3)cc12,C01381768_decoy,TRY1,Decoy,0,-7.69615,-8.53,-2.64,-6.0394080156171634
CCOc1ccc(N2C(=O)[C@@H](CC(=O)Nc3ccc(F)cc3)N(CC[NH+]3CCC(C)CC3)C2=S)cc1,C20114933_decoy,TRY1,Decoy,0,-9.21387,-8.11,-2.59,-7.699014004779588
CCOc1ccc(N2C(=O)[C@@H](CC(=O)Nc3ccc(OC)cc3)N(CCN3CC[NH+](C)CC3)C2=S)cc1,C20114968_decoy,TRY1,Decoy,0,-8.34138,-8.14,-2.38,-8.295445151201571
CC[NH+]1CCN(c2cc(C)c3cc(NC(=S)N4CCN(c5ccc([N+](=O)[O-])cc5)CC4)ccc3n2)CC1,C20153512_decoy,TRY1,Decoy,0,-8.30792,-6.63,-2.14,-5.131661501817344
COc1ccc(/[NH+]=c2\oc3c(C)ncc(COC(C)=O)c3cc2C(=O)Nc2ccc(Cl)cc2)c(OC)c1,C20617153_decoy,TRY1,Decoy,0,-9.2286,-8.21,-2.34,-9.464723382247232
COc1ccc([C@H](CNC(=O)CSc2nnc3c(Cl)cc(Cl)cn23)[NH+]2CCCCC2)cc1,C24966396_decoy,TRY1,Decoy,0,-10.0318,-7.38,-1.43,-8.356386425806148
Clc1ccc(COc2ccccc2C=NNc2cc(N3CCOCC3)nc(N3CCOCC3)[nH+]2)cc1,C08407535_decoy,TRY1,Decoy,0,-10.121,-9.22,-1.28,-9.67644071513974
CCN(C)c1nc(N2CCN(c3ccc(F)cc3)CC2)nc2c1C[NH+](Cc1cccc(OC)c1O)CC2,C34755477_decoy,TRY1,Decoy,0,-9.38318,-6.18,-1.38,-5.97513005732657
O=C(CSc1nc(N2CC[NH+](CC(=O)N3CC3)CC2)c2c3c(sc2n1)CCCC3)NC1CCCCC1,C34756698_decoy,TRY1,Decoy,0,-10.9886,-8.26,-1.9,-8.15014306494822
CCC[NH+]1CCN(c2nc(SCC(=O)Nc3ccc(OC)cc3)nc3sc4c(c23)CCCC4)CC1,C34756810_decoy,TRY1,Decoy,0,-9.9154,-6.86,-2.56,-6.131255655089637
CSc1ccc(NC(=O)N(CC[NH+](C)C)[C@H](C)c2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)cc1,C35070313_decoy,TRY1,Decoy,0,-7.07656,-7.28,-3.92,-7.782582853169977
COc1ccc([C@H]2CC(c3ccc(C)cc3)=[NH+]c3c(C(=O)Nc4ccc(C)cc4)cnn32)c(OC)c1OC,C20576185_decoy,TRY1,Decoy,0,-9.33163,-8.64,-1.72,-13.684980324021014
COc1cc([C@H]2C3=C(CC(C)(C)CC3=O)[NH+]=C3N=C(SCc4ccccc4)NN32)cc(OC)c1OC,C17242551_decoy,TRY1,Decoy,0,-8.82053,-6.77,-3.75,-6.768398132563261
COC(=O)c1c(NC(=O)[C@@H]2CCC[NH+](Cc3nc(-c4ccc(C)cc4)no3)C2)sc2c1CCCC2,C38890508_decoy,TRY1,Decoy,0,-8.53827,-7.26,-1.24,-6.324351773735816
COc1ccc(-c2noc(C[NH+]3CCC[C@@H](C(=O)N[C@@H](C)c4ccc(C(C)(C)C)cc4)C3)n2)cc1OC,C38893393_decoy,TRY1,Decoy,0,-9.41255,-7.26,-1.98,-6.007557976909288
CCOc1ccc([C@@H](C)NC(=O)[C@H]2CCC[NH+](Cc3nc(-c4ccc(C(C)(C)C)cc4)no3)C2)cc1OCC,C38903017_decoy,TRY1,Decoy,0,-10.471,-8.4,-2.66,-8.835545595388782
CC(C)CC1=C[C@@H](C(=O)N2CCC([C@H](Cc3ccc(F)cc3)[NH+](C)CC3=CN(C)N[C@H]3C)CC2)N=N1,C39380186_decoy,TRY1,Decoy,0,-8.31846,-7.38,-1.65,-6.8465668411028044
CCCS(=O)(=O)c1ccc(-c2cc(C(=O)NC[C@@H](c3ccc(C)cc3)[NH+]3CCCCC3)no2)cc1,C40325300_decoy,TRY1,Decoy,0,-10.8353,-7.67,-3.84,-7.567658081111528
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3ccc(C)cc3)CC2)N(C)C(=O)N[C@H]1c1ccc(C(C)C)cc1,C40392130_decoy,TRY1,Decoy,0,-8.5518,-6.96,-4.39,-6.625582790154
CCS(=O)(=O)c1ncc(C(=O)NC[C@H](c2ccc(C(C)(C)C)cc2)[NH+]2CCCCC2)c(Cl)n1,C40986120_decoy,TRY1,Decoy,0,-10.1023,-7.62,-3.83,-8.898129565535005
CCOC(=O)[C@H]1CCC[NH+](Cc2c(O)ccc3c(-c4cc5cccc(OC)c5oc4=O)cc(=O)oc23)C1,C41586564_decoy,TRY1,Decoy,0,-8.2953,-7.94,-2.7,-7.317373080288917
CCOc1ccccc1N1CCN(CN2N[C@H](C3=c4ccccc4=[NH+]C3)N(C[C@H]3CCCO3)C2=S)CC1,C63245261_decoy,TRY1,Decoy,0,-9.90955,-6.32,-2.03,-6.655059844018485
COc1ccc(O[C@@H]2C(=O)c3ccc(OCC(=O)NCCC4=c5ccccc5=[NH+]C4)cc3O[C@H]2C)cc1,C63270280_decoy,TRY1,Decoy,0,-9.58843,-8.29,-2.1,-6.507469421376407
CCc1cc(=O)oc2c3c(cc(OCC(=O)NCCC4=c5cc(OC)ccc5=[NH+]C4)c12)OC(C)(C)CC3,C63384927_decoy,TRY1,Decoy,0,-8.62036,-5.33,-3.72,-5.618324611068496
C=C(C)COc1cc2c(cc1Cl)[C@H](C)[C@@H](CC(=O)NCCC1=c3cc(OC)ccc3=[NH+]C1)C(=O)O2,C63486388_decoy,TRY1,Decoy,0,-7.6825,-7.0,-5.7,-6.811775635606595
C[NH2+]Cc1cn(C[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C(=O)NC2CCCCC2)nn1,C08298894_decoy,TRY1,Decoy,0,-8.20874,-5.27,-1.57,-5.728050919153688
CC(C)([NH3+])c1cn(CC2CC[NH+](C3CSCCSC3)CC2)nn1,C19607843_decoy,TRY1,Decoy,0,-10.0107,-5.45,-2.86,-5.333803301931642
C[C@H](Cc1ccccc1F)[NH+]1CCC(Cn2cc(C(C)(C)[NH3+])nn2)CC1,C20149175_decoy,TRY1,Decoy,0,-7.33946,-7.37,-2.31,-5.034901992384699
COc1cc(Br)cc(C[NH2+]CCN2CC[NH2+]CC2)c1OC,C20968607_decoy,TRY1,Decoy,0,-8.48642,-5.77,-2.16,-7.906921798474888
CC(C)([NH3+])c1cn(CC2CC[NH+](CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)nn1,C23478396_decoy,TRY1,Decoy,0,-7.86417,-5.57,-2.42,-4.911659276404243
COc1cc(C[NH2+][C@H](C)C[NH+]2CCCCC2)cc(Br)c1O,C35258866_decoy,TRY1,Decoy,0,-8.86283,-6.17,-1.18,-5.640105839002156
COc1ccc(Br)cc1[C@@H](C[NH3+])N1CC[NH+](C(C)C)CC1,C36170692_decoy,TRY1,Decoy,0,-7.75206,-3.88,-2.5,-4.698608652625688
CC[C@H](C)[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCCO2,C37109791_decoy,TRY1,Decoy,0,-8.01367,-5.43,-1.51,-5.202441120064712
CC[NH+](CC(C)C)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C37111212_decoy,TRY1,Decoy,0,-9.66563,-4.63,-1.12,-5.477900921651701
CC[C@H](C)C[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C37172675_decoy,TRY1,Decoy,0,-8.01479,-4.89,-3.43,-5.481989181753868
CC[NH+]1CCN([C@@H](C[NH3+])c2cc(Br)c3c(c2)OCO3)CC1,C37324703_decoy,TRY1,Decoy,0,-7.70288,-4.52,-1.7,-4.461669951758287
COc1cc(C[C@@H](C)[NH3+])cc(Br)c1OCC[NH+]1CCCC1,C37724945_decoy,TRY1,Decoy,0,-9.75804,-6.24,-1.73,-13.36984909551428
COc1cc(Br)c([C@H](C[NH3+])[NH+]2CCC[C@@H](C)C2)cc1OC,C37754885_decoy,TRY1,Decoy,0,-8.49594,-3.98,-2.06,-4.5854943785290825
COc1cc(Br)c([C@@H](C[NH3+])[NH+]2CCCCCC2)cc1OC,C37754887_decoy,TRY1,Decoy,0,-7.77161,-4.14,-1.91,-4.873416999740595
COc1cc(Br)c([C@H](C[NH3+])[NH+]2CCCCCC2)cc1OC,C37754888_decoy,TRY1,Decoy,0,-7.87683,-4.13,-2.98,-4.778859214329745
CC[C@H]([NH2+]CCN1CC[NH+](C)CC1)c1cc(Br)ccc1O,C37759745_decoy,TRY1,Decoy,0,-7.32447,-4.44,-1.12,-4.644313159685915
CC[C@H]1CCC[NH+]1[C@@H](C[NH3+])c1cc(OC)c(OC)cc1Br,C37913551_decoy,TRY1,Decoy,0,-8.52294,-5.07,-3.26,-5.173629981648028
CC[NH+](C(C)C)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCCCO2,C37081902_decoy,TRY1,Decoy,0,-9.02804,-4.5,-1.42,-5.447124584562569
CCC[NH+](C(C)C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C37095861_decoy,TRY1,Decoy,0,-8.31901,-4.12,-3.79,-4.788268457882149
C[NH2+]CC1=NNN(C2CC[NH+](Cc3ccc([C@@H]4C=CN=N4)s3)CC2)C1,C39358293_decoy,TRY1,Decoy,0,-8.07797,-5.53,-0.97,-5.098979980859478
C[NH2+]CC1=NNN(C2CC[NH+](Cc3ccc([C@H]4C=CN=N4)s3)CC2)C1,C39358294_decoy,TRY1,Decoy,0,-7.68093,-6.9,-0.91,-6.605986030031545
CCc1ccc2c(c1)=C1N=NC(N/N=C/c3cccc(OC)c3O)=[NH+][C@@H]1[NH+]=2,C39769495_decoy,TRY1,Decoy,0,-7.45515,-7.23,-2.98,-5.160601653589721
[NH3+]C[C@H](c1ccc(Br)o1)N1CCC([NH+]2CCCCC2)CC1,C40693855_decoy,TRY1,Decoy,0,-7.74234,-4.37,-0.61,-4.342684676129401
[NH3+]C[C@@H](c1ccc(Br)o1)N1CCC([NH+]2CCCCC2)CC1,C40693857_decoy,TRY1,Decoy,0,-8.40155,-4.61,-0.18,-4.786580348784831
CC(C)C[C@@H](C)[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C42577573_decoy,TRY1,Decoy,0,-7.45688,-4.93,-2.86,-4.693112013875026
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)Cc1cnn(C)c1,C43261845_decoy,TRY1,Decoy,0,-9.03731,-4.04,-3.34,-5.264470779481516
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)Cc1cnn(C)c1,C43286776_decoy,TRY1,Decoy,0,-9.54776,-5.85,-1.6,-7.748010442836618
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)Cc1cnn(C)c1,C43286777_decoy,TRY1,Decoy,0,-7.35951,-3.72,-2.54,-4.449194514908804
C[NH+]1CCC(C[NH2+]C[C@H](O)COc2ccc(Br)cc2)CC1,C44518243_decoy,TRY1,Decoy,0,-7.77639,-4.85,-1.63,-5.129389116658017
C[NH+]1CCC(C[NH2+]C[C@H](O)COc2cccc(Br)c2)CC1,C44518251_decoy,TRY1,Decoy,0,-8.41926,-5.27,-0.64,-5.078561407676452
CC[NH+]1CCN([C@@H](C)CNC(=O)Nc2ccc(N3CCCC3)[nH+]c2)CC1,C48082578_decoy,TRY1,Decoy,0,-8.84835,-5.55,-1.98,-5.234429982221142
COc1ccc(-c2cc([C@H]3C[NH+]4CC[C@H]3C[C@@H]4C[NH3+])n(C)n2)cc1OC,C35415841_decoy,TRY1,Decoy,0,-8.99964,-5.11,-2.61,-5.53478837482087
[NH3+][C@H](COc1cncc(C#Cc2ccncc2)c1)CC1=c2ccccc2=[NH+]C1,C52627727_decoy,TRY1,Decoy,0,-9.48071,-7.07,-2.89,-6.153451608542368
COc1c(C)c[nH+]c(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)c1C,C54095987_decoy,TRY1,Decoy,0,-7.056,-4.16,-1.63,-4.134132587919911
CN(C)c1[nH+]cccc1CNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C47882324_decoy,TRY1,Decoy,0,-8.2799,-6.97,-4.4,-6.970959195362935
C[NH+](C)[C@H]1CCN([C@@H](C[NH3+])c2cc(Br)c3c(c2)OCO3)C1,C62964690_decoy,TRY1,Decoy,0,-8.17615,-5.13,-1.08,-5.113108558453255
Cc1cccc2c1N[C@H](NC(=O)CSC1[NH+]=c3ccccc3=[NH+]1)S2,C63075047_decoy,TRY1,Decoy,0,-7.79532,-5.12,-1.78,-5.373607491818569
C[NH+](C)CCCNC(=O)CNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1,C63271139_decoy,TRY1,Decoy,0,-7.8662,-7.09,-1.72,-5.904112835732532
O=C(CSCC1[NH+]=c2ccccc2=[NH+]1)N[C@@H]1Nc2ccccc2S1,C63295719_decoy,TRY1,Decoy,0,-7.43848,-5.02,-1.33,-5.017138274500397
COc1ccc(N2C(=S)S[C@@H](C3[NH+]=c4ccccc4=[NH+]3)[C@@H]2N)cc1,C63416521_decoy,TRY1,Decoy,0,-7.51927,-6.59,-1.42,-5.389091054693325
COc1ccc(N2C(=S)S[C@H](C3[NH+]=c4ccccc4=[NH+]3)[C@@H]2N)cc1,C63416523_decoy,TRY1,Decoy,0,-7.37575,-5.89,-2.17,-4.566838970201834
CC1=C(c2ccnc(NCC[C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)n2)[C@@H](C)NN1C,C63846983_decoy,TRY1,Decoy,0,-8.37649,-7.39,-1.48,-5.918713569697202
COc1ccc(N2NC=C(C3=Nc4cc5c(cc4=[NH+]3)NC(=O)[NH+]=5)[C@H]2C)cc1,C63855643_decoy,TRY1,Decoy,0,-8.19522,-6.16,-0.85,-5.820409840163567
COc1ccc(N2NC=C(C3=Nc4cc5c(cc4=[NH+]3)NC(=O)[NH+]=5)[C@@H]2C)cc1,C63855644_decoy,TRY1,Decoy,0,-8.63902,-6.74,0.28,-5.300933703046533
Cc1nnc(SCCC[NH2+]C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)s1,C63883071_decoy,TRY1,Decoy,0,-8.88037,-6.26,-2.09,-5.2161864904922535
CCNC(=O)NC(=O)C[NH+]1CCC(C2=c3cc(OC)ccc3=[NH+]C2)CC1,C63970907_decoy,TRY1,Decoy,0,-7.06177,-5.94,-1.79,-5.152590398573667
CNC(=O)NC(=O)[C@H](C)[NH+]1CCC(C2=c3cc(OC)ccc3=[NH+]C2)CC1,C63970910_decoy,TRY1,Decoy,0,-6.30094,-5.85,-1.41,-5.022241826359647
CNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(C2=c3cc(OC)ccc3=[NH+]C2)CC1,C63970914_decoy,TRY1,Decoy,0,-6.60403,-7.08,-2.04,-5.131544560521714
C[C@H]1CCC[C@@](CNC(=O)NC2CC[NH+](CC(F)F)CC2)([NH+](C)C)C1,C64254718_decoy,TRY1,Decoy,0,-7.95481,-6.28,-1.58,-5.601152238516126
Cc1nn(CCO)c(C)c1C[NH2+][C@@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C67250623_decoy,TRY1,Decoy,0,-7.93865,-6.96,-1.54,-6.482571593910207
CC[NH+](CC)CCC[C@H](C)[n+]1c2ccc(Cl)cc2nc2c(N)cc(N)cc21,C05700672_decoy,TRY1,Decoy,0,-8.54639,-7.01,-0.77,-7.673928236350709
CC[NH+](CC)CCC[C@@H](C)[n+]1c2ccc(Cl)cc2nc2c(N)cc(N)cc21,C06139165_decoy,TRY1,Decoy,0,-8.40365,-7.02,-3.1,-8.002934022484347
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2cc(OC)ccc2O)C[C@@]1(C)CO,C11816145_decoy,TRY1,Decoy,0,-8.73844,-5.25,-1.92,-5.388193312397464
Cc1cccc(C[NH2+]Cc2cccc(OC[C@@H](O)C[NH+]3CCC(O)CC3)c2)c1,C12052501_decoy,TRY1,Decoy,0,-8.79875,-6.23,-3.5,-6.85202865798776
Cc1cccc(C[NH2+]Cc2cccc(OC[C@H](O)C[NH+]3CCC(O)CC3)c2)c1,C12052505_decoy,TRY1,Decoy,0,-8.36794,-6.6,-2.11,-7.561616226140518
OC1CCC([NH2+]Cc2ccc(OC[C@@H](O)C[NH+]3CCc4ccccc4C3)cc2)CC1,C12056816_decoy,TRY1,Decoy,0,-8.7841,-7.85,-2.02,-6.438765064038723
OC1CCC([NH2+]Cc2ccc(OC[C@H](O)C[NH+]3CCc4ccccc4C3)cc2)CC1,C12056818_decoy,TRY1,Decoy,0,-9.26128,-7.96,-2.38,-7.04520006465115
CCOc1cc(C[NH2+]C[C@H]2C[C@@H](CO)[NH+](C)[C@H]2c2ccccc2F)ccc1O,C12210244_decoy,TRY1,Decoy,0,-8.47531,-5.58,-2.2,-5.011671368582289
OC1CC[NH+](C[C@@H](O)COc2cccc(C[NH2+]C3CCCCCCC3)c2)CC1,C12299449_decoy,TRY1,Decoy,0,-8.36006,-5.65,-2.28,-5.123246536276716
OC1CCC([NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCc3ccccc3C2)CC1,C12385240_decoy,TRY1,Decoy,0,-9.77552,-6.86,-1.41,-7.560831382944864
OC1CCC([NH2+]Cc2ccccc2OC[C@H](O)C[NH+]2CCc3ccccc3C2)CC1,C12385241_decoy,TRY1,Decoy,0,-9.19948,-7.2,-2.22,-6.565853815701214
O[C@@H](COc1cccc(C[NH2+]CC2(O)CCCCC2)c1)C[NH+]1CCCCCC1,C14972137_decoy,TRY1,Decoy,0,-8.68561,-6.75,-1.41,-6.057900596271927
O[C@H](COc1cccc(C[NH2+]CC2(O)CCCCC2)c1)C[NH+]1CCCCCC1,C14972142_decoy,TRY1,Decoy,0,-8.84353,-7.19,-1.96,-6.1042682459766615
OC1CCC([NH2+]Cc2cccc(OC[C@@H](O)C[NH+]3CCc4ccccc4C3)c2)CC1,C14975737_decoy,TRY1,Decoy,0,-8.37756,-7.3,-3.46,-5.96607154273121
OC1CCC([NH2+]Cc2cccc(OC[C@H](O)C[NH+]3CCc4ccccc4C3)c2)CC1,C14975740_decoy,TRY1,Decoy,0,-9.76783,-6.3,-4.41,-5.65781839560281
O[C@@H](COc1ccccc1C[NH2+]CC1(O)CCCCC1)C[NH+]1CCSCC1,C14979788_decoy,TRY1,Decoy,0,-9.31954,-5.93,-3.29,-6.9973403600729895
O[C@H](COc1ccccc1C[NH2+]CC1(O)CCCCC1)C[NH+]1CCSCC1,C14979792_decoy,TRY1,Decoy,0,-8.7685,-6.37,-1.76,-6.756595091904615
OC1CC[NH+](C[C@@H](O)COc2cccc(C[NH2+]Cc3ccc(F)cc3F)c2)CC1,C15077475_decoy,TRY1,Decoy,0,-7.75453,-7.14,-2.47,-5.611583390329425
OC1CC[NH+](C[C@H](O)COc2cccc(C[NH2+]Cc3ccc(F)cc3F)c2)CC1,C15077477_decoy,TRY1,Decoy,0,-8.94692,-7.46,-1.54,-7.094366789068223
C[NH+](CC(=O)Nc1ccccc1Cl)CC(=O)Nc1sccc1C(N)=O,C16589802_decoy,TRY1,Decoy,0,-7.12859,-7.49,-1.85,-6.757149411244371
Nc1nnc(SCc2cc(O)nc(NC(=[NH2+])Nc3ccc(Cl)cc3Cl)n2)s1,C09329661_decoy,TRY1,Decoy,0,-10.0686,-7.69,-1.65,-8.313410821122334
COc1cccc([C@@H](CC[NH3+])N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)c1O,C19936584_decoy,TRY1,Decoy,0,-8.04523,-5.97,-2.04,-5.634750381308245
COc1cccc([C@H](CC[NH3+])N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)c1O,C19936585_decoy,TRY1,Decoy,0,-8.59427,-5.5,-2.23,-5.419478863859289
C[NH+](CCc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]Cc1ccc(F)cc1,C20465827_decoy,TRY1,Decoy,0,-7.34426,-5.55,-2.34,-5.050643790770754
C[NH+](CCc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]Cc1cccc(Cl)c1,C20465833_decoy,TRY1,Decoy,0,-7.2664,-5.87,-1.91,-5.541972787945037
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2ccc(CO)o2)C[C@@]1(C)CO,C20500647_decoy,TRY1,Decoy,0,-7.45946,-7.1,-1.5,-6.83766546034525
O[C@@H](COc1ccccc1C[NH2+]CC1(O)CCCCC1)C[NH+]1CCc2ccccc2C1,C20779254_decoy,TRY1,Decoy,0,-7.64996,-7.92,-2.82,-7.129410774315281
C[NH+](Cc1ccccc1)[C@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]Cc1cccc(Cl)c1,C30879733_decoy,TRY1,Decoy,0,-7.0795,-5.45,-1.26,-5.501562553169387
ONC[C@H](c1ccc(Cc2ccccc2)cc1)N1CC[NH2+][C@H](c2ccccc2O)C1,C39531027_decoy,TRY1,Decoy,0,-7.81463,-6.49,-1.43,-5.784192146963767
COC(=O)c1cc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc(C(=O)OC)c1,C40705679_decoy,TRY1,Decoy,0,-8.08971,-5.79,-2.25,-5.323091337780513
CCCOc1c(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1OC,C40744435_decoy,TRY1,Decoy,0,-7.2756,-5.74,-3.28,-5.75567483913617
CC(C)Oc1c(Cl)cc(Cl)cc1C[NH2+]CCNC(=O)c1nonc1N,C40744467_decoy,TRY1,Decoy,0,-9.34179,-7.04,-1.63,-8.01918133062513
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)ccc1OCc1c(F)cccc1Cl,C40744504_decoy,TRY1,Decoy,0,-7.89661,-7.75,-2.62,-6.864023669081996
COc1ccccc1C(=O)NNc1ncnc(NCC[NH+]2CCCCC2)c1N,C40756361_decoy,TRY1,Decoy,0,-7.71618,-6.9,-1.75,-5.7075831997944855
C=CC[NH+](CC=C)[C@@H](CNC(=O)Nc1ccccc1SCC(N)=O)C(C)C,C45695216_decoy,TRY1,Decoy,0,-9.76123,-5.95,-3.78,-6.411552266284027
CC[C@@H](CNC(=O)NNC(=S)NC1CCCC1)[NH+]1CCc2ccccc2C1,C46312291_decoy,TRY1,Decoy,0,-8.61132,-7.79,-1.59,-6.670028568054952
[NH3+]CCN(Cc1ccc(C[NH2+]Cc2ccccn2)cc1)[C@@H]1CCCc2cccnc21,C49113550_decoy,TRY1,Decoy,0,-7.38809,-5.97,-3.94,-5.626000009443929
[NH3+]CCN(Cc1ccc(C[NH2+]Cc2ccccn2)cc1)[C@H]1CCCc2cccnc21,C49113552_decoy,TRY1,Decoy,0,-7.97802,-6.83,-2.25,-5.693413098403565
[NH3+][C@H](CNc1cnc(Cl)c(/C=C/c2ccncc2)c1)CC1=c2ccccc2=[NH+]C1,C52627502_decoy,TRY1,Decoy,0,-9.27723,-5.61,-1.94,-5.933021306708279
Nc1nc(Nc2ccc3ncsc3c2)cc(Nc2ccc(C(=O)NCc3ccco3)cc2)[nH+]1,C39267716_decoy,TRY1,Decoy,0,-8.42849,-6.69,-1.94,-6.614983692503019
CCCNC(=O)C[NH+]1CCC(NC(=O)c2cc(NC(=O)CC)ccc2O)CC1,C53808474_decoy,TRY1,Decoy,0,-7.291,-5.52,-3.63,-5.016414441549717
Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1,C56159791_decoy,TRY1,Decoy,0,-7.55404,-7.49,-2.4,-6.6513036638646525
Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1,C56159792_decoy,TRY1,Decoy,0,-7.45207,-7.16,-1.97,-5.343962565805174
Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1,C56159794_decoy,TRY1,Decoy,0,-7.64099,-7.2,-3.21,-6.412218489692642
CC[NH+](CC)[C@H](CNC(=O)Nc1ccccc1SCC(N)=O)CC(C)C,C58896767_decoy,TRY1,Decoy,0,-7.22672,-4.96,-4.33,-5.140474359219101
C[C@@H](CC[NH+](C)C)NC(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C62504297_decoy,TRY1,Decoy,0,-7.05431,-5.8,-2.2,-5.585559594806488
[NH3+]CCc1nc(NC[C@@H](c2ccc(F)cc2)[NH+]2CCCC2)c2ccccc2n1,C65464248_decoy,TRY1,Decoy,0,-9.60501,-7.38,-3.31,-8.665629497288409
[NH3+]CCc1nc(NC[C@H](c2ccc(F)cc2)[NH+]2CCCC2)c2ccccc2n1,C65464251_decoy,TRY1,Decoy,0,-9.43587,-6.07,-1.04,-7.571161294833885
CCCCNC(=O)[C@@H]1CC[C@H](C)[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C66474074_decoy,TRY1,Decoy,0,-8.90107,-4.84,-2.07,-5.163059251902028
COc1cc(Br)cc(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)c1O,C67122193_decoy,TRY1,Decoy,0,-7.71807,-6.08,-3.88,-4.985859167422755
CN(C)c1ccc(/C=N/N2C(=O)CSC2=S)cc1,C01207377_decoy,TRY1,Decoy,0,-6.85295,-5.62,-0.7,-5.761773328909615
COc1cc2oc(=O)cc(C(F)(F)F)c2cc1OC,C00057589_decoy,TRY1,Decoy,0,-5.94276,-5.49,-1.5,-3.9109320678099135
CC(=O)COc1cc2oc(=O)cc(C)c2cc1Cl,C05040142_decoy,TRY1,Decoy,0,-7.20979,-5.3,-0.88,-4.597345113118408
Cc1ccc(CSC2=NC=NC3=NC=N[C@@H]32)cc1,C06522511_decoy,TRY1,Decoy,0,-7.27335,-3.84,-0.91,-3.690045737925044
C[C@H]1CN(S(=O)(=O)/C=C/c2ccccc2)C[C@H](C)O1,C07308081_decoy,TRY1,Decoy,0,-6.92904,-6.15,-0.63,-5.083677229347086
Brc1cc(CO[C@H]2CCCCO2)on1,C08614791_decoy,TRY1,Decoy,0,-6.02485,-4.22,0.18,-3.5621207045564653
COc1cc(N2CCCCC2)c(C=O)cc1C=O,C08701906_decoy,TRY1,Decoy,0,-6.55645,-4.73,-1.05,-4.695926559528906
CN(C)c1nc(C=O)c(Cl)n1-c1ccccc1,C12505209_decoy,TRY1,Decoy,0,-5.67001,-4.13,-0.67,-3.7651192176739423
CO/C(=N\N=C/c1ccccc1F)c1ccncc1,C17220565_decoy,TRY1,Decoy,0,-6.0356,-4.68,-1.36,-3.5290920415185565
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1C=O,C19476078_decoy,TRY1,Decoy,0,-5.65773,-5.7,-1.6,-4.022770260164079
CCc1nnc(C2CCN(C(=O)C(C)(C)C)CC2)s1,C23140741_decoy,TRY1,Decoy,0,-5.76686,-5.97,-1.82,-4.801846728634638
CN(Cc1ccc(C#N)cc1)c1ccc(C#N)cn1,C30523391_decoy,TRY1,Decoy,0,-5.87473,-6.88,-0.87,-6.957808128414557
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)c1cnn(C)c1,C31333273_decoy,TRY1,Decoy,0,-6.35975,-4.19,-1.0,-3.917048321112833
C/C(=N/N=C(\C)c1cccc(C)n1)c1cccc(C)n1,C17174156_decoy,TRY1,Decoy,0,-6.56794,-6.55,-2.43,-7.1335598299761145
N#CCc1ccc([C@H](C#N)c2ccc(Cl)nn2)cc1,C32267237_decoy,TRY1,Decoy,0,-6.99989,-6.46,-1.08,-6.101530474447084
O=c1ccccn1Cc1ncc(-c2ccc(F)cc2)o1,C32764922_decoy,TRY1,Decoy,0,-6.35719,-7.12,-0.6,-6.409688330460783
C[C@H]1CN(CCOc2ccccc2C#N)CCO1,C34673967_decoy,TRY1,Decoy,0,-6.0992,-5.06,-1.28,-4.889746875620623
ClCCc1nnc(-c2ccc(Br)o2)o1,C35658528_decoy,TRY1,Decoy,0,-7.15452,-4.53,-1.0,-4.671417687343316
O=Cc1cn(-c2ccncc2)nc1-c1ccc(F)c(F)c1,C35779406_decoy,TRY1,Decoy,0,-6.09886,-5.89,-1.63,-4.302746742426327
O=Cc1cn(-c2ccccc2F)nc1-c1ccco1,C36894330_decoy,TRY1,Decoy,0,-6.096,-6.57,-1.82,-6.260083716796794
Cc1cc(OC(=O)c2c(F)cc(F)cc2F)nc(C)n1,C01391654_decoy,TRY1,Decoy,0,-6.37118,-7.21,-1.72,-6.00415147476645
C#CCn1nc(-c2ccc(OCC)cc2)ccc1=O,C38479264_decoy,TRY1,Decoy,0,-6.48563,-5.56,-1.17,-4.201322116454812
CSc1nc(=O)n(C[C@H]2CCCO2)c2c1CCCC2,C38479572_decoy,TRY1,Decoy,0,-6.75817,-4.89,-1.94,-4.255661175470755
Cc1ccc(C2=NN=C[C@H]2CN2CCOCC2)cc1,C39352820_decoy,TRY1,Decoy,0,-6.3635,-6.57,-0.76,-6.590799805219894
Cc1noc(C)c1CC(=O)N(C)[C@@H](C)C(C)(C)C,C40068486_decoy,TRY1,Decoy,0,-5.60829,-5.44,-1.82,-4.1135927630398506
Cc1ccc(C)c(C(=O)[C@@H](C)n2nc(C)nc2C)c1,C41065104_decoy,TRY1,Decoy,0,-5.72737,-5.71,-2.33,-5.078280253306306
COc1ccc(C[C@H](C#N)N2CCOCC2)cc1,C41297307_decoy,TRY1,Decoy,0,-6.15757,-6.13,-1.82,-5.774171367560784
COc1ccc(C2(CN=C=O)CCOCC2)cc1,C41298976_decoy,TRY1,Decoy,0,-6.20351,-3.78,-1.35,-3.342806302073914
COC(=O)[C@@]1(SC)[C@@H]2C=C[C@H]1C1(C2)OCCO1,C44143836_decoy,TRY1,Decoy,0,-7.57775,-3.74,-0.76,-4.126226121651136
COC(=O)[C@@]12C=CC=C[C@]1(C(=O)OC)CC=CC2,C45027951_decoy,TRY1,Decoy,0,-5.57205,-3.82,-1.99,-3.885924706102052
C1CCc2nnc(SC[C@H]3CCCCO3)n2CC1,C47821857_decoy,TRY1,Decoy,0,-8.18495,-5.55,-1.5,-4.733090372350399
C[C@@H](CC#N)C(=O)c1cc(Cl)c2c(c1)OCCCO2,C48259169_decoy,TRY1,Decoy,0,-7.09709,-6.47,-2.31,-6.25087894387514
Cc1ccc(C(=O)/C=C/c2c(C)nn(C)c2Cl)o1,C48398784_decoy,TRY1,Decoy,0,-7.42622,-5.9,-1.08,-5.714600171274338
Cc1ccc([C@H](C)N(C)C(=O)c2cnns2)s1,C48801666_decoy,TRY1,Decoy,0,-6.76599,-5.05,-2.11,-4.319003762130748
C[C@@H](c1ccncc1)N(C)c1ncnc2ccsc12,C49441767_decoy,TRY1,Decoy,0,-6.78727,-4.5,-1.92,-4.219402748521574
Cc1noc(C2CN(Cc3ccccc3Cl)C2)n1,C49482650_decoy,TRY1,Decoy,0,-6.74323,-7.41,-2.6,-6.079919394540531
Cc1cc(C)c2c(c1)N(CCCCC#N)C(=O)C2=O,C49578700_decoy,TRY1,Decoy,0,-5.91762,-5.48,-2.39,-4.72907247770071
COc1ccc(C)cc1N1CCN([C@@H](C)C#N)CC1,C49847939_decoy,TRY1,Decoy,0,-6.81069,-4.74,-1.45,-4.032455476373272
CCN(C(=O)C1(C#N)CCOCC1)c1ccc(C)cc1,C49990501_decoy,TRY1,Decoy,0,-4.92951,-4.61,-1.44,-4.12370000922891
CC(C)c1ncc(Cl)c(C(=O)N(C)C(C)C)n1,C50106253_decoy,TRY1,Decoy,0,-6.20446,-4.05,-2.09,-3.7165304474768415
COCc1cc(Cl)nc(Cc2ccncc2)n1,C53133926_decoy,TRY1,Decoy,0,-6.6824,-5.5,-0.8,-8.032158985364141
CC(=O)c1sc(N(C)C2CCOCC2)nc1C,C54862371_decoy,TRY1,Decoy,0,-7.63568,-4.72,-0.68,-4.359126576525419
CN(Cc1cccc(C#N)c1)c1ncccc1C#N,C30522769_decoy,TRY1,Decoy,0,-5.94102,-5.57,-1.25,-6.885782046265658
CCc1nccn1-c1nc2sccn2c1CCl,C42419975_decoy,TRY1,Decoy,0,-7.23659,-5.95,-1.54,-6.102395218799088
Cc1c(C(=O)N(CC#N)CC#N)sc2ccccc12,C60332500_decoy,TRY1,Decoy,0,-6.76762,-4.04,-0.8,-4.126631771545344
Cc1noc(-c2cccn2Cc2ccccc2C)n1,C65288352_decoy,TRY1,Decoy,0,-5.75468,-6.36,-0.87,-4.537661505151151
CCN(C(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1C,C65549406_decoy,TRY1,Decoy,0,-5.67407,-5.52,-3.13,-4.9391471028810185
C[C@@H]1COCCN1Cc1coc(-c2ccc(F)cc2)n1,C65550587_decoy,TRY1,Decoy,0,-7.53675,-6.17,-1.05,-4.9173346588276585
COc1cc(Cl)c(C=C(C#N)C#N)cc1OC,C66202265_decoy,TRY1,Decoy,0,-6.6779,-5.55,-1.17,-5.94066238466786
Fc1cccc([C@H]2CN(Cc3ccno3)CCO2)c1,C66849289_decoy,TRY1,Decoy,0,-6.54782,-5.53,-0.66,-4.098256813966429
Nc1nc(N)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04353415_decoy,TRY1,Decoy,0,-6.59429,-7.44,-0.74,-7.614564815689531
Nc1ncnc2c1nc(N)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C05163030_decoy,TRY1,Decoy,0,-6.69719,-7.57,-0.32,-7.583783897334773
Nc1ncnc2c1nc(N)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C04823726_decoy,TRY1,Decoy,0,-6.67991,-7.31,-0.81,-7.917653876195926
Nc1nc(N)c2ncn([C@H]3O[C@@H](CCO)[C@@H](O)[C@@H]3O)c2n1,C13284854_decoy,TRY1,Decoy,0,-5.60903,-6.99,-0.7,-5.352439234424791
CN(/N=C/C(=N/N)[C@@H](O)[C@@H](O)[C@@H](O)CO)c1ccccc1,C16188760_decoy,TRY1,Decoy,0,-7.18006,-5.83,-1.14,-7.3851991983298175
CN(/N=C/C(=N/N)[C@H](O)[C@@H](O)[C@@H](O)CO)c1ccccc1,C16188762_decoy,TRY1,Decoy,0,-7.74944,-7.47,-1.74,-9.35758317459086
CN(/N=C/C(=N/N)[C@@H](O)[C@H](O)[C@@H](O)CO)c1ccccc1,C16188764_decoy,TRY1,Decoy,0,-7.45327,-6.71,-4.33,-8.923408744767341
CN(/N=C/C(=N/N)[C@H](O)[C@H](O)[C@@H](O)CO)c1ccccc1,C16188766_decoy,TRY1,Decoy,0,-7.75759,-6.33,-1.39,-6.994177512379456
CCO[C@@H](C)C(/C=N/NC(N)=S)=N/NC(N)=S,C18165358_decoy,TRY1,Decoy,0,-7.5086,-4.71,-1.13,-7.65002792840109
Nc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1,C22048039_decoy,TRY1,Decoy,0,-6.9607,-7.65,-1.46,-7.7827731504946
Nc1ncnc2c1nc(N)n2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O,C22048043_decoy,TRY1,Decoy,0,-6.17922,-7.8,-1.1,-9.04945402025738
CCCCCNC(=S)NNC(=O)[C@@H](C)NC(N)=O,C26680132_decoy,TRY1,Decoy,0,-7.85407,-4.17,-2.38,-5.103644783564705
Nc1nc(N)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1,C27332328_decoy,TRY1,Decoy,0,-6.3971,-6.11,-0.65,-4.323024430427743
Nc1nc(Nc2ccc(Cl)c(Cl)c2)c(N)c(=O)[nH]1,C16982833_decoy,TRY1,Decoy,0,-7.32759,-7.0,-1.48,-7.27045368803486
Nc1ncnc2c1nc(N)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C17376088_decoy,TRY1,Decoy,0,-6.28277,-7.62,-1.12,-7.115320122007317
Nc1ncnc2c1nc(N)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C31666797_decoy,TRY1,Decoy,0,-5.4974,-7.82,-0.57,-10.758751548339298
Nc1ncnc2c1nc(N)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C17013453_decoy,TRY1,Decoy,0,-6.89281,-7.84,-0.23,-8.42865589024167
NNc1ncnc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)[nH]nc12,C08628084_decoy,TRY1,Decoy,0,-7.54301,-7.93,-0.33,-8.850395266932221
NNc1ncnc2c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)[nH]nc12,C08628083_decoy,TRY1,Decoy,0,-6.89938,-7.89,-0.43,-8.227460827097829
Nc1cc2c(cc1NCCS(N)(=O)=O)NC(=O)CO2,C36744635_decoy,TRY1,Decoy,0,-7.79635,-5.11,-0.35,-4.556272289474797
Nc1nc(N)nc(CSc2c(N)cccc2Cl)n1,C37204006_decoy,TRY1,Decoy,0,-8.64631,-7.34,-1.46,-10.575838014117826
NNc1nc2sccn2c1S(=O)(=O)NCC(N)=O,C37471367_decoy,TRY1,Decoy,0,-7.26459,-7.06,-1.41,-7.566466615526313
CCCCn1c(N)c(NCCCC(N)=O)c(=O)[nH]c1=O,C37737764_decoy,TRY1,Decoy,0,-6.23491,-4.68,-2.86,-3.8774159333920912
Nc1nc(=O)[nH]c2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C04018121_decoy,TRY1,Decoy,0,-6.03196,-7.5,-0.78,-8.461540069354294
NC(=O)N/N=C1/C=CC(NNC(N)=O)=C2C(=O)C=CC=C21,C05003714_decoy,TRY1,Decoy,0,-6.5011,-7.29,-1.04,-9.228632893851568
NC1=NN=C(N)C1=NNc1ccc(S(N)(=O)=O)cc1,C04657707_decoy,TRY1,Decoy,0,-7.08298,-6.98,-0.57,-8.685534512053797
Cc1ccc2cccc(Nc3ncnc(NN)c3N)c2n1,C40758640_decoy,TRY1,Decoy,0,-8.0186,-8.2,-0.97,-8.783204562019218
COCCCNC(=S)NNC(=O)[C@@H](NC(N)=O)C(C)C,C42236054_decoy,TRY1,Decoy,0,-6.80514,-4.93,-2.1,-5.047447918614562
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1,C43505197_decoy,TRY1,Decoy,0,-7.21453,-6.71,-1.29,-8.50289500633356
NC(=O)C[C@@H]([NH3+])[C@H](C=O)c1cccc(C(N)=O)c1[N+](=O)[O-],C44254442_decoy,TRY1,Decoy,0,-5.88361,-5.43,-0.57,-8.53126465755342
NC(=O)C[C@H]([NH3+])[C@H](C=O)c1cccc(C(N)=O)c1[N+](=O)[O-],C44254445_decoy,TRY1,Decoy,0,-6.05897,-4.68,-1.54,-5.10510709754073
Nc1nc(N)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c2n1,C44595482_decoy,TRY1,Decoy,0,-6.49494,-6.79,-0.89,-6.530811207060211
CCOCCCNC(=S)NNC(=O)[C@H](C)NC(N)=O,C46585580_decoy,TRY1,Decoy,0,-6.4301,-5.63,-3.3,-6.164156193875245
CCCNC(=S)NNC(=O)[C@H](NC(N)=O)C(C)C,C48087955_decoy,TRY1,Decoy,0,-7.1024,-5.05,-4.12,-5.129648476735206
CN1C(=O)C(/C(N)=N/OCC(N)=O)=C(N)C12CCCC2,C49065818_decoy,TRY1,Decoy,0,-6.25424,-5.54,-0.96,-4.812154670449546
CCCNC(=S)NNC(=O)[C@H](CCC)NC(N)=O,C49076801_decoy,TRY1,Decoy,0,-7.39782,-5.51,-2.57,-7.135429583966845
CCCNC(=S)NNC(=O)[C@@H](CCC)NC(N)=O,C49076804_decoy,TRY1,Decoy,0,-7.10668,-5.94,-0.9,-6.665627999035778
C[C@@H](NC(N)=O)C(=O)NNC(=S)NCC(F)(F)F,C49519357_decoy,TRY1,Decoy,0,-6.89447,-4.82,-1.36,-4.308002370772258
NC(=O)CC1CCN(c2cc(C(N)=O)c(N)cc2F)CC1,C50032552_decoy,TRY1,Decoy,0,-7.90669,-6.37,-0.93,-8.090912876614262
CC(C)c1ncc(NN)c(C(=O)NC(C)(C)C(N)=O)n1,C51124528_decoy,TRY1,Decoy,0,-7.16075,-4.15,-1.97,-4.444365484763627
Cc1nn(C)c(NN)c1CSc1nc(N)cc(N)n1,C51151146_decoy,TRY1,Decoy,0,-7.53251,-6.99,-2.5,-6.822866508320031
Nc1ccc([C@H](O)CSc2nc(N)cc(N)n2)cc1,C51325689_decoy,TRY1,Decoy,0,-7.19156,-7.22,-3.9,-6.588618768821207
Nc1cc(N)nc(Sc2ccc3c(c2)NC(=O)[C@@H]3N)n1,C41023853_decoy,TRY1,Decoy,0,-7.9218,-7.69,-0.71,-7.021299480649409
NC(=O)c1cc(Sc2nc(N)cc(=O)[nH]2)ccc1N,C41670274_decoy,TRY1,Decoy,0,-6.5335,-7.19,-0.81,-6.939191088434758
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@@H]1c1cccs1,C58950504_decoy,TRY1,Decoy,0,-6.66293,-5.15,-1.52,-4.133649981422529
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@@H]1c1ccc[nH]1,C58950516_decoy,TRY1,Decoy,0,-6.6007,-5.12,-2.17,-4.362585172132171
CCO[C@@H](C)C(/C=N\NC(N)=S)=N/NC(N)=S,C18165360_decoy,TRY1,Decoy,0,-7.90626,-5.3,-1.06,-7.458021763830732
NCC#Cc1ccc(CN(CC(N)=O)CC(N)=O)s1,C61808442_decoy,TRY1,Decoy,0,-7.69253,-5.09,-3.02,-5.483790077816882
NC(=O)CN(CC(N)=O)Cc1cc([N+](=O)[O-])ccc1N,C61808507_decoy,TRY1,Decoy,0,-6.32543,-6.27,-1.88,-6.95634627780147
NNc1ccc(Cl)c(CN(CC(N)=O)CC(N)=O)n1,C61808551_decoy,TRY1,Decoy,0,-7.10243,-6.0,-1.3,-10.43347823805529
COc1cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)ccc1O,C04995354_decoy,TRY1,Decoy,0,-8.23953,-5.92,-1.47,-5.870575895302891
[NH3+][C@@H](Cc1c[nH]c2ccccc12)c1nnc(SCc2cccc(F)c2)o1,C01274888_decoy,TRY1,Decoy,0,-9.21158,-8.61,-1.43,-7.777504569274227
CC(C)[NH+]1CCN(C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C13629688_decoy,TRY1,Decoy,0,-7.37544,-6.75,-0.75,-5.498421399076529
CC(C)[C@H]([NH3+])C(=O)Nc1c(Cl)cc(Br)cc1Cl,C20505966_decoy,TRY1,Decoy,0,-8.51696,-4.37,-1.43,-4.898322524515577
C[C@@H](C(=O)Nc1c(F)c(F)c(F)c(F)c1F)[NH+]1CCC(C(N)=O)CC1,C25525243_decoy,TRY1,Decoy,0,-7.70915,-6.33,-1.39,-4.771237845278353
C[NH2+][C@@H](c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccc(Br)o1,C35487668_decoy,TRY1,Decoy,0,-7.70032,-6.42,-1.85,-4.830212080966322
C[NH+](C)CCCNS(=O)(=O)c1ccc(N)cc1Br,C37053458_decoy,TRY1,Decoy,0,-7.33057,-6.32,-1.28,-9.642933771180216
CCOc1c(Br)cc(Br)cc1CNCC[NH3+],C37712898_decoy,TRY1,Decoy,0,-8.4415,-4.45,-1.26,-7.457799060752042
O[C@H](C[NH2+]C[C@H](O)c1ccccc1)c1cccc(Br)c1,C37860123_decoy,TRY1,Decoy,0,-6.82537,-6.3,-1.39,-6.196952812545267
COc1ccc([C@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)cc1O,C01250665_decoy,TRY1,Decoy,0,-9.21287,-5.72,-1.06,-4.650918928028209
CC1(C)CC(NC(=O)C(=O)NC2=CC3=CC=N[C@@H]3C=C2)CC(C)(C)[NH2+]1,C39272222_decoy,TRY1,Decoy,0,-8.497,-6.12,-1.8,-6.995871633503663
CCS[C@H]1N[C@@H]2NC3=C(C(=O)CC(C)(C)C3)[C@H](C3=CC=[NH+]C3)N2N1,C39916078_decoy,TRY1,Decoy,0,-8.21646,-6.6,-1.91,-5.026322971793687
CC[NH+]1CCC(NS(=O)(=O)c2ccc(N)cc2Br)CC1,C40347750_decoy,TRY1,Decoy,0,-7.15526,-6.6,-1.3,-7.186266976572161
COc1cccc(C[NH+]2CCC3(CC2)NC(=O)c2cccc(C)c2N3)c1O,C40427095_decoy,TRY1,Decoy,0,-8.23375,-5.86,-3.0,-4.689907337198476
Cc1nc(CNc2c(N)c[nH+]c3ccc(Br)cc23)cs1,C41010386_decoy,TRY1,Decoy,0,-6.73729,-5.07,-0.05,-4.0568080542106655
C[NH+](Cc1csc(Br)c1)C[C@H](O)Cn1cc(N)cn1,C42360386_decoy,TRY1,Decoy,0,-8.45687,-4.14,-1.72,-4.554809434525811
C[NH+](Cc1cc(Br)cs1)C[C@H](O)Cn1cc(N)cn1,C42398082_decoy,TRY1,Decoy,0,-8.46224,-4.52,-0.52,-4.821170856355024
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)c1sccc1Br,C42524593_decoy,TRY1,Decoy,0,-10.1299,-4.76,-0.97,-5.575097830062251
C[C@H]([NH3+])[C@@H](Oc1ccc(CO)cc1)c1ccc(Br)cc1,C42958419_decoy,TRY1,Decoy,0,-7.5078,-5.45,-1.44,-7.124869333622477
C[C@H]([NH3+])[C@@H](Oc1ccc(CO)cc1)c1ccccc1Br,C43095540_decoy,TRY1,Decoy,0,-7.55906,-6.24,-2.13,-7.538393980285277
C[C@@H]([NH3+])[C@@H](Oc1ccc(CO)cc1)c1ccccc1Br,C43095543_decoy,TRY1,Decoy,0,-7.53985,-6.37,-1.91,-7.336585067753266
CC[C@H](N)[C@@H](c1ccc(Br)s1)[NH+]1CCN(CCO)CC1,C43260391_decoy,TRY1,Decoy,0,-8.59058,-4.38,-2.04,-5.2900948765820806
C[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CCN(CCO)CC1,C43260410_decoy,TRY1,Decoy,0,-8.92977,-3.8,-1.28,-4.85998527924861
[NH3+][C@H](CCO)c1ccc(-c2c(Cl)cc(C(F)(F)F)cc2Cl)o1,C44234987_decoy,TRY1,Decoy,0,-9.38041,-6.73,-4.2,-5.77813264961941
CC(C)C[C@@H]([NH3+])CNS(=O)(=O)c1cncc(Br)c1,C44243629_decoy,TRY1,Decoy,0,-9.663,-5.49,-2.31,-6.485461165283192
CC[C@@H]([NH3+])Cc1cc(Br)c(OC)c(Br)c1O,C44404226_decoy,TRY1,Decoy,0,-9.71789,-5.3,-1.43,-9.146537752377505
COc1cc(C[C@H](C)[NH3+])c(Br)c(Br)c1O,C44410867_decoy,TRY1,Decoy,0,-9.70667,-4.1,-0.96,-5.134609237245678
C[NH+](Cc1cccc(Br)c1)C[C@@H](O)Cn1cc(N)cn1,C48891161_decoy,TRY1,Decoy,0,-7.62479,-6.47,-1.54,-7.209656792552833
Cc1nc(C)c([C@@H](C)NS(=O)(=O)c2ccc(CC[NH3+])s2)s1,C49539322_decoy,TRY1,Decoy,0,-9.63551,-5.66,-2.05,-7.75051696866843
Cc1nc(C)c([C@H](C)NS(=O)(=O)c2ccc(CC[NH3+])s2)s1,C49539323_decoy,TRY1,Decoy,0,-9.96058,-5.45,-1.5,-5.92921666392314
C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1ccc(N)cc1Br,C49554789_decoy,TRY1,Decoy,0,-7.37008,-6.11,-1.0,-10.075159245206386
Nc1ncc(Br)cc1S(=O)(=O)N[C@@H]1CC[NH+]2CCC[C@H]12,C50672994_decoy,TRY1,Decoy,0,-7.57952,-4.66,-3.3,-4.026288554467339
[NH3+]C[C@H](Sc1ncnc2nc[nH]c12)c1ccc(Br)cc1,C51036190_decoy,TRY1,Decoy,0,-7.56864,-6.55,-2.31,-6.9835134526070455
Cc1nn(C)c(NN)c1C[NH+](C)Cc1cc(Br)cs1,C51145162_decoy,TRY1,Decoy,0,-7.95673,-5.95,-1.68,-6.650400639817012
C[C@@H](O)CN(C)S(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl,C51843318_decoy,TRY1,Decoy,0,-9.40113,-5.21,-2.73,-7.175282024490449
CCC(C)(C)NC(=O)[C@@H](C)Oc1ccc(Br)cc1[C@H](C)[NH3+],C52066440_decoy,TRY1,Decoy,0,-8.70465,-5.7,-3.35,-5.858790245845687
C[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CCC[C@@H]1CCCO,C52757272_decoy,TRY1,Decoy,0,-8.34697,-5.17,-0.75,-5.460973452493578
C[C@H]([NH3+])[C@H](c1cc(Br)cs1)N1CCC[C@@H]1CCCO,C52757276_decoy,TRY1,Decoy,0,-8.68246,-4.21,-0.59,-5.463963844950988
C[NH2+][C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)[C@H]1COCCO1,C55301545_decoy,TRY1,Decoy,0,-7.53739,-5.85,0.26,-4.716572131360475
C[C@@H]([NH3+])[C@H](Sc1n[nH]c(=O)n1C)c1cc(Br)cs1,C61592524_decoy,TRY1,Decoy,0,-8.28894,-6.32,-2.38,-8.44989639363787
C[C@@H]([NH3+])[C@H](Sc1n[nH]c(=O)n1C)c1cccc(Br)c1,C61592612_decoy,TRY1,Decoy,0,-7.12775,-6.89,-1.47,-11.027693035294872
C[C@@H]([NH3+])[C@@H](Sc1n[nH]c(=O)n1C)c1cccc(Br)c1,C61592614_decoy,TRY1,Decoy,0,-8.45587,-5.88,-4.73,-6.759211649793904
CCn1c(S[C@H](C[NH3+])c2ccc(Br)cc2)n[nH]c1=O,C61594325_decoy,TRY1,Decoy,0,-8.69748,-5.47,-4.39,-6.268548229027969
CCn1c(S[C@@H](C[NH3+])c2cc(Br)cs2)n[nH]c1=O,C61594412_decoy,TRY1,Decoy,0,-9.1014,-5.88,-0.69,-7.692121803931533
[NH3+]C[C@@H](Sc1n[nH]c(=O)n1C1CC1)c1ccc(Br)cc1,C61594636_decoy,TRY1,Decoy,0,-8.68808,-5.46,-1.3,-4.872088130349467
[NH3+]C1CCC(c2ncc(-c3ccc(F)c(Br)c3)[nH]2)CC1,C61689857_decoy,TRY1,Decoy,0,-8.38054,-7.41,-0.92,-6.831259082460089
C[NH+](CCNS(=O)(=O)c1cc(Br)ccc1N)C1CC1,C61992622_decoy,TRY1,Decoy,0,-7.72669,-5.8,-1.79,-5.456443932897197
CC(=O)N[C@@H]1Nc2ccc(NC(=O)[C@H]3C=c4ccccc4=[NH+]3)cc2S1,C63600812_decoy,TRY1,Decoy,0,-7.19745,-6.08,-1.03,-5.531807798700667
C=CCn1c(=S)[nH]c([O-])c([C@H]2[NH2+]CCC3=c4ccccc4=[NH+][C@H]32)c1=O,C63641417_decoy,TRY1,Decoy,0,-6.50663,-5.66,-2.03,-4.684005455634937
C[C@@H]1NN[C@@H](SCC(=O)NCCC2=c3ccccc3=[NH+]C2)S1,C63740166_decoy,TRY1,Decoy,0,-6.72658,-5.4,-1.19,-4.526761507081899
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OCC(=O)Nc2ccccc2OC)c(OCC)c1,C00679509_decoy,TRY1,Decoy,0,-8.53092,-6.31,-3.75,-7.658827929749617
CCOc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1,C08722037_decoy,TRY1,Decoy,0,-8.32928,-6.74,-2.74,-5.9270187463534665
CCCCSCCCNC(=O)c1c[nH]c2ccc(S(=O)(=O)Nc3ccc(CC)cc3)cc2c1=O,C08813442_decoy,TRY1,Decoy,0,-8.80118,-5.38,-4.23,-5.5912426157934245
CCOc1ccc(NS(=O)(=O)c2ccc3[nH]cc(C(=O)NCCCOC(C)C)c(=O)c3c2)cc1,C06181517_decoy,TRY1,Decoy,0,-8.02822,-6.68,-4.39,-5.077099585994623
CCCCCCOc1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1,C09269558_decoy,TRY1,Decoy,0,-8.61759,-5.48,-4.15,-5.524428606516104
CC(C)CCOc1ccccc1C(=O)NC(=S)Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1,C09269584_decoy,TRY1,Decoy,0,-8.34666,-6.21,-4.4,-5.401901515355356
CCOCCOc1ccccc1C(=O)NC(=S)NNC(=O)c1ccc(OCC(C)C)cc1,C09826317_decoy,TRY1,Decoy,0,-8.07385,-6.68,-2.32,-8.75094716592816
Cc1cc(C)cc(OCC(=O)NNC(=S)NC(=O)c2ccccc2OCCc2ccccc2)c1,C10510607_decoy,TRY1,Decoy,0,-8.70884,-8.96,-4.13,-7.710252180990081
CCCCN(C(=O)COC(=O)c1cccc(C(F)(F)F)c1)c1c(N)n(CCC)c(=O)[nH]c1=O,C10744660_decoy,TRY1,Decoy,0,-7.43269,-6.67,-2.64,-6.5942161645595565
COCCOC(=O)c1c(NC(=O)COC(=O)C(C)(C)c2ccccc2)sc(C(N)=O)c1C,C10842447_decoy,TRY1,Decoy,0,-9.43555,-6.45,-2.29,-7.448158363896224
CC[C@H](C)NC(=O)c1ccccc1NC(=S)NC(=O)c1cc(Br)ccc1OCCOC,C10123495_decoy,TRY1,Decoy,0,-8.35769,-6.39,-2.97,-7.068477378038815
CCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1ccc(C(=O)NCCOC)cc1,C13617500_decoy,TRY1,Decoy,0,-8.93587,-4.99,-3.68,-5.729918763691368
CCOc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(S(=O)(=O)N[C@H](C)CC)cc2)cc1,C13621041_decoy,TRY1,Decoy,0,-9.38615,-6.26,-2.71,-7.865662558227557
CCOc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(S(=O)(=O)N[C@@H](C)CC)cc2)cc1,C13621042_decoy,TRY1,Decoy,0,-8.35077,-5.52,-1.83,-5.753576566657563
CC(C)CCOc1ccccc1C(=O)NC(=S)NNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1,C13630246_decoy,TRY1,Decoy,0,-9.53533,-7.48,-0.9,-7.889875392124164
Cc1ccc(C(C)C)c(OCC(=O)NNC(=S)NC(=O)COc2ccc(C(C)(C)C)cc2)c1,C13976465_decoy,TRY1,Decoy,0,-8.6284,-8.43,-2.02,-8.523265459180765
CC[C@@H](C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccccc2OCCC(C)C)cc1,C14034484_decoy,TRY1,Decoy,0,-8.39685,-6.3,-3.89,-5.59450756598714
CCCCN(C(=O)c1cc(Cl)c(OC(C)C)c(OC)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14623891_decoy,TRY1,Decoy,0,-8.21941,-5.72,-3.39,-6.147008041335715
CCCCOc1c(Cl)cc(C(=O)N(C)c2c(N)n(CCCC)c(=O)[nH]c2=O)cc1OCC,C14655614_decoy,TRY1,Decoy,0,-8.12839,-5.82,-4.49,-5.727119427473009
CCCCCN(C(=O)COc1c(Cl)cccc1Cl)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697750_decoy,TRY1,Decoy,0,-7.7663,-5.74,-3.31,-6.003419214435958
CCCCN(C(=O)COC(=O)c1ccc(-c2ccccc2)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C15155060_decoy,TRY1,Decoy,0,-8.11626,-7.53,-2.8,-6.405093017060065
CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)cc1,C15808326_decoy,TRY1,Decoy,0,-8.00625,-7.13,-3.86,-5.836486394420902
CCOc1ccccc1Nc1nnc(SCC(=O)N(CCC(N)=O)c2ccc(F)cc2)s1,C16763214_decoy,TRY1,Decoy,0,-8.73024,-8.11,-2.32,-6.970668021685168
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)[C@@H](NC(=O)c1ccccc1F)C(C)C,C18398530_decoy,TRY1,Decoy,0,-8.14603,-8.28,-1.78,-7.288241515297982
CC(C)c1ccc(OCc2nnc(SCC(=O)NCCc3ccc(OC(F)F)cc3)n2N)cc1,C19354557_decoy,TRY1,Decoy,0,-8.83444,-8.63,-1.45,-7.085805872084444
O=C(CSc1n[nH]c(N/N=C/c2ccc(OCc3ccc(F)cc3)o2)n1)NCc1ccccc1Cl,C20424891_decoy,TRY1,Decoy,0,-9.37056,-8.69,-4.04,-7.358649491174949
CCOC(=O)[C@@](NC(=O)CCl)(Nc1ccc([C@](O)(C(=O)OC)C(F)(F)F)cc1)C(F)(F)F,C20609128_decoy,TRY1,Decoy,0,-7.45882,-5.44,-2.04,-5.262179417401571
COc1ccc(NC(=S)/N=C(\NCCc2ccc(F)cc2)Nc2nc(C)cc(C)n2)c(OC)c1,C14156010_decoy,TRY1,Decoy,0,-9.3733,-8.37,-1.24,-8.06946917711057
CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)CCNS(=O)(=O)c2ccc(C(C)C)cc2)c1,C22024575_decoy,TRY1,Decoy,0,-8.70465,-1.52,-2.29,-3.6481414065295374
NC(=O)CCc1nnc(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)n1Cc1ccco1,C22407995_decoy,TRY1,Decoy,0,-8.39874,-7.27,-2.12,-7.462486783310513
COCCNC(=O)c1c(NC(=O)COC(=O)[C@@H](C)NC(=O)C(C)(C)C)sc2c1CCCC2,C22525478_decoy,TRY1,Decoy,0,-10.3096,-6.51,-3.18,-7.001258289012479
NC(=O)CCn1c(SC[C@H](O)COc2ccc(-c3ccccc3)cc2)nnc1-c1ccco1,C22765316_decoy,TRY1,Decoy,0,-9.60918,-8.16,-2.66,-8.066974372203266
CCCCCN(C(=O)COc1cccc(Br)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C22992393_decoy,TRY1,Decoy,0,-8.2675,-4.68,-1.86,-5.368367286656573
CCOc1cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccccc2Cl)cc(OCC)c1OCC,C26957840_decoy,TRY1,Decoy,0,-8.52227,-6.81,-1.62,-6.758834176138489
CCOC(=O)C1=C(CSc2n[nH]c(/C=C/c3ccc(C)o3)n2)[C@@H](C(=O)OCC)[C@@H](N)S1,C38793071_decoy,TRY1,Decoy,0,-10.4784,-5.89,-3.07,-7.24621568716026
COc1cc(CCC(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc(OC)c1OC,C39586456_decoy,TRY1,Decoy,0,-11.4521,-6.39,-3.91,-6.694505521637197
CCCCCCOc1ccc([C@H]2c3c(-c4cc(Cl)c(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1,C39914023_decoy,TRY1,Decoy,0,-8.1265,-7.35,-2.01,-9.119895783245813
CCCCSc1nc2n(n1)[C@H](c1ccc(OCc3ccccc3F)c(OCC)c1)C(C(N)=O)=C(C)N2,C40986790_decoy,TRY1,Decoy,0,-9.0009,-6.73,-2.01,-7.784552886718913
CCCCn1c(N)c(N(Cc2ccco2)C(=O)COc2ccccc2[C@H](C)CC)c(=O)[nH]c1=O,C45727310_decoy,TRY1,Decoy,0,-8.49258,-7.03,-2.58,-6.319633919508631
CCOc1cc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)cc(OCC)c1OCC,C46899071_decoy,TRY1,Decoy,0,-8.53542,-7.18,-3.11,-6.386819125500167
CCOc1cc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCO)ccc1OCCC(C)C,C09409220_decoy,TRY1,Decoy,0,-8.66041,-5.2,-1.4,-5.669357290989636
CCCCOc1ccc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCO)cc1OCC,C09409216_decoy,TRY1,Decoy,0,-8.73425,-6.61,-3.79,-7.54422331689611
CCOC(=O)C1=C(C)N=C(C)/C(=C(/[O-])OCC)[C@H]1c1ccc(OC[C@@H](O)C[NH2+]C(C)(C)C)cc1C,C27712737_decoy,TRY1,Decoy,0,-8.04795,-5.18,-4.09,-5.316618633517405
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(C)\C=C\c3ccccc3)n2)s1,C59023413_decoy,TRY1,Decoy,0,-10.7142,-7.07,-3.16,-7.423620671142768
COc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccccc2OCc2ccccc2Cl)n1,C59038924_decoy,TRY1,Decoy,0,-9.85188,-8.25,-4.06,-7.521715574372058
COc1ccc(OC)c(/C=N/Nc2nc(SCC(=O)NCCc3ccc(Cl)cc3)n[nH]2)c1,C59310597_decoy,TRY1,Decoy,0,-10.4888,-6.2,-2.58,-6.464015317023113
CC(C)(C)c1ccc(OCC(=O)NC(=S)NCCNc2ccc(Cl)cc2[N+](=O)[O-])cc1,C59337275_decoy,TRY1,Decoy,0,-8.44435,-6.16,-2.41,-5.446034588442677
CCCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C(\C)CC(C)C)n3)cc2s1,C59891989_decoy,TRY1,Decoy,0,-10.0336,-7.77,-3.66,-9.30610790940244
CCCNC(=O)CSc1nnc(SCC(=O)Nc2ccc([NH+](CC)C(C)C)cc2)s1,C60384678_decoy,TRY1,Decoy,0,-9.90246,-6.57,-3.38,-7.072323306474215
CC(C)Cc1ccc([C@@H](C)C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1,C66199917_decoy,TRY1,Decoy,0,-10.2251,-5.18,-2.74,-6.71503681110213
C[NH2+][C@H](C(=O)N[C@@H]1C=C(C(=O)N[C@H](C)C(N)=O)C[C@@H](O)[C@@H]1O)C(C)C,C03839688_decoy,TRY1,Decoy,0,-8.28193,-6.31,-1.61,-6.858781095569508
O=c1[nH]cc(NCCNc2[nH+]cc(C(F)(F)F)cc2Cl)c(=O)[nH]1,C03116795_decoy,TRY1,Decoy,0,-6.65594,-7.23,-0.83,-6.561276570927171
O[C@@H]1[C@H](O)CO[C@](O)(C[NH+](Cc2ccccc2)Cc2ccccc2)[C@H]1O,C04350985_decoy,TRY1,Decoy,0,-5.4367,-6.16,-1.91,-4.621100029598736
C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)[NH3+])C(=O)Nc1ccc([N+](=O)[O-])cc1,C04533777_decoy,TRY1,Decoy,0,-7.57282,-6.2,-3.18,-5.921701719032223
C[C@H](NC(=O)[C@@H](C)NC(=O)[C@@H](C)[NH3+])C(=O)Nc1ccc([N+](=O)[O-])cc1,C04533779_decoy,TRY1,Decoy,0,-7.70593,-6.29,-3.45,-5.678445564770351
CC(=O)Nc1ccc(NC(=O)C[C@H]([NH2+]CCC[NH+](C)C)C(=O)[O-])cc1,C05257972_decoy,TRY1,Decoy,0,-6.52698,-6.35,-4.04,-5.304406184261538
CC(=O)Nc1ccc(NC(=O)C[C@@H]([NH2+]CCC[NH+](C)C)C(=O)[O-])cc1,C05257973_decoy,TRY1,Decoy,0,-7.58414,-5.9,-2.81,-6.113973501164892
COC(=O)c1c(NC(=O)C(=O)NCC[NH+](C)C)sc(C(N)=O)c1C,C09134797_decoy,TRY1,Decoy,0,-9.39729,-5.69,-2.71,-6.502479455650115
CC(C)NC(=O)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)NC3CC3)[NH+]2C1,C15708328_decoy,TRY1,Decoy,0,-7.31109,-5.34,-0.64,-5.174151514444407
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@@H](O)CO)C2=O,C19331341_decoy,TRY1,Decoy,0,-7.66706,-6.36,-0.83,-6.347752136597292
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@@H](O)CO)C2=O,C19331350_decoy,TRY1,Decoy,0,-8.24674,-6.15,-1.28,-6.797647203297067
C=CC[NH+](Cc1nc(N)nc(N(C)C)n1)Cc1nc(N)nc(N(C)C)n1,C28963572_decoy,TRY1,Decoy,0,-7.34628,-5.8,-1.86,-7.109366413205807
N#CCC(=O)NN/C([NH3+])=C\Sc1ncc(C(F)(F)F)cc1Cl,C20219080_decoy,TRY1,Decoy,0,-8.47986,-6.45,-3.79,-7.394111765232585
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)CO)C2=O,C19323154_decoy,TRY1,Decoy,0,-8.33524,-4.68,-1.11,-5.990820720993718
C[NH2+][C@H](C(=O)N[C@@H]1C=C(C(=O)N[C@H](C)C(N)=O)C[C@@H](O)[C@@H]1O)C(C)C,C39560947_decoy,TRY1,Decoy,0,-8.12039,-6.71,-2.85,-7.123239276451394
CCC(=O)N[C@@H]1NN[C@@H](CC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)S1,C39775238_decoy,TRY1,Decoy,0,-8.36947,-5.32,-1.87,-4.820178707822195
CCOCc1ccc(C(=O)NNC(=O)c2c[nH+]c3ccccc3c2N)o1,C40345913_decoy,TRY1,Decoy,0,-8.56976,-4.95,-0.75,-6.609579173755837
Cc1c(C(=O)NCCCn2cc[nH+]c2)oc2c1/C(=N/NC(N)=O)CCC2,C40824298_decoy,TRY1,Decoy,0,-7.70827,-7.16,-2.0,-5.848409612200761
Cc1c(NC(=O)C(=O)NCc2ccc[nH+]c2N(C)C)cccc1C(N)=O,C41639200_decoy,TRY1,Decoy,0,-7.5414,-7.35,-2.06,-7.380968680670063
Cc1c(NC(=O)C(=O)NCC[NH+]2C[C@H](C)C[C@H](C)C2)cccc1C(N)=O,C41725592_decoy,TRY1,Decoy,0,-8.42953,-7.4,-4.12,-6.149390736211399
CC(C)C[C@H]([NH3+])c1nc(C(=O)N[C@@H](Cc2c[nH]cn2)C(N)=O)cs1,C43209476_decoy,TRY1,Decoy,0,-8.26118,-7.26,-4.06,-7.441421442024856
CC(C)C[C@H]([NH3+])c1nc(C(=O)N[C@H](Cc2c[nH]cn2)C(N)=O)cs1,C43209478_decoy,TRY1,Decoy,0,-10.0716,-6.33,-2.52,-7.862707996783073
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2nnc(Nc3ccccc3)o2)co1,C44163254_decoy,TRY1,Decoy,0,-8.14496,-9.27,-2.35,-7.7124189497647295
NC(=O)C[C@@H]([NH3+])c1ccc(Sc2ccc(Cl)cc2)c([N+](=O)[O-])c1,C44253758_decoy,TRY1,Decoy,0,-7.30616,-6.05,-2.92,-6.448869284087263
N#C/C(=C\c1ccc([C@H]([NH3+])CC(N)=O)cc1)S(=O)(=O)c1ccccn1,C44254945_decoy,TRY1,Decoy,0,-9.64723,-7.44,-1.51,-7.992244728055645
COc1cc(C[NH2+]CCCS(N)(=O)=O)cc(Br)c1O,C45067046_decoy,TRY1,Decoy,0,-8.15195,-5.6,-1.82,-5.099208338268396
CCCn1c(N)c(C(=O)C[NH+]2CCC(C(N)=O)CC2)c(=O)n(C)c1=O,C45311365_decoy,TRY1,Decoy,0,-7.49342,-6.28,-3.26,-5.2259509677687
CCc1[nH]c(C(=O)NC2CC[NH+](CC(N)=O)CC2)c(C)c1C(=O)OC,C45891094_decoy,TRY1,Decoy,0,-8.50792,-6.17,-2.36,-6.428989189844398
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)NNC(=O)C(=O)NC2CC2)C1,C46763168_decoy,TRY1,Decoy,0,-7.46011,-6.26,-2.6,-6.021305831248212
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccco1,C47963707_decoy,TRY1,Decoy,0,-7.46363,-6.62,-1.91,-5.66109339026188
C[C@H]1CCC[NH+]([C@@H](C)CNC(=O)C(=O)Nc2sccc2C(N)=O)C1,C47999037_decoy,TRY1,Decoy,0,-8.44213,-6.75,-2.66,-5.806922820860516
Cc1c(NC(=O)C(=O)NCC2([NH+](C)C)CCCCC2)cccc1C(N)=O,C48722015_decoy,TRY1,Decoy,0,-8.3312,-5.23,-1.23,-5.469589377976481
CCn1c(N)c(C(=O)C[NH+]2CCC[C@H](C(=O)NC3CC3)C2)c(=O)[nH]c1=O,C51047005_decoy,TRY1,Decoy,0,-7.29022,-7.55,-2.49,-6.893150736311725
NC(=O)c1ccsc1NC(=O)C[NH+]1CCC[C@@H](C(=O)NC2CC2)C1,C51047855_decoy,TRY1,Decoy,0,-7.8646,-6.56,-4.32,-7.61204768940051
CC1CCC2(CC1)NC(=O)N(NC(=O)C[NH+](CC(N)=O)C(C)C)C2=O,C14927577_decoy,TRY1,Decoy,0,-8.31486,-5.32,-3.19,-6.968670021499075
Cc1cc(=O)[nH]c(NCCNC(=O)C[C@H]2C(=O)NCC[NH+]2C(C)C)n1,C55359470_decoy,TRY1,Decoy,0,-7.78192,-6.88,-1.91,-6.422687710706829
NC(=O)NCCCCC(=O)Nc1ccccc1C[NH+]1CCSCC1,C61572556_decoy,TRY1,Decoy,0,-7.09948,-6.37,-1.05,-7.4459340218217696
COC(=O)C[C@H](C)C[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C61830740_decoy,TRY1,Decoy,0,-7.79577,-5.15,-1.32,-5.553401325299088
NC1=C2C(=N[C@@H](NCCCO)C3=C2CCN(Cc2ccccc2)C3)N=[NH+]1,C38574170_decoy,TRY1,Decoy,0,-11.01,-7.76,-0.5,-10.687426878763942
CC1=NNNN1c1cccc(NC(=O)C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)c1,C63795759_decoy,TRY1,Decoy,0,-8.62793,-9.07,-3.91,-7.146481069325716
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc(=O)[nH]c2ccccc12,C64885369_decoy,TRY1,Decoy,0,-7.43237,-7.75,-3.87,-6.571797814828685
CC1CC[NH+]([C@@H](C)CNC(=O)C(=O)Nc2sccc2C(N)=O)CC1,C65601638_decoy,TRY1,Decoy,0,-8.19485,-6.19,-1.17,-6.883279208588183
COc1cccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)c1OC(C)C,C66115435_decoy,TRY1,Decoy,0,-7.00014,-6.5,-1.47,-7.398915348577188
CCc1[nH]c(C(=O)N[C@@H]2CCC[NH+](CC(N)=O)C2)c(C)c1C(=O)OC,C66451821_decoy,TRY1,Decoy,0,-8.20894,-6.6,-2.12,-7.905025563832949
NC(=O)C1CC[NH+](CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)CC1,C66862598_decoy,TRY1,Decoy,0,-8.43772,-5.24,-2.07,-4.980655970675742
C[C@H]1CCC[NH+](C[C@@H](C)NC(=O)C(=O)Nc2sccc2C(N)=O)C1,C67397814_decoy,TRY1,Decoy,0,-8.34266,-6.41,-3.41,-6.58377141484787
Cc1ccc(NC(=O)C(=O)NCC[NH+]2C[C@H](C)C[C@H](C)C2)cc1C(N)=O,C67497818_decoy,TRY1,Decoy,0,-8.09142,-5.48,-1.61,-5.924204384551818
Cc1cc(C)c(CNC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c(=O)[nH]1,C67610872_decoy,TRY1,Decoy,0,-7.44305,-7.12,-4.21,-5.904564783974933
Cc1cc(C)c(CNC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c(=O)[nH]1,C67610875_decoy,TRY1,Decoy,0,-7.74734,-7.56,-1.36,-7.51462195965826
CC1CC[NH+](C[C@H](O)CNC(=O)NCCC(=O)NC2CCCC2)CC1,C67632685_decoy,TRY1,Decoy,0,-8.22369,-5.85,-2.08,-5.921991294613019
CC(C)CNC(=S)N[C@H]1C[C@@](O)(C(=O)NCC(N)=O)C[C@@H](O)[C@@H]1O,C03838739_decoy,TRY1,Decoy,0,-9.30752,-3.94,-2.55,-5.869262577386943
O=C1c2ccccc2C(=O)c2c(O)c(NCCC[NH2+]CCO)cc(O)c21,C05390383_decoy,TRY1,Decoy,0,-7.85054,-6.0,-2.86,-5.765187540295478
Nc1nc(Cl)c(N)c(NC[C@]2(CO)CC[C@@H](OCc3ccccc3)C2)n1,C01645761_decoy,TRY1,Decoy,0,-8.01283,-6.18,-2.06,-5.247707581035747
CSCC[C@@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C,C05701853_decoy,TRY1,Decoy,0,-8.05192,-6.19,-1.4,-6.806961052691746
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C,C05701856_decoy,TRY1,Decoy,0,-7.79997,-6.84,-2.03,-7.818065940862303
C[NH2+]Cc1cn(C[C@H]2O[C@@H](CC(=O)NCC[NH+](C)C)[C@H](O)[C@@H]2O)nn1,C08643695_decoy,TRY1,Decoy,0,-5.96879,-6.26,-1.49,-6.243916189765139
Cc1ccc(OC/C(=C/C=O)Nc2cc(C[C@@H]([NH3+])C(=O)[O-])c(O)cc2O)cc1,C12502242_decoy,TRY1,Decoy,0,-6.92231,-7.33,-4.22,-6.807080424768943
Cc1ccc(OC/C(=C/C=O)Nc2cc(C[C@H]([NH3+])C(=O)[O-])c(O)cc2O)cc1,C12502244_decoy1,TRY1,Decoy,0,-8.12314,-7.13,,-7.468289157854782
NNC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C04534199_decoy,TRY1,Decoy,0,-8.88532,-6.35,-2.91,-7.331648601227872
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)c1nnc(Nc2ccc(Cl)cc2)s1,C15775179_decoy,TRY1,Decoy,0,-9.09128,-4.67,-2.16,-5.199127679237984
OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)c1nnc(Nc2ccc(Cl)cc2)s1,C15775183_decoy,TRY1,Decoy,0,-8.79193,-6.75,-2.76,-7.130900839793516
NC(=S)NNCn1c(=S)sc(=S)n1CNNC(N)=S,C16136379_decoy,TRY1,Decoy,0,-9.93401,-5.99,-2.3,-9.275615284803129
NC(=O)NCOC(=S)SSSC(=S)OCNC(N)=O,C04428869_decoy,TRY1,Decoy,0,-8.46032,-5.55,-1.27,-7.189235765229244
CCC[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19322200_decoy,TRY1,Decoy,0,-8.30582,-7.28,-1.49,-8.247747773642313
CC[C@]12CN3C[C@](CC)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323239_decoy,TRY1,Decoy,0,-7.93214,-6.35,-1.06,-6.699249666427164
CC[C@]12CN3C[C@](CC)(C[NH+](C1)[C@@H]3[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323242_decoy,TRY1,Decoy,0,-7.62475,-4.99,-1.21,-5.510342096128546
CC[C@]12CN3C[C@](CC)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323243_decoy,TRY1,Decoy,0,-7.3278,-4.73,-1.41,-4.566205694255266
CC[C@]12CN3C[C@](CC)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323246_decoy,TRY1,Decoy,0,-8.16099,-4.43,-1.46,-5.751388323627272
CCCSc1nnc(NC(=O)CSc2nnc(NN)n2N)s1,C21036185_decoy,TRY1,Decoy,0,-9.02939,-6.97,-1.49,-8.65965901764251
CC(=O)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22066577_decoy,TRY1,Decoy,0,-4.40807,-4.69,-3.73,-4.087870094525627
CC[C@@H]([NH2+]C[C@@H](O)Cn1cc(/C=N/NC(N)=O)c2ccccc21)C(=O)[O-],C28295716_decoy,TRY1,Decoy,0,-7.76935,-5.08,-3.39,-5.228960911132308
CC[C@H]([NH2+]C[C@@H](O)Cn1cc(/C=N/NC(N)=O)c2ccccc21)C(=O)[O-],C28295718_decoy,TRY1,Decoy,0,-6.85451,-6.65,-2.89,-6.587083410529603
CC[C@@H]([NH2+]C[C@H](O)Cn1cc(/C=N/NC(N)=O)c2ccccc21)C(=O)[O-],C28295720_decoy,TRY1,Decoy,0,-7.07841,-6.68,-2.36,-5.2024085459132925
CC[C@H]([NH2+]C[C@H](O)Cn1cc(/C=N/NC(N)=O)c2ccccc21)C(=O)[O-],C28295721_decoy,TRY1,Decoy,0,-5.31746,-6.75,-2.58,-4.596559842739424
CC(=O)N[C@H](C(=O)NC[C@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C33782166_decoy,TRY1,Decoy,0,-6.16649,-5.19,-1.54,-5.018623350075411
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C35643696_decoy,TRY1,Decoy,0,-6.9408,-5.2,-2.53,-5.0872751285185736
CC(=O)N[C@H](C(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C35643707_decoy,TRY1,Decoy,0,-6.08108,-4.96,-3.56,-4.446108734990991
CC(=O)OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C35653153_decoy,TRY1,Decoy,0,-4.84557,-5.71,-3.77,-4.853226107136654
CCOC(=O)/C(NC(CO)(CO)CO)=[NH+]/Nc1ccc([N+](=O)[O-])cc1,C28294279_decoy,TRY1,Decoy,0,-6.43195,-4.17,-2.25,-4.6527405197637774
O=C(CCC(=O)N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C01956053_decoy,TRY1,Decoy,0,-9.46241,-8.57,-4.33,-8.0939016017405
COc1cc(C(=O)N/N=C/[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc(OC)c1OC,C39774303_decoy,TRY1,Decoy,0,-9.20917,-5.39,-3.56,-5.620387647306747
CCCCOc1c(/C(N)=N/O)c(/C(N)=N/O)c(OCCCC)c2ccccc12,C16082813_decoy,TRY1,Decoy,0,-6.39799,-5.61,-3.25,-6.326050989691739
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@@H](O)[C@H](O)CO,C40151164_decoy,TRY1,Decoy,0,-7.42942,-6.88,-2.99,-5.840666147652958
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)c1nnc(Nc2ccc(Cl)cc2)s1,C40151280_decoy,TRY1,Decoy,0,-8.93216,-6.01,-0.78,-6.3323205180132245
Nc1nccc2c1ncn2[C@H]1C[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C40828019_decoy,TRY1,Decoy,0,-9.36367,-6.87,-0.64,-10.34507621679066
Nc1nccc2c1ncn2[C@H]1C[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C40828025_decoy,TRY1,Decoy,0,-9.57809,-6.76,-1.46,-7.819722124607702
Nc1nccc2c1ncn2[C@H]1C[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C40828025_decoy,TRY1,Decoy,0,-9.57809,-6.76,-2.01,-7.819722124607702
CCCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41301814_decoy,TRY1,Decoy,0,-7.12402,-7.29,-2.53,-8.850233535020875
CCCNC(=O)C[NH+]1CCC(NC(=O)[C@@H](NC(N)=O)[C@H](C)CC)CC1,C41405433_decoy,TRY1,Decoy,0,-7.06825,-5.43,-3.91,-5.169356453635627
CC(=O)N[C@H](C(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C44608332_decoy,TRY1,Decoy,0,-6.35546,-5.45,-3.23,-4.90892094729381
CCCCC[C@@H](C)CNC(=S)NNC(=O)[C@H](CCSC)NC(N)=O,C61483835_decoy,TRY1,Decoy,0,-9.75444,-5.31,-3.67,-7.148214232670941
CCOC(=O)[C@H]1NNN(c2nonc2N)[C@@H]1CS[C@@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C63514335_decoy,TRY1,Decoy,0,-7.51252,-7.38,-1.3,-6.554424523891467
NC(=O)N[C@@H](CC(=O)NNC(=S)NCC(F)(F)F)c1cccs1,C64082014_decoy,TRY1,Decoy,0,-7.44521,-6.17,-0.91,-6.619241587400989
Cc1ccc(OC/C(=C\C=O)Nc2cc(C[C@H]([NH3+])C(=O)[O-])c(O)cc2O)cc1,C12502244_decoy2,TRY1,Decoy,0,-8.35821,-6.74,,-5.991204112144231
CC(=O)OC[C@@H]1O[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C65748741_decoy,TRY1,Decoy,0,-5.18337,-5.52,-1.16,-4.364335512949909
C[C@H](NC(=S)NNC(=O)[C@@H](C)NC(N)=O)c1ccc(Cl)cc1Cl,C66122092_decoy,TRY1,Decoy,0,-7.77426,-7.19,-4.46,-6.971878268525281
C[C@@H](NC(N)=O)C(=O)NNC(=S)N[C@H](C)c1ccc(Cl)cc1Cl,C66122093_decoy,TRY1,Decoy,0,-7.65235,-7.15,-2.67,-5.568412246533856
C[C@H](NC(N)=O)C(=O)NNC(=S)N[C@@H](C)c1ccc(Cl)cc1Cl,C66122094_decoy,TRY1,Decoy,0,-8.58879,-6.62,-3.18,-5.942400122269835
C[C@H](NC(N)=O)C(=O)NNC(=S)N[C@H](C)c1ccc(Cl)cc1Cl,C66122095_decoy,TRY1,Decoy,0,-8.60924,-7.08,-3.12,-6.320841208191975
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C(C)C,C66122773_decoy,TRY1,Decoy,0,-8.81322,-5.24,-2.81,-7.008154681280592
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=S)Nc1ccccc1C(C)C,C66123217_decoy,TRY1,Decoy,0,-7.55531,-6.98,-1.76,-7.645964571947134
CC(C)(C)[NH2+]Cc1cc(O)c(C[NH2+]C(C)(C)C)cc1O,C01680953_decoy,TRY1,Decoy,0,-6.55764,-5.99,-2.68,-5.124891156474493
CC12C[NH+](CC(N)=O)CC(C)(C[NH+](CC(N)=O)C1)C2,C12296712_decoy,TRY1,Decoy,0,-6.80014,-5.18,-3.63,-2.918799278234887
C[NH+](Cc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH3+],C20465931_decoy,TRY1,Decoy,0,-5.63724,-4.46,-1.27,-3.714250786065608
[NH3+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCC[C@H](O)C1,C36128465_decoy,TRY1,Decoy,0,-7.9658,-5.96,-2.38,-5.324574465001593
CNC(=O)NC(=O)[C@@H](C)N1CC[NH+](C[C@H](C)C[NH3+])CC1,C37049106_decoy,TRY1,Decoy,0,-7.67935,-5.79,-2.67,-5.254471877618617
[NH3+]Cc1ccccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C37049994_decoy,TRY1,Decoy,0,-7.68051,-4.5,-2.16,-4.451481358809881
CC[C@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC[C@H](C(N)=O)C2)C1,C37157756_decoy,TRY1,Decoy,0,-8.58507,-4.14,-0.82,-5.009229842070908
CCC[C@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC[C@@H]2C(N)=O)C1,C37158879_decoy,TRY1,Decoy,0,-7.49462,-4.49,0.08,-4.560365128628104
CCC[C@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2CCC[C@@H]2C(N)=O)C1,C37158883_decoy,TRY1,Decoy,0,-7.13439,-4.21,-1.12,-4.574470353907223
CCC[NH+](Cc1nc(N)nc(N)n1)C1CC[NH2+]CC1,C37539151_decoy,TRY1,Decoy,0,-7.15008,-6.79,-2.38,-7.284263246449216
CCCC[NH+]1CCC(NC(=O)CNC(=O)C[NH3+])CC1,C37626860_decoy,TRY1,Decoy,0,-8.33278,-4.55,-3.31,-5.165636402544794
CCCC[NH+]1CCC(NC(=O)[C@@H]([NH3+])CC(N)=O)CC1,C37626862_decoy,TRY1,Decoy,0,-9.22693,-5.73,-3.02,-8.204832901041094
CC(C)(C)[NH2+]CCC(=O)NC1CC[NH+](CC(N)=O)CC1,C37634724_decoy,TRY1,Decoy,0,-7.96901,-4.93,-3.83,-5.014494947552381
C[C@H](CNC(=O)CNC(=O)C[NH3+])C[NH+]1CCCCC1,C38042261_decoy,TRY1,Decoy,0,-7.77522,-4.18,-1.0,-4.809135118646777
C[C@@H]1CCC[C@](C[NH2+]CC(=O)NC(N)=O)([NH+](C)C)C1,C40669715_decoy,TRY1,Decoy,0,-6.42178,-6.16,-0.95,-8.300209744911994
Cc1cc(Nc2[nH+]cnc(Nc3cc[nH+]cc3)c2N)no1,C40680799_decoy,TRY1,Decoy,0,-6.04213,-7.27,-0.07,-8.618516553707279
CC1(C)CC(NC(=O)[C@@H]2C[C@@H](O)C[NH2+]2)CC(C)(C)[NH2+]1,C40810414_decoy,TRY1,Decoy,0,-7.46393,-4.47,-0.85,-4.1200854766321005
CC1(C)CC(NC(=O)[C@](C)([NH3+])C2CC2)CC(C)(C)[NH2+]1,C40810429_decoy,TRY1,Decoy,0,-6.86917,-3.98,-1.01,-4.01021834250448
CC1(C)CC(NC(=O)C2([NH3+])CCCC2)CC(C)(C)[NH2+]1,C40810431_decoy,TRY1,Decoy,0,-8.38803,-4.2,-2.33,-4.4970810587926
CCC[C@@](C)([NH3+])C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C40810439_decoy,TRY1,Decoy,0,-6.75,-4.58,-1.21,-4.1336436966017205
NC(=O)C[NH+](C1CCCC1)[C@H]1CCCCC[C@@H]1C[NH3+],C42428531_decoy,TRY1,Decoy,0,-8.10441,-3.96,-1.8,-5.065086589903609
CC(C)[NH+](CC(N)=O)[C@H]1C[C@H](C(C)(C)C)CC[C@@H]1C[NH3+],C42428615_decoy,TRY1,Decoy,0,-7.25932,-5.04,-1.79,-5.138843071812212
CC[C@@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+](C)CC(N)=O,C42944945_decoy,TRY1,Decoy,0,-7.29448,-4.39,-0.16,-4.826248584826733
CC[C@@H]([NH3+])[C@@H](c1ccccc1Cl)[NH+](C)CC(N)=O,C43051351_decoy,TRY1,Decoy,0,-7.1785,-4.2,-1.88,-4.894363547956882
CC[C@@H]([NH3+])[C@@H](c1cnn(C)c1)[NH+](CC(N)=O)C(C)C,C43231659_decoy,TRY1,Decoy,0,-6.31665,-3.8,-1.49,-4.019962454452493
CC[C@@H]([NH3+])[C@H](c1cnn(C)c1)[NH+](CC(N)=O)C(C)C,C43231664_decoy,TRY1,Decoy,0,-6.62739,-3.47,-4.14,-4.142832958235654
CC[C@@H]([NH3+])[C@H]([NH+]1CCC(CC(N)=O)CC1)C(C)(C)C,C43294157_decoy,TRY1,Decoy,0,-6.73159,-4.6,-1.38,-4.73323659225605
CC[C@@H]([NH3+])[C@@H]([NH+]1CCC(CC(N)=O)CC1)C(C)(C)C,C43294161_decoy,TRY1,Decoy,0,-7.16449,-6.1,-1.07,-9.37987276132252
C[C@H]([NH3+])[C@@H](c1ccco1)[NH+]1CCC(CC(N)=O)CC1,C43336029_decoy,TRY1,Decoy,0,-7.82529,-4.28,-1.4,-4.61868910361533
CC(C)C[NH+](CC(N)=O)Cc1cc(C#CC[NH3+])cs1,C43689123_decoy,TRY1,Decoy,0,-8.93187,-5.32,-3.36,-5.514941790662318
CC[C@H]([NH3+])C[C@H]1C(=O)N(C)C(=O)N(C)[C@H]1[C@H]([NH3+])CC,C44406176_decoy,TRY1,Decoy,0,-6.80979,-4.4,-0.77,-4.879288452547439
C[C@H]([NH3+])Cc1ccc(-c2ccc(C[C@@H](C)[NH3+])cn2)nc1,C44461044_decoy,TRY1,Decoy,0,-9.57677,-6.55,-1.27,-8.443237415054117
[NH3+][C@@H](CO)CC(C[C@@H]([NH3+])CO)c1cnc2ccccc2n1,C44466677_decoy,TRY1,Decoy,0,-9.99028,-5.34,-3.28,-9.990538860486357
CN(C)c1nc(N)nc(C[NH+]2CCC(C[NH3+])CC2)n1,C44513454_decoy,TRY1,Decoy,0,-8.22969,-5.57,-3.09,-5.611672821810452
Cc1n[nH]c(C)c1NC(=O)C[NH+]1CCC[C@H](C[NH3+])C1,C44529371_decoy,TRY1,Decoy,0,-8.47075,-4.49,-0.79,-4.559699565676147
CC(C)(C)NC(=O)NC(=O)C[NH+]1CCC[C@H](C[NH3+])C1,C44529560_decoy,TRY1,Decoy,0,-9.16787,-6.27,-1.69,-8.419470920086084
C[C@@H]1C[NH+]=C(NCC(C)(C)CNC2=[NH+]C[C@H](C)N2)N1,C44549871_decoy,TRY1,Decoy,0,-7.78207,-4.95,-1.86,-8.036440926570748
C[C@@H]1CCCC[C@H]1[NH+](C)CCCC[C@](C)([NH3+])C(N)=O,C45423581_decoy,TRY1,Decoy,0,-8.38871,-5.04,-2.73,-5.126245010847956
C[C@@]([NH3+])(CCCC[NH+]1CCO[C@H]2CCCC[C@@H]21)C(N)=O,C45425722_decoy,TRY1,Decoy,0,-7.44713,-4.92,-0.79,-4.5641965254069214
CC(C)(C)C1CC[NH+](CCC[C@](C)([NH3+])C(N)=O)CC1,C50348343_decoy,TRY1,Decoy,0,-8.61196,-5.5,-0.53,-11.417530237546314
[NH3+]CC[NH2+]C[C@@H](O)COc1ccc(Cl)c(Cl)c1,C50523461_decoy,TRY1,Decoy,0,-8.78517,-5.57,-1.26,-6.832464727098583
CC[NH2+][C@@H](C)CC(=O)NC1CC[NH+](CC(N)=O)CC1,C61271116_decoy,TRY1,Decoy,0,-7.8425,-3.99,-1.28,-4.824121011288956
[NH3+]Cc1ccccc1OC[C@H](O)C[NH+]1CC[C@H](O)C1,C61710199_decoy,TRY1,Decoy,0,-7.69958,-4.44,-1.52,-5.035098957806986
Cc1sc2ncnc(N(CC[NH3+])CC[NH3+])c2c1C,C61806440_decoy,TRY1,Decoy,0,-7.97487,-3.78,-2.31,-6.494418651571307
C[C@@](N)(C[NH+]1CCC(C[NH+]2CCCC2)CC1)C(N)=O,C62035043_decoy,TRY1,Decoy,0,-8.46491,-3.76,-0.54,-4.833662981693963
C[C@@]([NH3+])(CCCCN1CCn2cc[nH+]c2C1)C(N)=O,C62320351_decoy,TRY1,Decoy,0,-7.24169,-4.23,-2.02,-4.166008887595171
NC(=O)[C@@H](N)CC[NH+]1CCC(C[NH+]2CCCC2)CC1,C62533778_decoy,TRY1,Decoy,0,-7.96648,-6.61,-2.05,-6.831668032920617
NC(=O)NC(=O)CC[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1,C63200943_decoy,TRY1,Decoy,0,-7.99029,-5.28,-3.25,-5.164570730220325
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)C1[NH+]=c2ccccc2=[NH+]1,C63203288_decoy,TRY1,Decoy,0,-6.6594,-5.95,-0.94,-6.037950421202821
CS[C@@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63804891_decoy,TRY1,Decoy,0,-7.47843,-4.92,-1.05,-4.347840066184238
CC1(C)CC(O)(C#CC#CC2(O)CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C02491625_decoy,TRY1,Decoy,0,-10.1534,-5.14,-2.71,-3.1544439231816983
NNC(=O)[C@H]1C[C@@H]2C[C@@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@H]2C[C@H]1O,C04580246_decoy,TRY1,Decoy,0,-6.49339,-6.1,-1.12,-3.913129384514891
C[C@@]12Cc3[nH+]c4ccccc4c(N)c3[C@]1(C)Cc1[nH+]c3ccccc3c(N)c12,C04648868_decoy,TRY1,Decoy,0,-6.91936,-6.43,-1.5,-3.020660462626535
NNC(=O)[C@@H]1C[C@@H]2C[C@@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2C[C@H]1O,C01097276_decoy,TRY1,Decoy,0,-8.01735,-6.34,-0.58,-4.962486510210666
CC1(C)CC(O)(C2(O)CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C00198752_decoy,TRY1,Decoy,0,-7.27865,-4.54,-1.23,-3.960666929489085
CC[NH+]1CCC([NH2+]CCCCCc2n[nH]c(N)c2C#N)CC1,C08216972_decoy,TRY1,Decoy,0,-7.78375,-6.38,-2.07,-6.744950710079074
CC1(C)CNC(=O)[C@@]2(CCCO2)C[NH2+]C(C)(C)CNC(=O)[C@@]2(CCCO2)C[NH2+]1,C05741503_decoy,TRY1,Decoy,0,-7.03723,-5.71,-3.02,-3.826570927097973
Cc1[nH+][nH]c2c1[C@@H](c1cc(Cl)ccc1O)c1c([nH]c(=O)[nH]c1=O)N2,C31808590_decoy,TRY1,Decoy,0,-6.91124,-5.93,-1.4,-3.8737107430616713
[NH3+]C[C@@H](c1ccc(O)cc1O)N1CCN(c2cccc[nH+]2)CC1,C32070984_decoy,TRY1,Decoy,0,-9.53431,-5.68,-0.75,-6.271041233591003
Cc1[nH+][nH]c(N)c1[C@]1(O)C(=O)Nc2c(Cl)cc(Cl)cc21,C04864885_decoy,TRY1,Decoy,0,-7.68704,-4.88,-0.19,-3.847256954404252
Cc1[nH+][nH]c2c1[C@H](c1ccc(O)c(Cl)c1)c1c([nH]c(=O)[nH]c1=O)N2,C36353185_decoy,TRY1,Decoy,0,-7.08112,-5.35,-1.8,-3.949197309637624
C[NH+](CC(N)=O)CC(=O)Nc1c(N)cc(Cl)cc1Cl,C37268129_decoy,TRY1,Decoy,0,-8.22433,-5.17,-1.21,-4.947512747995514
CC[C@H]([NH2+]CCCC[NH3+])c1cc(Br)ccc1O,C37714906_decoy,TRY1,Decoy,0,-8.49355,-4.74,-1.86,-5.668863595692093
C[C@H](Cc1ccc(O)cc1)[NH2+]C[C@@H](O)c1cc(O)cc(O)c1,C00020252_decoy,TRY1,Decoy,0,-8.88716,-7.77,-1.77,-8.157608156699181
[NH3+][C@H]1NN[C@@H](CC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)S1,C39700557_decoy,TRY1,Decoy,0,-9.34594,-7.48,-0.26,-7.235566308974946
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1[nH+]cnc(NNc2ccccc2)c1N,C40688691_decoy,TRY1,Decoy,0,-8.62046,-6.54,-3.35,-7.436519643305388
CC(C)Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40708131_decoy,TRY1,Decoy,0,-7.61882,-5.04,-2.37,-5.158879643047783
Cc1ccc(Nc2[nH+]cnc(NNc3ccccc3)c2N)nc1,C40757591_decoy,TRY1,Decoy,0,-7.18133,-6.62,0.05,-6.140677636991375
NNc1[nH+]cnc(N(Cc2ccccc2)c2ccccn2)c1N,C40783882_decoy,TRY1,Decoy,0,-6.50213,-7.31,-2.37,-7.136250351217445
CCC[NH2+][C@H](C)c1ccc(Sc2nc(N)cc(N)n2)cc1,C41023828_decoy,TRY1,Decoy,0,-6.59096,-7.11,-1.08,-7.930759251468359
CCC[NH2+][C@@H](C)c1ccccc1Sc1nc(N)cc(N)n1,C41023849_decoy,TRY1,Decoy,0,-8.13131,-7.17,-1.42,-10.293354232465054
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(F)cc1,C42944069_decoy,TRY1,Decoy,0,-8.61528,-6.53,-2.01,-7.60593421839635
CC[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(F)cc1,C42944073_decoy,TRY1,Decoy,0,-7.52725,-6.46,-1.33,-5.375835229722648
CC[C@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+](CC(N)=O)CC(C)C,C42947091_decoy,TRY1,Decoy,0,-7.36019,-4.8,-4.16,-5.524055718103432
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)cc1,C42951451_decoy,TRY1,Decoy,0,-8.81807,-6.87,-1.18,-10.14921460260878
COc1ccc([C@H](Sc2nc(N)cc(=O)[nH]2)[C@H](C)[NH3+])cc1,C42965244_decoy,TRY1,Decoy,0,-8.00182,-6.68,-1.54,-7.699673757805831
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(C)c1,C42970477_decoy,TRY1,Decoy,0,-7.53059,-6.89,-1.31,-6.992489075539171
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1cccc(Cl)c1,C43019676_decoy,TRY1,Decoy,0,-8.34734,-7.16,-2.81,-6.852936132376568
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(Cl)c1,C43019692_decoy,TRY1,Decoy,0,-8.59544,-7.19,-0.95,-9.347214964803491
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1F,C43050379_decoy,TRY1,Decoy,0,-7.61948,-6.35,-1.41,-7.770584866989791
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1ccccc1Cl,C43090128_decoy,TRY1,Decoy,0,-7.61081,-7.27,-1.59,-7.323157971064352
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1Cl,C43090161_decoy,TRY1,Decoy,0,-8.63774,-6.95,-2.03,-9.344065860398022
COc1ccccc1[C@H](Sc1nc(N)cc(=O)[nH]1)[C@H](C)[NH3+],C43101998_decoy,TRY1,Decoy,0,-8.05739,-6.8,-1.65,-8.396830208035366
CC[C@@H]([NH3+])[C@H](c1ccc(Cl)s1)[NH+](CC(N)=O)C(C)C,C43253849_decoy,TRY1,Decoy,0,-8.03375,-3.53,-1.96,-4.738065622302669
Nc1cc(N)nc(S[C@H](C[NH3+])c2ccc(Cl)s2)n1,C43258274_decoy,TRY1,Decoy,0,-9.44805,-6.38,-1.78,-7.675147938575813
C[C@@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@H](O)CC[C@]43C)[C@H]1CC[C@@H]2[NH2+]CC[NH3+],C43741854_decoy,TRY1,Decoy,0,-9.555,-5.1,-1.73,-5.149270227640886
CC[C@@H]([NH3+])Cc1ccccc1Oc1ccccc1C[C@H]([NH3+])CC,C44400499_decoy,TRY1,Decoy,0,-8.5795,-5.32,-1.96,-6.515418453449799
CC[C@H]([NH3+])Cc1cc(C)c(-c2sc(C[C@@H]([NH3+])CC)cc2C)s1,C44403629_decoy,TRY1,Decoy,0,-12.5922,-5.37,-2.82,-7.680212512592367
CC[C@H]([NH3+])Cc1c2ccccc2c(C[C@H](C)[NH3+])c2ccccc12,C44409671_decoy,TRY1,Decoy,0,-7.27006,-6.79,-2.49,-4.984831984940693
CC(C)(C)CC(C)(C)c1ccc(OCC2CC2)c([C@@H]([NH3+])C[NH3+])c1,C44475860_decoy,TRY1,Decoy,0,-7.2544,-5.81,-1.92,-8.357414566411345
Cc1sc2nc(C[NH+]3CCC(C[NH3+])CC3)nc(N)c2c1C,C44513996_decoy,TRY1,Decoy,0,-9.5642,-6.68,-1.23,-8.935546487168057
Nc1cc(S(N)(=O)=O)ccc1N[C@@H]1CC[NH+]2CCCC[C@H]12,C49564187_decoy,TRY1,Decoy,0,-7.40138,-5.33,-4.2,-4.812289825179788
[NH3+]CCC[NH2+]C[C@@H](O)COc1ccc(Br)cc1,C51355947_decoy,TRY1,Decoy,0,-8.15868,-4.74,-3.54,-6.426153473918856
CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Br)ccc1O,C51693246_decoy,TRY1,Decoy,0,-9.22611,-6.83,-1.69,-11.306894019760758
CCc1[nH+]c(N)nc(N)c1-c1ccc(Cl)c(N/N=N\C)c1,C13762613_decoy,TRY1,Decoy,0,-8.74643,-8.35,-0.99,-12.282136608328496
CC1=[NH+][C@H](NC(=O)NC[C@@H]2[NH+]=c3ccc(F)cc3=[NH+]2)SN1,C63844898_decoy,TRY1,Decoy,0,-7.0276,-5.29,-1.33,-5.092427407558409
CC(C)S[C@@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C64428565_decoy,TRY1,Decoy,0,-6.44696,-5.35,-1.76,-4.228930481586379
O=C(C[NH2+]C[C@@H]1NN=C2CCCN21)NC1[NH+]=c2ccccc2=[NH+]1,C65372747_decoy,TRY1,Decoy,0,-6.29591,-7.85,-3.84,-6.265036424760054
O=C(C[NH2+][C@H]1CCCCNC1=O)NC1[NH+]=c2ccccc2=[NH+]1,C65395946_decoy,TRY1,Decoy,0,-6.80829,-7.43,-0.86,-5.454750728999065
NC(=O)[C@@H]1CCC[NH+](CC(=O)NC2[NH+]=c3ccccc3=[NH+]2)C1,C65407223_decoy,TRY1,Decoy,0,-6.94471,-6.37,-3.38,-6.156027670115243
OC[C@H]1O[C@H](Nc2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@@H]1O,C04042354_decoy,TRY1,Decoy,0,-6.20233,-1.17,-2.05,-2.332477234944856
Cc1ccccc1-c1nc2c(N)nc(N)nc2nc1N,C01566879_decoy,TRY1,Decoy,0,-6.52559,-7.81,-0.6,-10.453985646099454
Nc1ccc(Oc2ccc(-c3nc(N)nc(N)n3)cc2)cc1,C00317144_decoy,TRY1,Decoy,0,-7.77373,-7.8,-0.94,-10.456734253280386
C=CCNC(=S)NNc1nc(C(=O)NN)cs1,C03768026_decoy,TRY1,Decoy,0,-7.74541,-4.18,-0.45,-4.924136370402835
OCCCC[C@H](O)[C@@H](O)[C@](O)(CO)CCCCO,C04578416_decoy,TRY1,Decoy,0,-7.18926,-4.42,-1.63,-5.299427976605866
OC[C@@H]1O[C@@H](Nc2ccc(O)cc2)[C@H](O)[C@H](O)[C@@H]1O,C04600907_decoy,TRY1,Decoy,0,-5.50217,-6.8,-1.19,-5.911977309192551
CCc1nc(N)nc(N)c1-c1ccc(N(C)C)c(N)c1,C01591449_decoy,TRY1,Decoy,0,-7.11953,-7.27,-0.79,-10.344359299208516
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)/C=N/Nc1ccccc1,C04691991_decoy,TRY1,Decoy,0,-7.08755,-4.71,-2.49,-4.67527035643831
Cc1cc(N)c(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1C,C04707125_decoy,TRY1,Decoy,0,-5.82753,-5.02,-1.05,-3.824767751426776
NC(=O)c1cc2ccc(O)cc2o/c1=N/NC(N)=S,C04750951_decoy,TRY1,Decoy,0,-7.1434,-6.28,-1.79,-6.436242777654349
Nc1ccccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04762498_decoy,TRY1,Decoy,0,-5.55938,-6.91,-1.26,-5.965933629379129
C[C@H]1CCc2c(sc3nc(NN)nc(NN)c23)C1,C00506272_decoy,TRY1,Decoy,0,-7.98987,-4.65,-0.77,-4.917391493390496
C[C@H]1CCCc2sc3nc(NN)nc(NN)c3c21,C00550293_decoy,TRY1,Decoy,0,-8.27507,-7.07,-2.86,-7.986684338300456
Oc1cc(O)c(Oc2cc(O)c(O)c(O)c2)c(O)c1,C05351362_decoy,TRY1,Decoy,0,-8.56653,-8.07,-0.76,-9.133418514707357
Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C12503323_decoy,TRY1,Decoy,0,-6.04858,-7.14,-0.94,-6.832103827251819
Nc1nc(N)c2ncn([C@@H]3C[C@H](O)[C@H](CO)O3)c2n1,C04877169_decoy,TRY1,Decoy,0,-6.86204,-6.86,-0.32,-7.928497980542765
OC[C@@H]1O[C@H](Nc2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@@H]1O,C13549792_decoy,TRY1,Decoy,0,-6.51121,-7.56,-1.86,-6.768816405857985
Nc1nc(N)c2ncn([C@H]3C[C@@H](O)[C@@H](CO)O3)c2n1,C05975235_decoy,TRY1,Decoy,0,-6.34058,-5.6,-0.85,-4.068123014445096
Cc1cc(N)c(NC[C@@H](O)[C@H](O)[C@@H](O)CO)cc1C,C16922785_decoy,TRY1,Decoy,0,-6.99764,-5.31,-2.08,-6.728785474757057
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N\Nc1ccccc1,C17058754_decoy,TRY1,Decoy,0,-7.04354,-7.33,-2.2,-7.263376461782975
CN1CCc2c(sc3nc(NN)nc(NN)c23)C1,C20813746_decoy,TRY1,Decoy,0,-8.18255,-7.12,-1.22,-11.199793142240992
N#Cc1c(N)nc2sc(C(N)=O)c(N)c2c1-c1ccco1,C21630119_decoy,TRY1,Decoy,0,-7.44135,-7.64,-0.82,-9.32760877086473
Nc1nc(N)c(/N=N/c2ccc(Cl)cc2)c(N)n1,C25493226_decoy,TRY1,Decoy,0,-7.59749,-8.45,-0.12,-9.498884732611415
CCCC[C@@H](CC)CNC(=O)NC(C(N)=O)C(N)=O,C29732165_decoy,TRY1,Decoy,0,-7.54851,-5.63,-1.7,-6.635518643099411
Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1,C33358900_decoy,TRY1,Decoy,0,-5.30473,-7.06,-1.91,-5.930535333462524
CNc1ccc(O)c2c1[C@@H](O)c1c(O)ccc(N)c1[C@H]2O,C33610816_decoy,TRY1,Decoy,0,-7.6521,-7.03,-0.23,-6.384777154278431
Nc1nc(N)c2c(n1)[C@H]([C@@H]1C[C@H](O)[C@@H](CO)O1)C=N2,C35024561_decoy,TRY1,Decoy,0,-7.07518,-6.37,-0.52,-4.668975354988089
Nc1ccc(SCc2nc(N)nc(N)n2)c(Cl)c1,C37204722_decoy,TRY1,Decoy,0,-7.54645,-6.43,-0.95,-8.42998544789584
NC(=O)CCCNc1cc2c(cc1N)NC(=O)CC2,C37658450_decoy,TRY1,Decoy,0,-7.76111,-6.96,-1.06,-7.075139835855722
N/C(=N\O)c1c(F)c(F)c(/C(N)=N\O)c(F)c1F,C16082816_decoy,TRY1,Decoy,0,-7.81425,-7.57,-0.29,-13.238444033961198
NNc1ncnc(Nc2cccc3ncccc23)c1N,C40783869_decoy,TRY1,Decoy,0,-6.80254,-7.82,-0.7,-6.961122898206918
NNc1ncnc(NCc2ccccc2Cl)c1N,C40783904_decoy,TRY1,Decoy,0,-7.47063,-7.2,-0.48,-10.29312963294568
Nc1ccc(O)c(CSc2nc(N)cc(N)n2)c1,C41023523_decoy,TRY1,Decoy,0,-8.37911,-6.78,-3.3,-7.57905112355851
C[C@H](Sc1nc(N)cc(N)n1)c1ccc(N)cc1,C41023572_decoy,TRY1,Decoy,0,-7.61149,-7.05,-0.84,-6.716770666590068
CCCCCNC(=S)NNC(=O)CNC(N)=O,C41299486_decoy,TRY1,Decoy,0,-6.69588,-5.64,-1.21,-10.074034800493893
C=CCNC(=S)NNC(=O)[C@@H](NC(N)=O)C(C)C,C41961970_decoy,TRY1,Decoy,0,-6.50568,-3.78,-1.66,-4.16732706195418
C[C@@H]1CC[C@@H](C(N)=O)CN1c1ccc(N)c(C(N)=O)c1,C42441050_decoy,TRY1,Decoy,0,-7.00708,-6.48,-2.4,-6.106692652440918
NC(=O)CCNC(=O)C1(/C(N)=N/O)CCCCCC1,C44785258_decoy,TRY1,Decoy,0,-7.09807,-4.93,-0.83,-4.930755847806685
NC(=O)CCCNC(=O)C1(/C(N)=N/O)CCOCC1,C44785506_decoy,TRY1,Decoy,0,-6.98494,-6.34,-2.66,-7.196728139397549
CC[C@@H](C(=O)NCCCS(N)(=O)=O)/C(N)=N/O,C45091472_decoy,TRY1,Decoy,0,-7.32142,-5.49,-2.14,-7.586112546082079
CC(C)(Nc1cc2c(cc1N)NC(=O)CC2)C(N)=O,C45106242_decoy,TRY1,Decoy,0,-6.70663,-5.35,-1.45,-3.91926957907795
CC(C)(Nc1cc2c(cc1N)OCC(=O)N2)C(N)=O,C45106259_decoy,TRY1,Decoy,0,-7.08687,-4.83,-0.03,-3.879177306032388
C[C@H](NC(N)=O)C(=O)NNC(=O)NCC(F)(F)F,C48832052_decoy,TRY1,Decoy,0,-5.66424,-7.17,-0.98,-6.528643207867408
CCCCNC(=O)NNC(=O)[C@@H](CCC)NC(N)=O,C49128178_decoy,TRY1,Decoy,0,-7.0008,-4.55,-2.87,-5.267351420033413
CCCC[C@H](NC(N)=O)C(=O)NNC(=O)NCCC,C49298280_decoy,TRY1,Decoy,0,-6.3833,-4.94,-1.61,-5.549536360108129
NC(=O)c1cc(NCC(=O)NC2CC2)c(F)cc1N,C50030285_decoy,TRY1,Decoy,0,-7.56649,-6.35,-0.66,-8.833883392391716
NNc1ccc(CSc2nc(N)cc(=O)[nH]2)cn1,C51151177_decoy,TRY1,Decoy,0,-7.22779,-7.33,-1.02,-6.763190072272655
C/C(=N\NC(N)=S)c1sc(N)c(C(N)=O)c1C,C59467046_decoy,TRY1,Decoy,0,-8.64406,-5.59,-0.47,-5.544811544017477
Nc1cc(S(=O)(=O)[O-])c2ccc(N)c(O)c2c1N,C62723760_decoy,TRY1,Decoy,0,-5.92822,-7.73,-0.91,-7.769808296770153
Nc1ncnc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)n[nH]c12,C18275505_decoy,TRY1,Decoy,0,-6.26629,-7.71,-0.07,-8.130894941711231
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@@H]1c1cccc(O)c1)c1ccc(F)cc1,C04632222_decoy,TRY1,Decoy,0,-10.2644,-6.07,-3.23,-6.542851356665646
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@H]1c1cccc(O)c1)c1ccc(F)cc1,C04632223_decoy,TRY1,Decoy,0,-9.57529,-7.22,-2.53,-8.300998902981688
COCCOC(=O)c1c(NC(=O)C[NH2+]Cc2ccc(C)cc2)sc(C(N)=O)c1C,C06083651_decoy,TRY1,Decoy,0,-9.12917,-5.33,-1.06,-5.93044968753637
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccc(Cl)cc1,C08723272_decoy,TRY1,Decoy,0,-8.37254,-7.21,-3.31,-7.64600785844515
CCC[NH+](CC(=O)Nc1ccc(Cl)cc1Cl)CC(=O)Nc1sccc1C(N)=O,C12872494_decoy,TRY1,Decoy,0,-8.55407,-6.15,-2.27,-5.971537006918458
NC(=O)CC[NH+](CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1,C12991529_decoy,TRY1,Decoy,0,-8.30624,-6.99,-0.8,-7.667029043017134
Cc1cc(C)nc(N/C(=N/C(=S)NC2CCCC2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161178_decoy,TRY1,Decoy,0,-8.31368,-6.28,-2.62,-5.471413947528826
Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@H]([NH2+]CCc1ccc(S(N)(=O)=O)cc1)C2,C14733337_decoy,TRY1,Decoy,0,-10.1873,-8.7,-3.41,-9.338242342641552
Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@@H]([NH2+]CCc1ccc(S(N)(=O)=O)cc1)C2,C14733338_decoy,TRY1,Decoy,0,-10.499,-8.1,-2.35,-7.076395159085647
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCc1ccccc1Cl,C16195811_decoy,TRY1,Decoy,0,-7.73323,-7.22,-3.26,-5.95380060810017
CCOc1ccccc1NC(=O)Cn1[nH+]c(NC)c(-c2nc(-c3ccccc3C)no2)c1N,C23125407_decoy,TRY1,Decoy,0,-8.19223,-7.94,-2.99,-6.255874683970462
CCOC(=O)C1=C(C[NH+](CC)CC(=O)Nc2ccc(NC(C)=O)cc2)NC(=O)N[C@@H]1c1ccccc1,C24766207_decoy,TRY1,Decoy,0,-7.98357,-5.81,-2.37,-6.076226852625207
CCOC(=O)C1=C(C[NH+](CC)CC(=O)Nc2ccc(NC(C)=O)cc2)NC(=O)N[C@H]1c1ccccc1,C24766216_decoy,TRY1,Decoy,0,-8.34188,-5.97,-4.28,-5.911151496964812
Cc1ccc(S(=O)(=O)NCC(=O)N/N=C/c2cn(C[C@H](O)C[NH2+]C(C)(C)C)c3ccccc23)cc1,C28295691_decoy,TRY1,Decoy,0,-9.32966,-7.82,-1.81,-7.848378969014446
NS(=O)(=O)c1ccc(CC[NH2+]C[C@@H](O)COCc2ccc(Cl)cc2)cc1,C32682381_decoy,TRY1,Decoy,0,-9.48804,-6.85,-1.92,-6.199135939054274
NS(=O)(=O)c1ccc(CC[NH2+]C[C@H](O)COCc2ccc(Cl)cc2)cc1,C32682383_decoy,TRY1,Decoy,0,-9.6039,-4.91,-1.64,-5.36708830932814
CCOc1ccc(N/C(=C(C(/Cl)=C(/Cl)NCC[NH3+])\[N+](=O)[O-])n2nnc3ccccc32)cc1,C33917311_decoy,TRY1,Decoy,0,-7.24768,-5.95,-1.97,-5.612090138038997
CCOc1ccc(NC(=[NH2+])Nc2nc(CSc3nnc(C)s3)cc(=O)[nH]2)cc1,C09096691_decoy,TRY1,Decoy,0,-9.42766,-6.28,-4.52,-6.458857901007404
Cc1ccc(COc2ccc(Cl)cc2C[NH2+]CCNC(=O)c2nonc2N)cc1,C40744383_decoy,TRY1,Decoy,0,-8.19974,-6.93,-3.18,-6.891026654718544
Nc1nonc1C(=O)NCC[NH2+]Cc1cccc(OCc2c(Cl)cccc2Cl)c1,C40744510_decoy,TRY1,Decoy,0,-7.69151,-7.57,-1.89,-6.274224269231739
Nc1nonc1C(=O)NCC[NH2+]Cc1cccc(OCc2c(F)cccc2Cl)c1,C40744512_decoy,TRY1,Decoy,0,-8.71635,-7.55,-2.35,-6.689477061704505
CC(C)COC(=O)c1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40783051_decoy,TRY1,Decoy,0,-7.41404,-7.27,-3.23,-5.813472914625028
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH2+]CCO)cc1Cl,C43066825_decoy,TRY1,Decoy,0,-8.97268,-7.39,-3.08,-7.306053384308408
C[C@H](NC(=O)NCCC[NH+](C)CC(F)(F)F)c1cccc(S(N)(=O)=O)c1,C45125107_decoy,TRY1,Decoy,0,-8.67164,-5.68,-2.07,-5.632606383383336
C[C@@H](NC(=O)NCCC[NH+](C)CC(F)(F)F)c1cccc(S(N)(=O)=O)c1,C45125109_decoy,TRY1,Decoy,0,-8.3715,-5.99,-3.71,-6.617421223117196
NC(=O)CCOc1ccccc1NC(=O)NCc1ccccc1C[NH+]1CCCC1,C47877446_decoy,TRY1,Decoy,0,-7.10745,-6.62,-0.96,-6.480695194087274
CSCC[C@@H](NC(N)=O)C(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1,C41399774_decoy,TRY1,Decoy,0,-8.71204,-6.3,-0.2,-7.913845333239146
COc1ccccc1[C@@H](CNC(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCC1,C45725374_decoy,TRY1,Decoy,0,-8.07692,-6.93,-1.3,-6.147105690403776
COc1ccccc1[C@H](CNC(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCC1,C45725376_decoy,TRY1,Decoy,0,-7.85664,-6.8,-2.06,-7.486359309562518
CC(=O)Nc1ccc(NC(=O)C[NH2+]CCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1,C59447158_decoy,TRY1,Decoy,0,-6.95027,-5.72,-2.97,-5.1954318879055545
Cc1cc(C)nc(/N=C(\NC(=S)Nc2ccc(C)c(C)c2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161164_decoy,TRY1,Decoy,0,-9.5364,-7.39,-3.77,-6.896328154011468
Cc1cc(C)nc(/N=C(/NC(=S)Nc2ccc(F)cc2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161169_decoy,TRY1,Decoy,0,-8.9023,-6.27,-1.81,-6.2287586567318085
CCc1[nH]c(C)c(CNc2cc(C(=O)Nc3cccc(F)c3)cc(S(=O)(=O)NC(C)(C)C)c2)[nH+]1,C14532203_decoy,TRY1,Decoy,0,-8.49785,-6.33,-3.48,-5.96086079327597
COc1ccc([C@H](CNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)C2=c3ccccc3=[NH+]C2)cc1,C63112034_decoy,TRY1,Decoy,0,-8.25447,-7.71,-2.03,-6.155942585604759
COc1ccc([C@@H](CNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)C2=c3ccccc3=[NH+]C2)cc1,C63112039_decoy,TRY1,Decoy,0,-8.88296,-9.02,-3.27,-9.11313443249773
O=C(C[C@H]1NO[C@@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)NCc1ccccc1,C63783176_decoy,TRY1,Decoy,0,-9.21101,-7.52,-2.6,-6.48304623985847
O=C(C[C@@H]1NO[C@@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)NCc1ccccc1,C63783179_decoy,TRY1,Decoy,0,-8.73514,-7.93,-1.19,-6.845708042181607
O=C(C[C@H]1NO[C@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)NCc1ccccc1,C63783182_decoy,TRY1,Decoy,0,-8.39655,-7.54,-1.42,-5.942196989530238
O=C(C[C@@H]1NO[C@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1)NCc1ccccc1,C63783185_decoy,TRY1,Decoy,0,-8.29147,-8.76,-2.63,-9.088726729753375
O=C(NNC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1ccccc1Cl)C(=O)NC1CC1,C64343474_decoy,TRY1,Decoy,0,-9.88508,-7.88,-2.55,-10.215948504547566
Cc1ccc(C)c(N2N[NH2+]N[C@H]2SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c1,C64684363_decoy,TRY1,Decoy,0,-7.23239,-7.68,-2.56,-6.112488749387225
CCCCCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NN,C66115475_decoy,TRY1,Decoy,0,-7.72327,-7.15,-1.73,-7.596911388842912
CCCCCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115476_decoy,TRY1,Decoy,0,-7.57428,-6.76,-4.49,-7.339310693104518
CCCC[NH+]1Cc2cccc(NC(=O)C[C@H](NC(N)=O)c3ccccc3C)c2C1,C66513481_decoy,TRY1,Decoy,0,-7.9129,-5.83,-2.52,-6.08314657018066
CCCC[NH+]1Cc2cccc(NC(=O)C[C@@H](NC(N)=O)c3ccccc3C)c2C1,C66513482_decoy,TRY1,Decoy,0,-8.60173,-5.06,-4.04,-5.475126870726215
CCOC(=O)C1=C(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)NC(=O)N[C@@H]1c1ccccc1OC,C67287473_decoy,TRY1,Decoy,0,-7.40107,-5.55,-4.0,-5.524416936783108
CCOC(=O)C1=C(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)NC(=O)N[C@H]1c1ccccc1OC,C67287475_decoy,TRY1,Decoy,0,-8.02077,-6.71,-2.23,-6.151673458763261
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)c2ccc(F)cc2F)CC1,C67638583_decoy,TRY1,Decoy,0,-9.49254,-6.69,-1.9,-6.033200719789455
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)c2ccc(F)cc2F)CC1,C67638585_decoy,TRY1,Decoy,0,-9.10117,-7.23,-2.96,-6.647559960005023
O=c1[nH]c2cc3c(cc2cc1CN(C[C@H]1CCCO1)S(=O)(=O)c1ccccc1[N+](=O)[O-])OCCO3,C01222159_decoy,TRY1,Decoy,0,-7.16824,-6.41,-3.15,-4.813221024670802
CCCN1C(=O)/C(=C/c2c(N3CCNC(=O)[C@@H]3CC(=O)OCC)nc3ccccn3c2=O)SC1=S,C08858083_decoy,TRY1,Decoy,0,-8.65883,-6.07,-3.0,-5.929423689521343
CN(C)c1ccc([C@H](CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)S(=O)(=O)c2ccc(F)cc2)cc1,C09080726_decoy,TRY1,Decoy,0,-10.1137,-7.72,-2.46,-8.859551940894198
CC(=O)Nc1nnc(SCc2cc(=O)c(OC(=O)[C@H]3CC(=O)N(c4ccccc4C)C3)co2)s1,C09147486_decoy,TRY1,Decoy,0,-9.34185,-7.91,-3.36,-6.2458605748688845
COCC(=O)Nc1nnc(SCc2cc(=O)c(OC(=O)c3cc4ccccc4oc3=O)co2)s1,C09147655_decoy,TRY1,Decoy,0,-8.78629,-8.23,-2.41,-6.488181453729614
COC(=O)c1c(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)sc2c1CCN(C(=O)OC)C2,C09325171_decoy,TRY1,Decoy,0,-9.42476,-7.63,-2.6,-6.652839149337008
CC(=O)N[C@H]1[C@@H](Oc2ccc(Br)cc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C09974866_decoy,TRY1,Decoy,0,-6.92369,-6.14,-3.35,-5.540745880599372
CCOC(=O)N1CCN(c2nc3c(c(=O)[nH]c(=O)n3C)n2C[C@H](C)CSc2nccc(C)n2)CC1,C10249161_decoy,TRY1,Decoy,0,-8.79645,-6.58,-2.31,-7.740448250964493
CC(=O)N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C11852304_decoy,TRY1,Decoy,0,-7.26879,-4.8,-1.64,-5.490064290434586
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(CCC#N)CCC#N)cc2)sc2c1CC[C@H](C)C2,C12064244_decoy,TRY1,Decoy,0,-9.70974,-5.87,-2.33,-6.205183878880208
Cc1ccc(NC(=O)C[S@+]([O-])CC(=O)N(CC(=O)NC(C)(C)C)c2ccc3c(c2)OCCO3)cc1,C12472801_decoy,TRY1,Decoy,0,-9.28805,-8.31,-3.61,-7.770181429646959
COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H]1CCC(=O)N1[C@@H]1OC(=O)c2c1ccc(OC)c2OC,C12662143_decoy,TRY1,Decoy,0,-8.9878,-6.45,-3.21,-7.19945570151435
Cc1ccc(-c2nnn(CC(=O)N(C[C@H]3CCCO3)[C@H](C(=O)NC[C@@H]3CCCO3)c3ccc(C)o3)n2)o1,C12716793_decoy,TRY1,Decoy,0,-8.55508,-8.64,-3.14,-9.179323506143444
O=C(NCc1ccco1)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(=O)c2cccnc2)c1,C03013542_decoy,TRY1,Decoy,0,-9.55678,-7.71,-2.52,-6.789939826679162
Cc1ccc2cc([C@@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(C(=O)c4ccco4)CC3)c(=O)[nH]c2c1,C19940611_decoy,TRY1,Decoy,0,-7.96479,-6.01,-1.3,-5.815757311180488
Cc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C[C@H]3CCCO3)N3CCN(C(=O)c4ccco4)CC3)cc2c1,C19941310_decoy,TRY1,Decoy,0,-8.24629,-7.81,-1.5,-7.075390370546083
COCCn1nnnc1[C@@H](c1cc2ccc(C)cc2[nH]c1=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1,C19973011_decoy,TRY1,Decoy,0,-9.65976,-6.97,-1.63,-6.107734893044144
COCCn1nnnc1[C@H](c1cc2cc3c(cc2[nH]c1=O)OCO3)N(Cc1ccccc1)Cc1cccnc1,C19973406_decoy,TRY1,Decoy,0,-9.01996,-7.75,-3.54,-6.960158368830794
COc1ccc2cc([C@@H](c3nnnn3C3CCCC3)N3CCN(C(=O)c4ccco4)CC3)c(=O)[nH]c2c1,C20080196_decoy,TRY1,Decoy,0,-8.29458,-7.78,-2.48,-6.265358943108142
CCOc1ccc2[nH]c(=O)c([C@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(c4ccc(O)cc4)CC3)cc2c1,C20080494_decoy,TRY1,Decoy,0,-9.44508,-7.71,-2.86,-6.751465179722168
COc1cc2cc([C@@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccccc4)CC3)c(=O)[nH]c2cc1OC,C20080751_decoy,TRY1,Decoy,0,-8.08001,-5.85,-2.03,-5.215367027398167
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(NCCCN3CCOCC3)nc12,C13583687_decoy,TRY1,Decoy,0,-9.45444,-6.89,-2.3,-6.846790487724911
COc1ccc(N2C[C@@H](c3nnc(NC(=O)c4cc(OC)c(OC)cc4[N+](=O)[O-])s3)CC2=O)cc1,C20578434_decoy,TRY1,Decoy,0,-8.35978,-5.89,-3.1,-5.771355531875186
Cn1c(=O)c2c(ncn2CCC(=O)Nc2nnc([C@H]3CC(=O)N(c4ccc(F)cc4)C3)s2)n(C)c1=O,C20585080_decoy,TRY1,Decoy,0,-8.35602,-7.66,-2.05,-5.944752117088118
CCCCn1c(=O)c2ccccc2n2c(SCC(=O)c3c(N)n(CCOC)c(=O)[nH]c3=O)nnc12,C24784196_decoy,TRY1,Decoy,0,-8.09115,-7.1,-3.54,-5.7774353714127145
COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1,C32438776_decoy,TRY1,Decoy,0,-8.158,-7.34,-1.26,-6.098280375861607
Cc1nn(CC(=O)N2CCc3ccccc32)c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)Nc2cccnc2)C1,C33086212_decoy,TRY1,Decoy,0,-8.789,-7.61,-3.24,-6.406866093040806
COCCN(CC(=O)Nc1nc(CC(=O)N2CCC3(CC2)OCCO3)cs1)C(=O)c1ccc(C)cc1,C35416246_decoy,TRY1,Decoy,0,-9.09014,-7.69,-1.88,-7.586682812849159
COc1cc([C@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(Cc2ccco2)C(=O)CCl)ccc1O,C36503514_decoy,TRY1,Decoy,0,-8.50947,-7.43,-4.05,-7.500653972000636
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2cc([N+](=O)[O-])ccc2Cl)N(C)C(=O)c2cccnc2)cc1,C36538558_decoy,TRY1,Decoy,0,-7.7061,-6.13,-3.6,-5.484699180328395
CC(C)Cn1c(N)c(C(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c(=O)n(C)c1=O,C23080580_decoy,TRY1,Decoy,0,-7.88683,-6.2,-3.79,-5.581899607767768
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)OCC(=O)N1CCN(C(C)=O)CC1,C12984641_decoy,TRY1,Decoy,0,-9.92002,-7.09,-3.75,-7.112781095399697
Cc1c(NS(=O)(=O)c2ccc(NCCN3CCOCC3)c([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C,C13138582_decoy,TRY1,Decoy,0,-6.5105,-5.85,-2.36,-4.896120832677844
CO[P@]1(=O)NN2CCc3cc(S(=O)(=O)Oc4ccccc4)c(S(=O)(=O)C(C)C)cc3[C@@H]2CO1,C39464825_decoy,TRY1,Decoy,0,-7.36725,-6.85,-3.26,-5.085268611441925
CCO[P@@]1(=O)NN2C[C@@H]3C=C(S(=O)(=O)C(C)C)C(S(=O)(=O)c4ccccc4)=C[C@@H]3C[C@@H]2CO1,C39469563_decoy,TRY1,Decoy,0,-8.18711,-5.22,-2.2,-4.9596452090075
CC(C)S(=O)(=O)c1ccc([C@H](CC=O)NC=O)c(Br)c1S(=O)(=O)Oc1ccccc1,C39497722_decoy,TRY1,Decoy,0,-8.09539,-6.48,-2.85,-6.4620099719620985
COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1S(=O)(=O)N1CCOCC1,C39546090_decoy,TRY1,Decoy,0,-9.29763,-5.35,-1.77,-5.637058684335936
[H]/N=C1C(=C/c2ccc(-c3ccc(OCC)cc3[N+](=O)[O-])o2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C41083903_decoy,TRY1,Decoy,0,-7.84779,-6.9,-2.25,-5.474320083971106
COc1cc([C@H]2[NH2+][C@](CO)(C(=O)[O-])[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@@H]23)cc(Br)c1OC,C33919168_decoy,TRY1,Decoy,0,-8.29696,-6.09,-1.58,-6.26803664527556
COc1cc([C@@H]2[NH2+][C@](CO)(C(=O)[O-])[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@H]32)cc(Br)c1OC,C33919169_decoy,TRY1,Decoy,0,-8.72487,-6.69,-1.43,-5.732385847627098
CS(=O)(=O)N1CCc2c(c(-c3ccc(Cl)c(SCCO)c3)nn2CCCN2CCOCC2)C1,C49066974_decoy,TRY1,Decoy,0,-11.663,-5.64,-1.59,-7.259735701133056
COCCNC(=O)CSc1nnc(N2CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)s1,C49370161_decoy,TRY1,Decoy,0,-7.73109,-7.28,-3.07,-5.883926756597684
COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccccc4)c32)cc(OC)c1OC(=O)N1CCOCC1,C00709631_decoy,TRY1,Decoy,0,-7.32088,-5.61,-2.95,-5.729384359350131
COc1ccc(Cn2nnnc2CN(Cc2ccco2)Cc2cc3cc4c(cc3[nH]c2=O)OCO4)cc1,C01375736_decoy,TRY1,Decoy,0,-7.38788,-8.14,-2.76,-7.027483211412174
COc1ccc(-c2cc(C(=O)NCc3ccco3)c3c(C)nn([C@H]4CCS(=O)(=O)C4)c3n2)cc1OC,C57310615_decoy,TRY1,Decoy,0,-9.56613,-7.08,-2.8,-5.989100143822054
O=c1[nH]c2cc3c(cc2cc1CN(Cc1nnnn1CCc1ccccc1)C[C@@H]1CCCO1)OCCO3,C57640538_decoy,TRY1,Decoy,0,-8.7922,-5.93,-2.25,-5.8065938704069975
[H]/N=C1C(=C\c2ccc(OCCOc3ccccc3)c(OCC)c2)\C(=O)N=C2SN=C(S(C)(=O)=O)N2\1,C20205616_decoy,TRY1,Decoy,0,-7.79915,-7.11,-2.28,-7.536868516427073
C[C@H](NC(=O)[C@@H]1CC=CO1)C(=O)N1CCN(CC2=NC(=O)C3=C(c4cccs4)CSC3=N2)CC1,C39932309_decoy,TRY1,Decoy,0,-10.1402,-7.4,-1.58,-6.599079744828518
[H]/N=C1C(=C\c2ccc(OCCOc3ccccc3OC)cc2)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206471_decoy,TRY1,Decoy,0,-8.7876,-7.18,-1.71,-5.662781002565833
[H]/N=C1C(=C\c2cc(C)n(-c3ccc(OC)cc3OC)c2C)\C(=O)N=C2SN=C(S(=O)(=O)CC)N2\1,C20206936_decoy,TRY1,Decoy,0,-9.66748,-7.51,-3.01,-6.0140296937052256
COC(=O)c1sc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3cnn(C)c3C)C2)c(C(=O)OC)c1C,C02732640_decoy,TRY1,Decoy,0,-8.88681,-7.23,-4.98,-6.290915498203526
COC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)sc2c1CCN(C(C)=O)C2,C03007261_decoy,TRY1,Decoy,0,-8.60009,-7.23,-2.01,-5.906727596755246
Cc1cn([C@@H]2C[C@H](O)[C@H](CO[P@@](=O)(OCCC#N)Oc3ccc(Cl)cc3)O2)c(=O)[nH]c1=O,C08740033_decoy,TRY1,Decoy,0,-6.94697,-7.95,-2.24,-7.145443705792809
CCCCN1C(=O)/C(=C/c2c(N3CCNC(=O)[C@@H]3CC(=O)OC)nc3ccccn3c2=O)SC1=S,C08858016_decoy,TRY1,Decoy,0,-7.90532,-7.41,-3.39,-7.355544764381839
COc1ccc(-c2nc(SCC(=O)Nc3cc(C)on3)c3c(=O)n(C)c(=O)n(C)c3n2)cc1OC,C08901500_decoy,TRY1,Decoy,0,-9.86638,-5.76,-3.88,-5.780693811359651
CC(=O)NS(=O)(=O)c1ccc(N/C=C2\C(=O)N([C@H]3CCS(=O)(=O)C3)C(=O)C(C#N)=C2C)cc1,C08993466_decoy,TRY1,Decoy,0,-7.74124,-7.11,-2.09,-5.128779462432183
O=S1(=O)C[C@@H](S(=O)(=O)NC[C@@H](c2ccco2)S(=O)(=O)c2ccc3c(c2)OCO3)[C@@H](O)C1,C09081414_decoy,TRY1,Decoy,0,-8.67334,-7.78,-3.36,-7.844411498866782
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NC[C@@H](c2ccco2)S(=O)(=O)c2ccc3c(c2)OCO3)C1,C09081416_decoy,TRY1,Decoy,0,-7.86027,-7.58,-2.39,-7.082366325565463
Cc1ccc(S(=O)(=O)[C@H](CNC(=O)C(=O)N[C@H]2CCS(=O)(=O)C2)c2cccs2)cc1C,C09104296_decoy,TRY1,Decoy,0,-9.17474,-7.74,-3.22,-7.814601736977909
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(N3CCC(C(N)=O)CC3)nc12,C02417322_decoy,TRY1,Decoy,0,-9.54489,-5.6,-2.23,-6.12937893833207
COC(=O)NC(=O)c1c(NC(=O)c2cccc(S(C)(=O)=O)c2)sc2c1CCN(C(=O)OC)C2,C09325546_decoy,TRY1,Decoy,0,-8.36388,-6.0,-2.46,-5.631696359232232
O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(N2C(=O)CCC2=O)cc1,C09443793_decoy,TRY1,Decoy,0,-8.57409,-6.2,-2.32,-5.259483749802921
O=C(CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1)NN1C(=O)NC2(CCCCC2)C1=O,C11374361_decoy,TRY1,Decoy,0,-8.64918,-7.14,-3.74,-6.509545575143374
CCCn1c(N)c(C(=O)CSc2nnc(N3CCOCC3)n2C[C@H]2CCCO2)c(=O)n(C)c1=O,C11374514_decoy,TRY1,Decoy,0,-8.82517,-5.82,-1.92,-5.944108017630344
CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)CSc1nnc(N2CCCCC2)n1C1CC1,C11778128_decoy,TRY1,Decoy,0,-8.72552,-5.84,-2.84,-6.12892915141605
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1,C12617623_decoy,TRY1,Decoy,0,-8.56657,-8.63,-3.38,-6.092034619207463
Cc1nn(CCC#N)c(C)c1CCC(=O)NCCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O,C12787436_decoy,TRY1,Decoy,0,-9.8905,-8.74,-1.46,-8.001421547148649
O=C([O-])C1CCN(S(=O)(=O)c2ccc(N3CC[NH+](Cc4ccncc4)CC3)c([N+](=O)[O-])c2)CC1,C13192690_decoy,TRY1,Decoy,0,-8.45962,-6.62,-3.99,-5.530939778606675
O=C(C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCC(C(=O)[O-])CC2)CC1)NC1CC1,C13212213_decoy,TRY1,Decoy,0,-6.72492,-5.13,-4.03,-4.991799483197528
CCc1nnc(NS(=O)(=O)c2ccc(-n3c(C)cn4c5c(=O)[nH]c(=O)n(C)c5nc34)cc2)s1,C09829533_decoy,TRY1,Decoy,0,-8.49584,-6.67,-3.02,-5.378229742668149
O=C(Cn1[nH]c(=O)c2ccccc2c1=O)NCCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O,C14718687_decoy,TRY1,Decoy,0,-8.09462,-8.99,-1.89,-6.478497412298122
COc1cc(/C=C2\SC(=O)N(CCNC(=O)c3cn4c(C)cccc4n3)C2=O)cc(OC)c1OC,C15994955_decoy,TRY1,Decoy,0,-9.18829,-7.32,-2.0,-6.74754786325029
CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)c1,C16097302_decoy,TRY1,Decoy,0,-7.21181,-8.08,-2.92,-8.811561981924026
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NN3C(=O)NC4(CCCCC4)C3=O)c2c1,C17114557_decoy,TRY1,Decoy,0,-7.12114,-8.01,-1.64,-6.574920462788032
CCCCn1c(=O)[nH]c(=O)c2c1nc(CSc1nnc(C[C@H]3CCS(=O)(=O)C3)n1C)n2CC,C18668365_decoy,TRY1,Decoy,0,-8.30224,-7.48,-3.88,-6.269948244497403
COc1ccc(N2C(=O)[C@@H]3[C@@H](c4ccc(OC)cc4O)[NH2+][C@@](CCSC)(C(=O)[O-])[C@@H]3C2=O)cc1,C19848583_decoy,TRY1,Decoy,0,-8.29632,-6.73,-1.78,-7.457980876320573
COc1ccc2cc([C@@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(C(=O)c4ccco4)CC3)c(=O)[nH]c2c1,C20080170_decoy,TRY1,Decoy,0,-7.63771,-7.67,-2.9,-8.376282131082021
COCCn1nnnc1[C@H](c1cc2cc(OC)c(OC)cc2[nH]c1=O)N1CCN(c2ccccc2)CC1,C20084143_decoy,TRY1,Decoy,0,-9.37153,-5.76,-1.9,-6.41478340329974
COCCn1nnnc1[C@@H](c1cc2cc(OC)c(OC)cc2[nH]c1=O)N1CCN(c2ccccc2)CC1,C20084146_decoy,TRY1,Decoy,0,-8.07258,-7.25,-2.35,-6.458699307891884
COc1ccccc1CN(Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)Cc1nnnn1C[C@@H]1CCCO1,C20109369_decoy,TRY1,Decoy,0,-10.437,-7.29,-2.95,-8.263187396095585
COc1cc(=O)n2c(c1C(=O)N1CCC[C@H](O)C1)CCN(Cc1c[nH]nc1-c1ccc(F)cc1)CC2,C20539772_decoy,TRY1,Decoy,0,-8.08371,-6.22,-2.28,-5.864477830289176
Cc1cc(C)cc(N2C[C@H](c3nnc(NC(=O)CCn4cnc5c4c(=O)n(C)c(=O)n5C)s3)CC2=O)c1,C20585092_decoy,TRY1,Decoy,0,-7.68224,-8.93,-2.55,-5.748150545528682
Cc1cc(C)nc(SC[C@@H](C)Cn2c(N3CCN(CCO)CC3)nc3c2c(=O)[nH]c(=O)n3C)n1,C21727752_decoy,TRY1,Decoy,0,-8.68855,-5.81,-1.31,-5.75036439382891
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C1CCN(c2ccc3nnnn3n2)CC1,C22960314_decoy,TRY1,Decoy,0,-9.66423,-8.14,-1.88,-6.251769172270153
Cc1noc(C)c1S(=O)(=O)N1CCN(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)CC1,C23880921_decoy,TRY1,Decoy,0,-8.95884,-7.47,-4.87,-6.06280244912771
Cc1cc(NC(=O)CSc2nnc(N3CCOCC3)n2CC(C)C)n([C@@H]2CCS(=O)(=O)C2)n1,C29503640_decoy,TRY1,Decoy,0,-9.95342,-6.64,-2.45,-6.249375286664941
O=S(=O)([N-]c1nc2ccccc2nc1-[n+]1cccc(/N=C(\O)c2cccs2)c1)c1ccccc1,C13647124_decoy,TRY1,Decoy,0,-9.22847,-7.36,-2.17,-5.957566758171184
Cc1cccn2c(=O)c(/C=C3/SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c(NCc3ccco3)nc12,C33723917_decoy,TRY1,Decoy,0,-6.49156,-7.68,-2.09,-5.14483763378028
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](Cc2ccc(O)cc2)(C(=O)[O-])[NH2+][C@H]3c2ccccn2)cc1Cl,C33767157_decoy,TRY1,Decoy,0,-9.97686,-8.74,-1.97,-11.191852484492603
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)C1,C35292577_decoy,TRY1,Decoy,0,-9.45879,-6.1,-2.13,-6.0296831555081685
Cc1cc(NC(=O)CSc2nnc(N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)s2)no1,C35597081_decoy,TRY1,Decoy,0,-7.39734,-7.46,-2.28,-5.67424547075825
O=C(Nc1c2c(nn1-c1ccc(F)cc1)C[S@@+]([O-])C2)c1ccc(S(=O)(=O)N2CCOCC2)cc1,C06208148_decoy,TRY1,Decoy,0,-8.81327,-6.44,-1.5,-5.757780817863607
C[C@H]1CCc2c(sc(NC(=O)C[C@H]3SC(=O)NC3=O)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C39836554_decoy,TRY1,Decoy,0,-9.85507,-7.99,-0.76,-6.940154194053507
Cc1ncc([N+](=O)[O-])n1CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@H](c1ccc(Br)s1)[NH2+][C@@H]2C(=O)[O-],C33923208_decoy,TRY1,Decoy,0,-8.93286,-6.01,-4.13,-6.121766905004868
C#CCN1C(=O)[C@H]2[C@@H](c3coc4cc(C)c(Cl)cc4c3=O)[NH2+][C@](CCSC)(C(=O)[O-])[C@@H]2C1=O,C43218301_decoy,TRY1,Decoy,0,-9.74816,-6.23,-1.74,-6.4127884988816914
[H]/N=C1C(=C\c2ccc(OCc3cc(=O)n4nc(CC)sc4n3)c(OC)c2)\C(=O)N=C2SC=CN2\1,C20332070_decoy,TRY1,Decoy,0,-9.76641,-7.88,-3.34,-6.260075463137883
CCn1cc(C(=O)Nc2nc(C)cs2)c(=O)c2cc(F)c(N3CCN(C(=O)c4ccco4)CC3)cc21,C08974498_decoy,TRY1,Decoy,0,-8.58771,-6.87,-2.35,-7.089374669280069
COC(=O)C[C@H]1C(=O)NCCN1CN1C(=O)[C@@]2(C(C#N)=C(N)OC3=C2C(=O)CCC3)c2ccccc21,C22749584_decoy,TRY1,Decoy,0,-7.0696,-5.37,-2.28,-4.738116278749914
CC[C@H](c1nnnn1C[C@@H]1CCCO1)N(Cc1cccnc1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C13495354_decoy,TRY1,Decoy,0,-8.27121,-8.4,-1.43,-6.589006439986192
O=S(=O)([N-]c1nc2ccccc2nc1-[n+]1cccc(/N=C(\O)c2ccccc2Cl)c1)c1ccccc1,C18083068_decoy,TRY1,Decoy,0,-8.14487,-8.55,-3.07,-5.91611857478906
Cc1c(Cl)cccc1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NCCc1ccccc1,C08452603_decoy,TRY1,Decoy,0,-9.07121,-6.18,-2.47,-6.679247581729692
CC(C)COc1ccccc1C(=O)NC(=S)Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1,C09269588_decoy,TRY1,Decoy,0,-8.55953,-7.34,-2.97,-6.812826974258696
CCCNC(=O)NC(=O)COC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2,C09350946_decoy,TRY1,Decoy,0,-9.53096,-7.67,-2.44,-7.409898204380118
C=CCC(O)(CC=C)[C@@H](C)NC(=O)c1cc(NC(=O)C(C)C)cc2nc(C)n(Cc3ccccc3)c12,C11789328_decoy,TRY1,Decoy,0,-9.48341,-5.73,-4.77,-6.189529707029818
COc1cc(C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2Cl)cc(OC)c1OC,C12503676_decoy,TRY1,Decoy,0,-9.206,-6.92,-4.25,-6.199008004249249
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccc(Cl)cc3)n2CCOC)n1,C12591190_decoy,TRY1,Decoy,0,-9.0479,-6.12,-3.7,-6.416723591048941
COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2Cl)cc1OC,C13977321_decoy,TRY1,Decoy,0,-10.6678,-7.02,-3.5,-6.647145406811896
Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)CCCOc1ccc(Cl)cc1Cl,C13981208_decoy,TRY1,Decoy,0,-8.02884,-7.58,-1.52,-6.7990773908100826
COc1ccc(CN/C(=N\C(=S)Nc2ccc(C(F)(F)F)cc2)Nc2nc(C)cc(C)n2)cc1,C14156692_decoy,TRY1,Decoy,0,-8.65749,-6.11,-2.16,-5.974807913720519
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(Oc3ccccc3)cc2)NCc2cccs2)n1,C14157198_decoy,TRY1,Decoy,0,-9.66222,-5.53,-1.59,-6.397386197690908
CCCCN(C(=O)COc1cc(Cl)c(Cl)cc1Cl)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14624172_decoy,TRY1,Decoy,0,-8.83134,-7.56,-2.21,-8.507066285023406
COCCOc1ccc(Br)cc1C(=O)NNC(=O)CCC(=O)Nc1ccc(C)cc1C,C14662547_decoy,TRY1,Decoy,0,-9.15013,-7.47,-3.7,-7.133623889062969
COC(=O)c1c(NC(=O)[C@@H]2CCCO2)c2cc(NCc3cccc(O)c3)cnc2n1CCc1ccccc1,C14744942_decoy,TRY1,Decoy,0,-9.50239,-7.89,-3.49,-7.585248664488417
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C(C)C)cc1,C14894407_decoy,TRY1,Decoy,0,-9.67191,-7.83,-4.06,-8.90541093230859
C=CCn1c(CNc2ccc(Cl)cc2)nnc1SCC(=O)N/N=C/c1cc(Cl)ccc1O,C02743011_decoy,TRY1,Decoy,0,-9.93569,-7.02,-2.85,-6.800354642838487
O=C(COc1ccc(Br)cc1)NC(=S)NCCNc1ccc([N+](=O)[O-])cc1Cl,C16428764_decoy,TRY1,Decoy,0,-8.47541,-5.11,-3.67,-5.071499294895179
COc1ccc2[nH]c3c([O-])n(CCCCC(=O)NCCC[NH+]4CCCCCC4)c(=S)nc3c2c1,C20331512_decoy,TRY1,Decoy,0,-9.29346,-6.83,-1.53,-5.775980480747816
Cc1c(F)cccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(OCc3ccc(F)cc3)o2)n1,C20424911_decoy,TRY1,Decoy,0,-9.96887,-9.13,-4.37,-7.97018394793774
O=C(CCSc1n[nH]c(N/N=C/c2ccccc2Cl)n1)NC(c1ccccc1)c1ccccc1,C21077789_decoy,TRY1,Decoy,0,-9.72315,-9.12,-1.96,-7.455305251975679
CCCCCN(C(=O)c1cc(-c2ccco2)nc2ccccc12)c1c(N)n(CCCC)c(=O)[nH]c1=O,C21336057_decoy,TRY1,Decoy,0,-7.41555,-5.52,-3.81,-5.36055078330929
CCCOc1c(Br)cc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1OC,C21603052_decoy,TRY1,Decoy,0,-9.2801,-6.48,-2.15,-8.129697337076555
CCOC(=O)C1=C(COC(=O)C(O)(c2ccccc2)c2ccccc2)NC(=O)N[C@H]1c1ccccc1,C22025151_decoy,TRY1,Decoy,0,-7.70538,-8.22,-2.87,-7.380360210891606
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CSCc2ccc(Cl)s2)c(=O)[nH]c1=O,C23121971_decoy,TRY1,Decoy,0,-10.2883,-6.8,-1.9,-7.796822706778381
CCOc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCN(Cc2ccccc2)C3)cc(OCC)c1OCC,C23153793_decoy,TRY1,Decoy,0,-9.98204,-5.63,-2.49,-6.105340080203625
CCCCCN(C(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C23688105_decoy,TRY1,Decoy,0,-8.49634,-4.99,-4.17,-5.791036814224341
Cc1ccc(C(C)C)c(OCc2nnc(S[C@H](C)C(=O)Nc3ccccc3OC(F)F)n2N)c1,C24270377_decoy,TRY1,Decoy,0,-9.67508,-7.97,-2.72,-7.728701354337223
CCCN1C(=O)N[C@@H](c2cccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)c2)C(C(=O)OCCOC)=C1C,C34836610_decoy,TRY1,Decoy,0,-9.84144,-6.33,-5.05,-6.297193370923225
CCCN(C(=O)c1cccc(O)c1O)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1cc([N+](=O)[O-])ccc1Cl,C36571345_decoy,TRY1,Decoy,0,-6.77701,-5.81,-4.35,-5.422661335619605
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)[C@@H](C)c2ccccc2)o1,C36597723_decoy,TRY1,Decoy,0,-7.67095,-6.12,-2.11,-6.02606619416344
CCC/C=C/[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccc(C)o1)C(=O)c1cccc(O)c1O,C36597739_decoy,TRY1,Decoy,0,-8.37796,-6.65,-3.63,-6.716566342653658
CCCCn1c(N)c(N(Cc2ccccc2OC)C(=O)[C@H](C)Oc2ccc(Cl)cc2)c(=O)[nH]c1=O,C12888908_decoy,TRY1,Decoy,0,-7.50682,-5.89,-1.9,-5.857789258662033
O=C(CCCC(=O)N(c1cccc(F)c1)[C@H](C(=O)NC1CCCC1)c1ccc(O)cc1)Nc1ccccn1,C13027757_decoy,TRY1,Decoy,0,-9.73576,-7.92,-2.73,-8.420849235527482
O=C(CCCC(=O)N(c1cccc(F)c1)[C@@H](C(=O)NC1CCCC1)c1ccc(O)cc1)Nc1ccccn1,C13027754_decoy,TRY1,Decoy,0,-9.21427,-7.96,-3.24,-8.65551638127677
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)OC(=O)[C@@H](C)SCC(=O)Nc1ccc(F)cc1,C39577178_decoy,TRY1,Decoy,0,-8.53202,-5.93,-3.91,-5.5484855473768695
Cc1cc(C)c(NC(=O)CNC(=O)COC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)c(C)c1,C39611642_decoy,TRY1,Decoy,0,-8.04,-7.65,-2.53,-7.164154285421727
C=CCn1c(CC(=O)Nc2cccc(SC)c2)nnc1S[C@@H](C)C(=O)Nc1ccccc1O,C39749231_decoy,TRY1,Decoy,0,-9.62514,-6.2,-2.01,-6.732326359822339
Cc1nc(NC(=O)CSc2nnc([C@@H](CO)NC(=O)c3ccc(Cl)cc3)n2CC(C)C)sc1C,C39749765_decoy,TRY1,Decoy,0,-9.78889,-8.26,-2.1,-7.84256157747825
CCc1ccccc1NC(=O)CSc1nnc([C@@H](CO)NC(=O)c2ccc(Cl)cc2)n1CC(C)C,C39761665_decoy,TRY1,Decoy,0,-10.1187,-6.9,-2.55,-7.090143602929495
CCc1nc(NC(=O)CSc2nnc([C@@H](CO)NC(=O)c3ccc(Cl)cc3)n2CC)sc1C,C39765426_decoy,TRY1,Decoy,0,-10.1708,-8.29,-3.34,-10.613484686823394
O=S(=O)(NC[C@@H]1CCCO1)c1ccc(NC(=S)Nc2ccc(OC(F)F)c(Cl)c2)cc1,C39974695_decoy,TRY1,Decoy,0,-7.6411,-7.84,-2.74,-6.233457338200959
CCCCOc1ccc(Nc2ncnc(N3CCN(C(c4ccccc4)c4ccccc4)CC3)c2N)cc1,C40729715_decoy,TRY1,Decoy,0,-10.1868,-2.27,-2.71,-4.569971347237917
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=S)Nc2cc(C(F)(F)F)ccc2Cl)cc1OC,C46773135_decoy,TRY1,Decoy,0,-7.38964,-6.38,-1.98,-4.997129618159319
C=CCn1c(CNc2cccc3ccccc23)nnc1S[C@@H](C)C(=O)N/N=C/c1cc(Cl)ccc1O,C02752176_decoy,TRY1,Decoy,0,-10.9484,-8.1,-1.8,-7.912231055786933
O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1)NCc1ccccc1,C58881457_decoy,TRY1,Decoy,0,-7.86674,-8.87,-2.41,-6.462819946538216
O=C(CSc1n[nH]c(N/N=C/c2ccccc2F)n1)Nc1ccccc1SCc1ccc(F)cc1,C59015004_decoy,TRY1,Decoy,0,-8.97903,-7.84,-3.07,-7.004330576571595
CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3F)n2)sc2c1CCC2,C59015024_decoy,TRY1,Decoy,0,-10.2415,-8.93,-2.3,-7.989427081113921
O=C(CSc1n[nH]c(N/N=C/c2ccccc2OCc2ccccc2Cl)n1)NC1CCCC1,C59038983_decoy,TRY1,Decoy,0,-9.12962,-7.3,-2.98,-8.180467238979576
CCC/C=N/Nc1nc(SCC(=O)Nc2nnc(SCc3ccccc3Cl)s2)n[nH]1,C59311719_decoy,TRY1,Decoy,0,-10.0788,-8.32,-2.99,-7.1241944483798845
C=CCn1c(CNc2ccccc2)nnc1S[C@@H](C)C(=O)N/N=C/c1c(O)ccc2ccccc12,C59486860_decoy,TRY1,Decoy,0,-8.60584,-8.31,-2.77,-6.633004006328569
CC(C)Cc1ccc([C@H](C)C(=O)NC(=S)Nc2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1,C66199934_decoy,TRY1,Decoy,0,-10.0996,-5.93,-4.64,-6.4279438050420366
CC[NH+](CC)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCc1ccccc1,C06193010_decoy,TRY1,Decoy,0,-9.07541,-6.14,-1.56,-6.344326693101808
CC[NH+](CC)CCN(Cc1cc2cc(OC)c(OC)cc2[nH]c1=O)C(=S)Nc1ccc(F)cc1,C06193318_decoy,TRY1,Decoy,0,-8.73302,-5.77,-1.63,-5.834913199890702
CC[NH+](CC)CCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCCc1ccccc1,C06193400_decoy,TRY1,Decoy,0,-8.95613,-7.3,-1.62,-7.2169246825923965
CCCCCN(C(=O)COC(=O)CCC(=O)c1cccs1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C08825392_decoy,TRY1,Decoy,0,-9.26269,-6.67,-3.09,-6.858301862652038
CCOc1ccc(N2C(=O)/C(=C/Nc3ccc(C(=O)OCC[NH+](CC)CC)cc3)C(=O)NC2=S)cc1,C09355058_decoy,TRY1,Decoy,0,-9.18524,-5.25,-3.3,-5.62681402420452
O=C(CCCC(=O)OCCCc1ccccc1)NC(=S)NNC(=O)c1sc2ccccc2c1Cl,C12137576_decoy,TRY1,Decoy,0,-9.93763,-7.41,-2.84,-6.9952426848982485
CCOc1ccc(C/C(N)=N/OC(NC(=O)c2cccs2)(C(F)(F)F)C(F)(F)F)cc1OCC,C12412138_decoy,TRY1,Decoy,0,-8.71815,-7.01,-1.67,-6.521570845363419
CCCCOc1ccc(Br)cc1C(=O)NC(=S)Nc1ccccc1C(=O)NCCOC,C10123150_decoy,TRY1,Decoy,0,-8.77569,-6.29,-2.32,-7.4908560093042045
CCOc1ccc2[nH]c(=O)c(C[NH+](CCCO)[C@H](c3nnnn3Cc3ccccc3)C(C)C)cc2c1,C13500582_decoy,TRY1,Decoy,0,-8.39951,-6.25,-3.08,-6.444767391830203
CCCCCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2cc(C)ccc2C(C)C)cc1,C14029155_decoy,TRY1,Decoy,0,-8.7206,-7.15,-3.12,-7.654361609772697
CCCCOc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccc(C(C)C)cc1Br,C14032435_decoy,TRY1,Decoy,0,-8.72684,-7.06,-3.54,-6.69651030858348
CCCCCOc1ccccc1C(=O)NC(=S)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl,C14036186_decoy,TRY1,Decoy,0,-8.28383,-5.89,-4.61,-5.80496101595275
O=C(COc1cccc2ccccc12)NNC(=S)NC(=O)c1ccccc1OCCOc1ccccc1,C14040769_decoy,TRY1,Decoy,0,-8.09248,-7.79,-3.64,-6.6141349325790575
CCCCN(C(=O)/C=C/c1ccc(OC(F)F)c(OC)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14623990_decoy,TRY1,Decoy,0,-7.8206,-6.85,-2.67,-5.487104919109595
CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)CCC(=O)Nc1cc(C)ccc1C,C14648307_decoy,TRY1,Decoy,0,-9.82527,-6.91,-3.63,-7.841961337260551
C=CCOc1ccccc1C(=O)NNC(=S)NC(=O)c1cc(Br)ccc1OCCCC,C14650333_decoy,TRY1,Decoy,0,-8.01083,-5.16,-2.45,-6.625519030516907
C=CCc1ccc(OCC(=O)N(Cc2ccco2)c2c(N)n(CCCC)c(=O)[nH]c2=O)c(OC)c1,C14652890_decoy,TRY1,Decoy,0,-8.57053,-7.53,-3.47,-8.347043299768737
CCCCCN(C(=O)c1cc(Cl)c(OC(C)C)c(OC)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697762_decoy,TRY1,Decoy,0,-7.34065,-5.08,-3.23,-5.118523612957328
CC[NH+](CC)CCC[C@H](C)NC(=O)c1csc(CN(CCOC)C(=O)Nc2c(C)cccc2C)n1,C16459435_decoy,TRY1,Decoy,0,-7.52871,-5.98,-2.77,-5.212437840992886
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCn2c(-c3ccc(OCC)cc3)n[nH]c2=S)cc1,C18071554_decoy,TRY1,Decoy,0,-7.26728,-6.22,-2.65,-5.892681069078776
COc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1,C20909379_decoy,TRY1,Decoy,0,-9.59963,-7.48,-3.42,-7.094754347119486
CC/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCCOC)s2)n[nH]1)c1ccccc1,C21081554_decoy,TRY1,Decoy,0,-10.7819,-7.36,-4.88,-7.706734948592259
CCOC(=O)C1=C(COC(=O)c2[nH]c(CC)c(C(=O)OC)c2C)NC(=O)N[C@H]1c1ccc(OC)cc1,C22314066_decoy,TRY1,Decoy,0,-7.97448,-6.68,-1.41,-6.0966201386088645
C[NH+](C)CCNS(=O)(=O)c1ccc(NCc2ccc(OCC(F)(F)F)cc2)c([N+](=O)[O-])c1,C23620662_decoy,TRY1,Decoy,0,-7.14298,-6.22,-4.26,-5.007269090936384
CCCCn1c(N)c(N(CCC(C)C)C(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])c(=O)[nH]c1=O,C28242239_decoy,TRY1,Decoy,0,-7.21408,-5.02,-5.27,-5.256625400530843
CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc1nc(C)c(C(=O)OCC(C)C)s1,C32535790_decoy,TRY1,Decoy,0,-10.2599,-5.89,-4.11,-6.915117943475507
CCCCCN(C(=O)CCC(=O)O[C@H](C)C(=O)c1ccc(CC)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C32944976_decoy,TRY1,Decoy,0,-7.7776,-7.01,-2.11,-6.213703354493016
Cc1ccc(OCCCC(=O)N(C)CC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1,C32971993_decoy,TRY1,Decoy,0,-8.39706,-5.99,-1.42,-6.522902321449354
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@H]2c2ccc(OCC(N)=O)cc2)c(C)c1,C33751873_decoy,TRY1,Decoy,0,-9.26721,-5.05,-3.01,-5.745796679020962
CC[NH+](CC)CCC[C@H](C)NC(=O)Cc1csc(NC(=O)CN(CCOC)C(=O)c2ccc(C)cc2)n1,C34913501_decoy,TRY1,Decoy,0,-10.0627,-6.52,-3.83,-6.623529097822672
Cc1ccc(C)c(-c2csc3nc(C[NH+](CCN4CCOCC4)C[C@@H](O)COCC(C)C)[nH]c(=O)c23)c1,C35746472_decoy,TRY1,Decoy,0,-8.94668,-7.25,-3.42,-7.4879854059513455
C#CCOC[C@@H](O)C[NH+](Cc1ccccc1)Cc1nc2sc(C(=O)OCC=C)c(C)c2c(=O)[nH]1,C35747071_decoy,TRY1,Decoy,0,-8.02287,-6.12,-2.3,-6.553740732584868
COc1ccc(-c2csc3nc(C[NH+](Cc4ccco4)C[C@@H](O)COCC(C)C)[nH]c(=O)c23)cc1,C36206288_decoy,TRY1,Decoy,0,-8.5702,-6.61,-1.87,-6.947351855196331
CCCC(=O)OC[C@@H](O)C[NH+](Cc1nc2sc(C(=O)OC)c(CC)c2c(=O)[nH]1)Cc1ccco1,C36206722_decoy,TRY1,Decoy,0,-8.04467,-5.7,-2.19,-6.11951226499889
CCc1c(C(=O)OC)sc2nc(C[NH+](C[C@H](O)COCC(C)C)C3CCCCC3)[nH]c(=O)c12,C36206751_decoy,TRY1,Decoy,0,-8.89331,-7.07,-3.47,-7.359918394341553
Cc1c(C(=O)OC(C)C)sc2nc(C[NH+](Cc3ccco3)C[C@@H](O)COC(C)C)[nH]c(=O)c12,C36206823_decoy,TRY1,Decoy,0,-8.23965,-5.34,-3.86,-5.984793712683748
COCCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)COCC(C)C,C36206869_decoy,TRY1,Decoy,0,-8.85442,-6.29,-4.42,-6.850610724888866
C=CCOC[C@H](O)C[NH+](Cc1ccccc1)Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1,C36207127_decoy,TRY1,Decoy,0,-8.73315,-6.92,-2.99,-6.473426423921096
COC(=O)c1sc2nc(C[NH+](Cc3ccccc3)C[C@H](O)COCc3ccco3)[nH]c(=O)c2c1C,C36207525_decoy,TRY1,Decoy,0,-8.30944,-7.22,-1.67,-6.36652604047205
CCOC(=O)C1=C(COC(=O)CNC(=O)c2ccccc2OCC)NC(=O)N[C@H]1c1ccccc1,C36245661_decoy,TRY1,Decoy,0,-7.11661,-7.4,-2.12,-6.564867370724546
CCCCCN(C(=O)CCC(=O)OCc1ccc(Cl)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C36245710_decoy,TRY1,Decoy,0,-8.89461,-6.97,-1.63,-7.023004319856174
CCOC(=O)C1=C(CSc2nnc(NCCOC)s2)NC(=O)N[C@H]1c1ccc(OC)cc1,C36852839_decoy,TRY1,Decoy,0,-9.42658,-5.78,-1.77,-8.321126100642292
CCOP(=O)(OCC)C(C)(C)NCc1cccc(C[NH2+]C(C)(C)P(=O)(OCC)OCC)c1,C37630390_decoy,TRY1,Decoy,0,-5.85281,-5.35,-2.58,-4.830900612232236
CCCCn1c(N)c(N(CCOC)C(=O)COC(=O)[C@@H](C)Oc2ccc(Cl)cc2)c(=O)[nH]c1=O,C12902416_decoy,TRY1,Decoy,0,-8.16097,-7.18,-4.48,-8.517564559307779
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3OC)n2)s1,C59018939_decoy,TRY1,Decoy,0,-9.9749,-7.68,-5.52,-7.405952861311782
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(/C)c3ccc(OC)cc3OC)n2)s1,C59022846_decoy,TRY1,Decoy,0,-9.82267,-7.51,-4.24,-7.776034407477386
CC[C@H](C)Sc1nnc(NC(=O)CSc2nc(N/N=C/c3ccc(OC)c(OC)c3)n[nH]2)s1,C21039179_decoy,TRY1,Decoy,0,-11.1011,-7.22,-2.94,-8.474820740908877
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccccc3SCc3ccccc3)n[nH]2)cn1,C59831922_decoy,TRY1,Decoy,0,-8.26315,-6.97,-3.71,-6.5536561006716045
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCCCC)s3)n[nH]2)cn1,C59831969_decoy,TRY1,Decoy,0,-10.2168,-6.96,-3.59,-9.58306893315282
CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cnn(CCOC)c4)n3)cc2s1,C59887023_decoy,TRY1,Decoy,0,-10.8771,-5.56,-3.43,-6.269187121594832
CC[NH+](CC)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)N[C@@H](C)c1ccccc1,C06193013_decoy,TRY1,Decoy,0,-9.42592,-7.13,-3.81,-7.44211135549928
COc1cc(/C=N/NC(=O)Cc2nnc(N)s2)cc(Cl)c1OCCOCCOc1cccc(C)c1,C08772121_decoy,TRY1,Decoy,0,-10.089,-6.93,-4.26,-7.305408526611405
CCOC(=O)c1c(NC(=O)COC(=O)c2ccccc2NCc2ccco2)sc(C(=O)NC)c1C,C09023145_decoy,TRY1,Decoy,0,-9.49056,-6.28,-4.95,-6.330970510472822
CCN(CCCNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1cccc(C)c1,C09692616_decoy,TRY1,Decoy,0,-9.26178,-7.02,-3.79,-6.2336661368418085
CCOCCOc1ccccc1C(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,C09696438_decoy,TRY1,Decoy,0,-10.0072,-6.59,-2.86,-6.964924371938594
CCCCCN(CC(=O)N[C@H](C)c1ccc2c(c1)OCCO2)c1c(N)n(CCCC)c(=O)[nH]c1=O,C11339223_decoy,TRY1,Decoy,0,-9.18328,-6.74,-2.67,-7.841148043638474
COc1ccccc1COC[C@@H](O)C[NH+](C[C@H](O)COCc1ccccc1OC)C12CC3CC(CC(C3)C1)C2,C12801188_decoy,TRY1,Decoy,0,-9.48166,-8.29,-3.29,-9.625457685011847
CCOc1ccc(NCc2cccn2-c2nnc(N3CCC(C(=O)NCC[NH+](CC)CC)CC3)s2)cc1,C09972088_decoy,TRY1,Decoy,0,-10.7832,-5.61,-3.24,-7.142255631628545
[NH3+]CCCCCNc1nc(Nc2ccc([N+](=O)[O-])cc2)nc(OC(C(F)(F)F)C(F)(F)F)n1,C09554143_decoy,TRY1,Decoy,0,-8.50863,-5.74,-3.69,-6.949037910826018
CCCCN(C(=O)C[NH+](C)CCOc1ccccc1C)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C15099408_decoy,TRY1,Decoy,0,-7.20126,-5.2,-3.09,-5.206538709294716
CCc1ccccc1NC(=O)N(CCOC)Cc1nc(C(=O)N[C@@H](C)CCC[NH+](CC)CC)cs1,C16459685_decoy,TRY1,Decoy,0,-8.73156,-5.86,-3.47,-6.288293948947538
CCCCCCNC(=S)Nc1cc([N+](=O)[O-])ccc1N(CCO)C(=S)NCCCCCC,C16638104_decoy,TRY1,Decoy,0,-8.94944,-5.59,-3.53,-6.461426285289578
CCCC[NH+](CCCC)CCCN1C(=O)C(O)=C(C(=O)c2ccccc2)[C@@H]1c1ccc(O)c(OC)c1,C08695199_decoy,TRY1,Decoy,0,-7.8021,-6.61,-3.87,-7.366106271180331
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCn2c(-c3ccc(OCC)cc3)n[nH]c2=S)cc1,C18071553_decoy,TRY1,Decoy,0,-9.03038,-6.65,-2.16,-6.749104677567777
Cc1cc(C=O)c(O)c(CN(CC[NH+](Cc2ccco2)Cc2cc(C)cc(C=O)c2O)Cc2ccco2)c1,C19370085_decoy,TRY1,Decoy,0,-9.21023,-5.42,-4.59,-6.900260019477699
COc1ccc(CCN/C(=N/C(=S)NCCCN2CCOCC2)Nc2nc(C)cc(C)n2)cc1,C14157096_decoy,TRY1,Decoy,0,-8.73657,-5.83,-2.63,-6.576381270551058
CCCCCN(C(=O)Cc1csc(-c2ccc(OC)cc2)n1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C24281583_decoy,TRY1,Decoy,0,-8.31977,-4.95,-3.17,-7.374127075432625
CCCCC[C@H](O)/C=C/C=C/CCCCCCCC(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C27643534_decoy,TRY1,Decoy,0,-11.7084,-4.96,-3.21,-6.7074577549932926
CCCCC[C@H](O)/C=C/C=C/CCCCCCCC(=O)NNC(=O)CCCC[C@H]1SC[C@@H]2NC(=O)N[C@@H]21,C27643547_decoy,TRY1,Decoy,0,-11.8759,-7.05,-3.6,-7.740235046684658
CCOC(=O)c1c(-c2ccc(C)o2)csc1NC(=O)COc1ccccc1C(=O)NCC[NH+](C)C,C32679071_decoy,TRY1,Decoy,0,-7.30978,-5.53,-2.65,-6.718379025962975
COCCn1c([C@@H](C)N(CCCCCC[NH3+])C(=O)c2cccc(C(F)(F)F)c2)nc2ccccc2c1=O,C33533208_decoy,TRY1,Decoy,0,-9.01891,-5.23,-4.5,-6.495938853911296
O=C(NCC[NH+]1CCCC1)[C@H](C[NH+](Cc1ccc2c(c1)OCO2)C[C@@H]1CCCO1)Oc1ccccc1F,C34708258_decoy,TRY1,Decoy,0,-9.84726,-7.7,-2.28,-8.304267109969032
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@H]2c2ccc(OCC(N)=O)cc2)cc1C,C34917259_decoy,TRY1,Decoy,0,-9.30963,-5.92,-1.73,-6.635640786502508
CCCCC(=O)Nc1ccc(N2CCN(c3ccccc3OC)CC2)c(C(=O)NCCC[NH+](C)C)c1,C35265039_decoy,TRY1,Decoy,0,-8.97282,-5.96,-3.05,-6.049434835426091
CCCNC(=O)N1CCN(c2cc(Cl)nc(SCC(=O)N[C@H](C)CCC[NH+](CC)CC)n2)CC1,C35318038_decoy,TRY1,Decoy,0,-9.44703,-5.61,-3.87,-5.666692324992043
C=CC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)COc1ccccc1C,C35747111_decoy,TRY1,Decoy,0,-9.07643,-6.94,-1.97,-7.060778099570796
C=CCOC[C@@H](O)C[NH+](Cc1ccccc1)Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1,C35747293_decoy,TRY1,Decoy,0,-9.52239,-6.91,-2.98,-7.686550316272677
COCCCNC(=O)c1csc(C[NH+](CCc2c[nH]c3ccccc23)Cc2ccc(OC)cc2OC)n1,C35815283_decoy,TRY1,Decoy,0,-8.34201,-6.25,-2.61,-6.823722145269929
C=CC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCN(Cc1ccccc1)C3)C[C@H](O)COCC(C)C,C36155955_decoy,TRY1,Decoy,0,-9.63845,-7.17,-3.7,-6.506316141799216
COc1ccc(-c2csc3nc(C[NH+](CCC(C)C)C[C@H](O)COC(C)C)[nH]c(=O)c23)cc1OC,C36206027_decoy,TRY1,Decoy,0,-9.68197,-5.16,-2.73,-6.470200090339265
CCc1c(C(=O)OC)sc2nc(C[NH+](Cc3ccco3)C[C@@H](O)COc3ccccc3)[nH]c(=O)c12,C36207299_decoy,TRY1,Decoy,0,-8.42819,-5.7,-1.91,-5.687813770826541
C=CCOC(=O)c1sc2nc(C[NH+](CCCOC)C[C@H](O)COc3ccccc3C)[nH]c(=O)c2c1C,C36207371_decoy,TRY1,Decoy,0,-8.4807,-5.8,-3.44,-6.738388460282406
C=CC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@H](O)COc1ccc(Cl)cc1,C36207469_decoy,TRY1,Decoy,0,-9.69821,-7.12,-3.43,-6.623144568866992
COCCC[NH+](Cc1nc2scc(-c3ccc(C)cc3)c2c(=O)[nH]1)C[C@H](O)COCc1ccco1,C36207651_decoy,TRY1,Decoy,0,-7.99096,-7.95,-4.16,-6.8498634583008
CCCCCN(C(=O)CCC(=O)OCc1ccc(C(C)C)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C12859413_decoy,TRY1,Decoy,0,-8.25239,-7.41,-2.25,-7.523589342246538
COc1ccc(-c2nc(C[NH+]3CCC(C(=O)NCC[NH+](CC(C)C)CC(C)C)CC3)c(C)o2)cc1OC,C08597485_decoy,TRY1,Decoy,0,-10.0015,-6.08,-2.57,-7.596580933343647
COCCC(=O)N[C@@H]1c2cc(N[C@H](C)COC)c[nH+]c2N(CCc2c[nH]c3ccccc23)[C@@H]1C(=O)OC,C39352446_decoy,TRY1,Decoy,0,-8.66543,-6.17,-2.22,-7.8632860024022255
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)o2)[C@H]1c1ccc(OCC(N)=O)cc1,C40019049_decoy,TRY1,Decoy,0,-8.55791,-6.79,-4.42,-7.060197413364249
C[C@H](CC(=O)Nc1nc(NC(=O)C[C@H](C)CC(C)(C)C)nc(NC(=O)C[C@H](C)CC(C)(C)C)n1)CC(C)(C)C,C15777065_decoy,TRY1,Decoy,0,-9.79089,-7.44,-3.75,-9.65856769790116
Cc1cc(C(C)(C(=O)COCOCCOCCO)c2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O,C44830509_decoy,TRY1,Decoy,0,-9.3086,-7.07,-4.13,-7.056186065197519
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc([N+](=O)[O-])cc3)n2)s1,C58993658_decoy,TRY1,Decoy,0,-10.0877,-6.67,-2.5,-6.835350241901007
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)NCc3cccc(OC)c3OC)n[nH]2)cc1,C59005592_decoy,TRY1,Decoy,0,-8.91312,-7.1,-3.51,-6.229916196944861
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(N(CC)CC)cc2)n1,C59005914_decoy,TRY1,Decoy,0,-11.0278,-6.49,-3.02,-6.718712268248812
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(/C)c3ccc(OC)c(OC)c3)n2)s1,C59016172_decoy,TRY1,Decoy,0,-9.87557,-7.39,-3.73,-7.411619492615668
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C(/C)c2ccc(OC)cc2OC)n1,C59022888_decoy,TRY1,Decoy,0,-10.3269,-8.02,-2.84,-9.667939631557193
CCOc1ccc(CN(CCCn2cc[nH+]c2)C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)cc1,C59264652_decoy,TRY1,Decoy,0,-9.17945,-5.35,-2.39,-7.377306735169007
COc1cc(C(=O)NC(=S)NCCCNc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1OC,C59438359_decoy,TRY1,Decoy,0,-9.44839,-6.31,-3.73,-6.916181873019044
C=CCn1nc(C)c(/C=N/Nc2nc(SCCC(=O)NC(c3ccccc3)c3ccccc3)n[nH]2)c1C,C59831424_decoy,TRY1,Decoy,0,-10.4824,-8.35,-3.52,-8.25871479260435
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc4nc(SCCC)sc4c3)n[nH]2)cn1,C59831985_decoy,TRY1,Decoy,0,-11.6034,-6.27,-2.85,-7.226703125627528
C=CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cnn(CC=C)c4)n3)cc2s1,C59832002_decoy,TRY1,Decoy,0,-9.23239,-6.28,-3.42,-6.004672516197563
CCc1nnc(NC(=O)CSc2nnc(CNc3ccc(OC)cc3)n2-c2ccc(OC)cc2)s1,C02074491_decoy,TRY1,Decoy,0,-10.2206,-8.59,-3.13,-7.748558587957271
O=C(COC(=O)c1cccnc1SCC(=O)Nc1ccccc1OC(F)F)NC[C@H]1CCCO1,C08824750_decoy,TRY1,Decoy,0,-8.91537,-7.78,-2.33,-6.979832693997903
Cc1cc(C(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(F)cc2)[C@@H](C)O)c(C)n1Cc1ccco1,C09455216_decoy,TRY1,Decoy,0,-7.38258,-7.52,-2.84,-6.543311885602535
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1C,C09603665_decoy,TRY1,Decoy,0,-7.87347,-6.58,-4.65,-5.485006285818783
CCn1c(SCC(=O)OCC(=O)Nc2ccccc2C(=O)NC2CC2)nnc1-c1cccs1,C09620487_decoy,TRY1,Decoy,0,-8.26311,-7.12,-3.49,-7.188114745583057
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@@H](C)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C,C10021977_decoy,TRY1,Decoy,0,-6.90992,-7.18,-2.76,-6.523349260183029
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@H](C)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C,C10021979_decoy,TRY1,Decoy,0,-6.43551,-7.35,-2.83,-6.088431098665397
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)Cc1csc(-c2ccc(OC)c(OC)c2)n1,C10417837_decoy,TRY1,Decoy,0,-9.67831,-6.96,-2.75,-7.360222670753346
COCCNC(=O)NC(=O)COC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1,C11071562_decoy,TRY1,Decoy,0,-9.2029,-6.56,-1.94,-6.568477157074796
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cc(OC)c(OC)cc2NC(=O)C(C)(C)C)c1C,C11170415_decoy,TRY1,Decoy,0,-8.85131,-6.54,-3.55,-6.106502190825486
COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)OCC(=O)NCCc2ccc3c(c2)OCCO3)cc1,C11747820_decoy,TRY1,Decoy,0,-9.81799,-8.95,-4.38,-9.570208867836492
C=CCN(C(=O)CCC(=O)Nc1cc(C)on1)[C@@H](C(=O)NC1CCCC1)c1cccc(OC)c1,C13505749_decoy,TRY1,Decoy,0,-8.06606,-6.54,-2.07,-6.698055973283674
CCc1ccc(CNc2cnc3c(c2)c(NC(=O)c2ccco2)c(C(=O)OC)n3CCOC)o1,C14535434_decoy,TRY1,Decoy,0,-8.60321,-7.39,-3.67,-8.431302984087072
CCOc1ccc(Br)cc1C(=O)NC(=S)N1CCNC(=O)[C@H]1CC(=O)OCCOC,C14655618_decoy,TRY1,Decoy,0,-8.15114,-6.0,-2.21,-6.040644661880046
COC(=O)c1c(NC(=O)[C@@H]2CCOC2)c2cc(NCc3cccc(C)n3)cnc2n1CCCc1ccccc1,C14742550_decoy,TRY1,Decoy,0,-8.56151,-6.63,-2.39,-5.977214266162163
COC(=O)c1c(NC(=O)[C@H]2CCOC2)c2cc(NCc3cnn(C)c3)cnc2n1CCCc1ccccc1,C14746291_decoy,TRY1,Decoy,0,-9.48974,-5.74,-1.95,-7.274274794836244
COc1ccccc1C(=O)NC(=O)COC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccccc1F,C16043937_decoy,TRY1,Decoy,0,-8.51141,-7.43,-3.13,-6.930587152274627
C=CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nnc1[C@H](NC(=O)c1ccc(C)cc1)C(C)C,C16345486_decoy,TRY1,Decoy,0,-10.2365,-8.18,-2.17,-7.983770534497338
CCOc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(=O)NCCOC)CCCC3)cc1OC,C19040901_decoy,TRY1,Decoy,0,-11.0022,-6.85,-2.52,-7.603269346078285
CCOC(=O)C1=C(COC(=O)CCC(=O)c2ccc3c(c2)CCC3)NC(=O)N[C@@H]1c1ccco1,C19190277_decoy,TRY1,Decoy,0,-8.89893,-7.72,-2.4,-6.91872164139914
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2ccc(OC)cc2)c1C,C09178393_decoy,TRY1,Decoy,0,-7.07569,-5.3,-2.67,-4.806755013779667
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@H]2c2ccc(OC)cc2)c1C,C09178389_decoy,TRY1,Decoy,0,-8.5306,-6.69,-1.7,-7.872347415707023
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@H]2c2cc(OC)c(OC)cc2OC)c(O)c1,C20309751_decoy,TRY1,Decoy,0,-9.19663,-6.27,-3.28,-7.716582045509426
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2ccc(OC)c(OC)c2OC)c(O)c1,C20309761_decoy,TRY1,Decoy,0,-7.20944,-5.29,-3.55,-5.639644841115768
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1C(=O)OCC(=O)c1ccc(SC)c(NC(C)=O)c1,C21760698_decoy,TRY1,Decoy,0,-8.30718,-7.67,-3.39,-7.283006392567041
CCOC(=O)C1=C(COC(=O)c2ccccc2SCc2cscn2)NC(=O)N[C@@H]1c1ccco1,C22868634_decoy,TRY1,Decoy,0,-8.45398,-6.73,-2.05,-7.628132354063357
CCOc1ccc(C(=O)NCC(=O)O[C@@H](C)C(=O)Nc2ncc(Cl)cc2Cl)cc1OCC,C23536740_decoy,TRY1,Decoy,0,-8.42323,-7.77,-3.14,-7.562695730736536
CCCCn1c(=O)n(C[C@H](O)COc2ccc3ccccc3c2)c(=O)c2c1nc(CO)n2CCC,C24972430_decoy,TRY1,Decoy,0,-8.23355,-7.76,-3.92,-6.976047060218298
CCCOc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)CNS(=O)(=O)c2ccccc2)cc1,C02519959_decoy,TRY1,Decoy,0,-8.5207,-8.37,-1.7,-7.2335728805519075
COc1ccc([C@H](CC(=O)[O-])Cc2csc(CCCCNc3cc(N4CCOCC4)cc[nH+]3)n2)cn1,C28568817_decoy,TRY1,Decoy,0,-8.73083,-6.43,-4.4,-5.777057308813883
CCOc1ccccc1C(=O)NCC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F,C28811205_decoy,TRY1,Decoy,0,-6.8605,-7.14,-2.5,-5.844621425817328
CC(C)(C)c1ccc(OCCNC(=O)c2ccccc2OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1,C30953081_decoy,TRY1,Decoy,0,-7.77701,-7.07,-1.69,-7.429788198938757
COC(=O)COc1ccc(/C=N\NC(=O)[C@H](NC(=O)c2ccc(Cl)cc2Cl)C(C)C)cc1OC,C30961670_decoy,TRY1,Decoy,0,-7.48745,-7.41,-3.17,-6.419375090119549
CCOc1cc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCC[NH+](CC)CC)ccc1O,C35484780_decoy,TRY1,Decoy,0,-9.24934,-5.85,-1.73,-6.523002963173565
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC[NH+](C)C)N2[C@H]1c1cc(OC)ccc1OC,C35694430_decoy,TRY1,Decoy,0,-7.42298,-4.96,-2.56,-5.169120760655566
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC[NH+](C)C)N2[C@H]1c1cccc(OC)c1OC,C35696184_decoy,TRY1,Decoy,0,-7.07097,-3.53,-3.1,-5.0961627988358815
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@@H](C(=O)NC(C)(C)C)c1cc([N+](=O)[O-])ccc1Cl,C36519443_decoy,TRY1,Decoy,0,-7.30146,-4.83,-1.95,-6.275657719188741
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@@H]1c1ccccc1OC,C12468549_decoy,TRY1,Decoy,0,-7.43132,-6.55,-2.04,-7.202686610270393
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)OCC(=O)N[C@H]1CCC[C@@H](C)[C@H]1C,C08685052_decoy,TRY1,Decoy,0,-8.59353,-7.19,-3.39,-6.8249597460580045
C=CCn1c(CCC(=O)Nc2ccccc2Cl)nnc1S[C@H](C)C(=O)Nc1nnc(C2CC2)s1,C39767909_decoy,TRY1,Decoy,0,-10.3396,-8.08,-2.32,-8.396058214338126
C=CCn1c(CCC(=O)Nc2ccc(C)c(Cl)c2)nnc1S[C@@H](CC)C(=O)Nc1nnc(C)s1,C39768044_decoy,TRY1,Decoy,0,-10.8392,-5.11,-2.08,-6.756764534016097
C=CCn1c(CC(=O)Nc2ccccc2CC)nnc1SCC(=O)Nc1nnc(C(C)C)s1,C39773160_decoy,TRY1,Decoy,0,-10.4187,-7.11,-3.91,-9.172510176781426
CCOC(=O)C1=C(C)[C@@H](C(=O)OCC)S[C@H]1NC(=O)CSc1nc(-c2ccncc2)n[nH]1,C39963617_decoy,TRY1,Decoy,0,-8.25887,-5.28,-2.44,-5.550750858629449
CCOc1ccccc1NC(=O)C1=C(C)Nc2nc(SCC)nn2[C@@H]1c1ccc(OCC)c(OCC)c1,C41022478_decoy,TRY1,Decoy,0,-9.84232,-5.36,-3.0,-7.356916779059831
CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSc1nnc2c3ccccc3n(C)c2n1,C02187547_decoy,TRY1,Decoy,0,-8.80889,-6.79,-2.3,-6.156480799837059
CCCCCCOc1ccc([C@H]2C(C(=O)Nc3cccc(C)c3C)=C(C)Nc3nnnn32)cc1OCC,C54614026_decoy,TRY1,Decoy,0,-8.2128,-6.8,-3.78,-6.057838511070152
CCOC(=O)COc1ccc(/C=N/NC(=O)CC[C@@H](O)c2ccc(OCC)cc2)cc1OCC,C58894338_decoy,TRY1,Decoy,0,-9.47229,-6.97,-2.14,-7.830169322628896
CCOc1ccc(N2C(C(C)=O)=NN(c3ccc(OC)cc3)[C@@H]2c2ccc(OCC(N)=O)c(OC)c2)cc1,C59720007_decoy,TRY1,Decoy,0,-9.42522,-5.25,-2.74,-6.507721746753618
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)CC1,C60154904_decoy,TRY1,Decoy,0,-8.00729,-5.75,-2.07,-5.533930921145344
CCCCOC(=O)C[C@H]1C(=O)NCCN1C(=O)CNc1ccc(C(=O)N(CCC)CCC)cc1,C66082288_decoy,TRY1,Decoy,0,-7.82126,-5.95,-2.25,-5.809000458641078
C[C@@H](O)C[NH2+]CCNc1ccc(NCC[NH2+]C[C@@H](C)O)c2c1C(=O)c1c(O)ccc(O)c1C2=O,C05386711_decoy,TRY1,Decoy,0,-8.52818,-6.06,-3.86,-5.824905955490952
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CS/C(=C/C[NH3+])CCCCC[NH3+])[C@@H](O)[C@@H]1O,C12502717_decoy,TRY1,Decoy,0,-10.5488,-7.16,-3.66,-8.71438852902289
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CS/C(=C/C[NH3+])CCCCC[NH3+])[C@@H](O)[C@@H]1O,C12502722_decoy,TRY1,Decoy,0,-9.28455,-7.19,-3.82,-7.270079744589352
CN(CC[C@H]([NH3+])CC(=O)N[C@H]1C=C[C@H](N2C=C[C@@](N)(O)NC2=O)O[C@@H]1C(=O)[O-])C(N)=[NH2+],C12504450_decoy,TRY1,Decoy,0,-8.1141,-7.43,-2.6,-5.994207629575627
Nc1nc(N)c2nc(-c3ccc([N+](=O)[O-])cc3)c(NCCC[NH2+]CCC[NH3+])nc2n1,C13212518_decoy,TRY1,Decoy,0,-9.56157,-6.59,-3.0,-7.449386562319315
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CS[C@H](CC[NH3+])CCCCC[NH3+])[C@@H](O)[C@@H]1O,C05487117_decoy,TRY1,Decoy,0,-9.97758,-7.02,-3.81,-8.00390952786569
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CS[C@H](CC[NH3+])CCCCC[NH3+])[C@H](O)[C@H]1O,C16941048_decoy,TRY1,Decoy,0,-9.13093,-7.12,-4.61,-9.003842953871706
NC(=[NH2+])[C@H]1CN(CCCCCCCCCCN2C[C@@H](C(N)=[NH2+])C(=O)NC2=O)C(=O)NC1=O,C16958507_decoy,TRY1,Decoy,0,-9.31141,-7.14,-4.59,-6.750459717478654
C[C@H](O)C[NH2+]CCNc1ccc(NCC[NH2+]C[C@@H](C)O)c2c1C(=O)c1c(O)ccc(O)c1C2=O,C17124445_decoy,TRY1,Decoy,0,-7.43847,-7.17,-3.31,-8.51663084607997
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CS/C(=C/C[NH3+])CCCCC[NH3+])[C@@H](O)[C@H]1O,C34921303_decoy,TRY1,Decoy,0,-9.61909,-6.51,-2.23,-7.685022781187687
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CS/C(=C/C[NH3+])CCCCC[NH3+])[C@@H](O)[C@H]1O,C34921307_decoy,TRY1,Decoy,0,-8.92318,-7.63,-2.04,-7.871282006752595
C[NH+](CCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)CCCNc1ccc(NN[NH3+])cc1[N+](=O)[O-],C28631130_decoy,TRY1,Decoy,0,-10.0648,-6.37,-3.92,-6.8870425855488815
O=C(N/N=C/[C@H](O)[C@H](O)[C@@H](COC[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33897335_decoy,TRY1,Decoy,0,-8.03715,-7.16,-3.38,-7.0881154262714885
O=C(N/N=C/[C@H](O)[C@@H](O)[C@@H](COC[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33957510_decoy,TRY1,Decoy,0,-8.64015,-7.96,-3.94,-8.318994548961665
CN(CC[C@@H]([NH3+])CC(=O)N[C@H]1C=C[C@H](n2ccc(N)nc2=O)O[C@@H]1C(=O)[O-])C(N)=[NH2+],C01612188_decoy,TRY1,Decoy,0,-10.5021,-5.61,-2.19,-7.950810728468841
CN(CC[C@H]([NH3+])CC(=O)N[C@@H]1C=C[C@H](n2ccc(N)nc2=O)O[C@@H]1C(=O)[O-])C(N)=[NH2+],C03869446_decoy,TRY1,Decoy,0,-8.44704,-7.48,-3.4,-7.081722943220603
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[NH2+]CCO)ccc(NCC[NH2+]CCO)c21,C03794794_decoy,TRY1,Decoy,0,-9.13494,-7.28,-2.56,-9.161891693756628
[H]/N=C(/NCCCCCC/[NH+]=C(N)/N=C(\N)Nc1ccc(Cl)cc1)N/C(N)=N/c1ccc(Cl)cc1,C18098320_decoy,TRY1,Decoy,0,-9.48364,-8.09,-4.55,-8.04392808673391
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO[P@@](=O)([O-])OC(=O)[C@H]([NH3+])CC(=O)[O-])[C@@H](O)[C@H]1O,C03871604_decoy,TRY1,Decoy,0,-7.56065,-6.36,-1.8,-7.615853644066592
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO[P@@](=O)([O-])OC(=O)[C@H]([NH3+])CC(=O)[O-])[C@@H](O)[C@@H]1O,C03871606_decoy,TRY1,Decoy,0,-6.87048,-7.29,-1.96,-6.962681993480288
O=NN(CCCN(N=O)C(=O)Nc1c[nH]c(=O)[nH]c1=O)C(=O)Nc1c[nH]c(=O)[nH]c1=O,C04887299_decoy,TRY1,Decoy,0,-6.32788,-5.91,-3.18,-6.910047394787617
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C06073449_decoy,TRY1,Decoy,0,-9.74283,-6.45,-1.99,-7.265887206095183
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C06073450_decoy,TRY1,Decoy,0,-8.51153,-6.55,-2.11,-8.122532144033075
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C06073472_decoy,TRY1,Decoy,0,-9.20651,-5.88,-1.65,-6.146493829773871
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C06073474_decoy,TRY1,Decoy,0,-9.20534,-7.46,-2.06,-8.570375338060312
COCCNC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06905086_decoy,TRY1,Decoy,0,-8.28341,-7.35,-1.52,-8.42506817294303
C=CCSc1nc(N)c(C(c2ccc([N+](=O)[O-])cc2)c2c(N)nc(SCC=C)[nH]c2=O)c(=O)[nH]1,C08426370_decoy,TRY1,Decoy,0,-7.39668,-5.76,-1.6,-5.958231859189893
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C08872275_decoy,TRY1,Decoy,0,-9.23623,-7.71,-1.06,-8.09700622664054
OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C08872276_decoy,TRY1,Decoy,0,-9.72237,-9.22,-2.61,-8.169536128734517
OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C09296493_decoy,TRY1,Decoy,0,-9.19645,-5.91,-2.31,-6.391257234609675
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccc(Cl)cc2)nnn1-c1nonc1N,C09309081_decoy,TRY1,Decoy,0,-8.81832,-6.6,-2.87,-6.776978626051774
CCCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C10004143_decoy,TRY1,Decoy,0,-7.73304,-6.92,-3.01,-9.024268847326228
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C12660329_decoy,TRY1,Decoy,0,-8.37314,-7.85,-2.97,-7.2650597164093025
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C08740529_decoy,TRY1,Decoy,0,-7.76318,-7.98,-1.44,-7.642561353064983
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H](O)[C@@H]1O,C13451108_decoy,TRY1,Decoy,0,-10.9186,-6.98,-4.65,-7.177919377717154
OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1,C13548729_decoy,TRY1,Decoy,0,-8.68966,-7.72,-2.76,-8.46040608238464
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C13548749_decoy,TRY1,Decoy,0,-8.64682,-8.45,-0.91,-8.129265875751177
O=C(/C=C\c1ccc(O)c(O)c1)O[C@H]1C[C@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H](O)[C@H]1O,C15657687_decoy,TRY1,Decoy,0,-9.33057,-6.93,-4.31,-6.456154851795188
OCC(CO)(CO)Nc1nc(NN=Cc2ccc(Cl)cc2)nc(NN=Cc2ccc(Cl)cc2)n1,C16400453_decoy,TRY1,Decoy,0,-11.2355,-8.38,-2.38,-10.6592743429936
CC(=O)NNc1nc(C)c(C(/C=C/c2cccc([N+](=O)[O-])c2)=N/NC(=S)NN)s1,C16958131_decoy,TRY1,Decoy,0,-9.57478,-7.49,-2.99,-8.614850011066586
NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c(NCc2ccco2)cc1Cl,C22059743_decoy,TRY1,Decoy,0,-7.89601,-7.44,-3.6,-6.879605243358458
NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c(NCc2ccco2)cc1Cl,C22059753_decoy,TRY1,Decoy,0,-4.92208,-6.84,-2.48,-4.455132382213846
O=C(CO)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@H]1O,C22065030_decoy,TRY1,Decoy,0,-5.41119,-6.65,-2.83,-5.104363229870969
O=C(CO)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@H]1O,C22065032_decoy,TRY1,Decoy,0,-5.92802,-5.86,-2.83,-4.943301761600882
O=C(CCc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C22065240_decoy,TRY1,Decoy,0,-5.42044,-8.14,-3.19,-6.495919462574124
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33745451_decoy,TRY1,Decoy,0,-5.72599,-6.07,-1.4,-4.260093310915959
COc1cc([C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](CO)c2ccc(O)c(OC)c2)ccc1O,C35271363_decoy,TRY1,Decoy,0,-7.76468,-5.2,-3.26,-5.078668319829887
COc1cc(C[C@@H](CO)[C@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)Cc2ccc(O)c(OC)c2)ccc1O,C35455227_decoy,TRY1,Decoy,0,-9.74711,-6.81,-2.56,-7.98702505255734
CC(=C\C(=O)[O-])/C=C(\C)C[C@@H](C)CCCC[C@H](O)[C@@H](CO)C(=O)OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1O,C35464016_decoy,TRY1,Decoy,0,-6.7011,-7.1,-4.2,-6.108171613372455
O=C(CCc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35645831_decoy,TRY1,Decoy,0,-6.57726,-8.1,-2.35,-8.274297458868356
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C08740528_decoy,TRY1,Decoy,0,-7.69263,-7.59,-3.4,-7.128955173830734
CC/C(=C\CO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C37539005_decoy,TRY1,Decoy,0,-7.01587,-5.32,-3.74,-4.96464639203627
CC(C)[C@@H](NC=O)C(=O)OC[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COC(=O)[C@H](NC=O)C(C)C,C35455715_decoy,TRY1,Decoy,0,-8.41549,-5.61,-3.11,-8.317703633181628
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1CC(O)(C(=O)[O-])C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O,C18284963_decoy,TRY1,Decoy,0,-12.0506,-9.06,-4.17,-10.560953745244554
OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O,C39560293_decoy,TRY1,Decoy,0,-6.81072,-7.81,-0.88,-6.940317442526831
CC(C)Oc1cc(Nc2nc(N[C@@H](C)c3ccc(F)cn3)nc(NC[C@@H](O)CO)c2Cl)n[nH]1,C40847156_decoy,TRY1,Decoy,0,-9.43171,-7.65,-2.89,-8.397696045928774
[NH3+]CCCCCCNc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@@](=O)([O-])O[C@H]3[C@H]2O)c(=O)[nH]1,C42854045_decoy,TRY1,Decoy,0,-8.32199,-6.5,-4.01,-5.803921371565021
O=C(/C=C/c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O)NCCCCCCNC(=O)C(F)(F)F,C43771817_decoy,TRY1,Decoy,0,-7.16418,-6.38,-2.81,-6.285711316711056
O=C(CO)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C44021696_decoy,TRY1,Decoy,0,-6.41783,-4.98,-4.48,-4.977994470395288
O=C(CO)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C44021699_decoy,TRY1,Decoy,0,-6.35698,-5.95,-3.75,-5.306026605255623
O=C(CO)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C44170569_decoy,TRY1,Decoy,0,-4.54807,-4.65,-2.38,-3.7778276773722888
O=C(CO)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C44170573_decoy,TRY1,Decoy,0,-4.56831,-5.22,-2.4,-3.9643327589304
C=CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,C09886208_decoy1,TRY1,Decoy,0,-7.42146,-7.83,,-6.483015261737927
NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c(NCc2ccco2)cc1Cl,C65742726_decoy,TRY1,Decoy,0,-5.80317,-5.49,-4.05,-5.073740253513399
O=C(CO)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C34914648_decoy,TRY1,Decoy,0,-5.24942,-5.06,-2.67,-4.651895699122544
O=C(CO)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@H]1O,C34914650_decoy,TRY1,Decoy,0,-5.22524,-5.48,-2.47,-4.793281668591163
OCC(CO)(CO)Nc1nc(N/N=C/c2ccc(Cl)cc2)nc(N/N=C/c2ccc(Cl)cc2)n1,C35958649_decoy,TRY1,Decoy,0,-11.7612,-8.84,-2.49,-10.26924916516999
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO[P@@](=O)([O-])OC(=O)[C@H]([NH3+])CC(=O)[O-])[C@@H](O)[C@H]1O,C03871605_decoy,TRY1,Decoy,0,-6.71041,-6.55,-3.16,-4.975308538479497
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO[P@@](=O)([O-])OC(=O)[C@H]([NH3+])CC(=O)[O-])[C@@H](O)[C@@H]1O,C03871607_decoy,TRY1,Decoy,0,-6.30639,-5.22,-1.77,-4.397807195783016
C=CCOC(=O)N[C@@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@H]1O,C04293708_decoy,TRY1,Decoy,0,-5.32338,-4.73,-3.18,-4.220920361105642
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@H]1O,C04293709_decoy,TRY1,Decoy,0,-5.73741,-4.86,-3.72,-4.574919421626488
C=CCOC(=O)N[C@@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O,C04293710_decoy,TRY1,Decoy,0,-6.4755,-6.1,-2.99,-6.017642384543726
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O,C04293711_decoy,TRY1,Decoy,0,-6.29677,-4.49,-2.82,-4.488201447449345
CNP1(NC)=NP(NC)(NC)=NP(NC)(NC)=NP(NC)(NC)=N1,C04742125_decoy,TRY1,Decoy,0,-2.60184,-3.66,-2.49,-3.0537322965515425
COC(=O)C1=C(C)N(NC(N)=O)C2([NH3+])N(NC(N)=O)C(C)=C(C(=O)OC)C12C(=O)OC,C01620914_decoy,TRY1,Decoy,0,-5.21451,-4.93,-1.66,-5.051294342111007
O=C(OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)cc1Cl,C12661065_decoy,TRY1,Decoy,0,-7.16068,-7.57,-2.24,-6.131795236219653
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C16124335_decoy,TRY1,Decoy,0,-7.0314,-6.6,-3.47,-5.30007282165733
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C16124338_decoy,TRY1,Decoy,0,-6.66012,-6.62,-1.92,-5.740263801943359
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C16124341_decoy,TRY1,Decoy,0,-6.71857,-5.85,-2.99,-5.235078558906924
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C16124344_decoy,TRY1,Decoy,0,-4.79252,-6.11,-4.93,-4.1372868923666
C=CCOC(=O)N[C@@H]1[C@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@@H]1O,C22047975_decoy,TRY1,Decoy,0,-5.20603,-5.86,-3.73,-4.286679994084673
C=CCOC(=O)N[C@@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@@H]1O,C22047980_decoy,TRY1,Decoy,0,-5.66363,-5.71,-2.9,-5.068249157250228
C=CCOC(=O)N[C@@H]1[C@H](O)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@@H]1O,C22047985_decoy,TRY1,Decoy,0,-5.83041,-5.53,-4.14,-4.76183767171821
C=CCOC(=O)N[C@@H]1[C@H](O)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@@H]1O,C22047990_decoy,TRY1,Decoy,0,-6.5086,-5.12,-1.46,-5.500509571821308
CC(C)CC(=O)O[C@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C[C@@H](O)[C@@](O)(CO)[C@@H]12,C31158065_decoy,TRY1,Decoy,0,-8.17079,-5.88,-1.71,-5.698086365331801
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@@H]1O,C31163228_decoy,TRY1,Decoy,0,-9.79105,-8.1,-2.04,-7.839885454695824
C/C(=C\CO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)(C)O,C31164855_decoy,TRY1,Decoy,0,-6.47478,-6.38,-3.18,-5.624452350176815
CC[C@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C(C)C,C31164871_decoy,TRY1,Decoy,0,-6.67397,-5.31,-3.52,-5.813343977577153
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C31166708_decoy,TRY1,Decoy,0,-5.73487,-8.46,-3.41,-5.873726672740145
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C31166712_decoy,TRY1,Decoy,0,-5.17285,-7.37,-1.97,-4.612599149059699
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C31166716_decoy,TRY1,Decoy,0,-6.84642,-7.81,-2.73,-5.694788593604207
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C33416003_decoy,TRY1,Decoy,0,-6.48122,-4.88,-2.45,-5.089839528419371
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C33416005_decoy,TRY1,Decoy,0,-6.16224,-4.94,-2.93,-4.540477963418682
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C33416007_decoy,TRY1,Decoy,0,-5.72096,-5.93,-2.98,-4.664330789079313
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O,C33416009_decoy,TRY1,Decoy,0,-5.14361,-4.49,-2.73,-4.535630876018765
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33650605_decoy,TRY1,Decoy,0,-7.20364,-6.08,-3.03,-6.24132793584473
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33745448_decoy,TRY1,Decoy,0,-7.3644,-5.58,-3.31,-5.419021696937302
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C35169077_decoy,TRY1,Decoy,0,-7.9586,-6.04,-3.73,-6.414424605840041
CC[C@@H](C)[C@@H]([NH3+])/C([O-])=N/S(=O)(=O)[N-]C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C35297917_decoy,TRY1,Decoy,0,-8.47897,-9.17,-1.81,-8.950106765976855
CC(C)CC(=O)O[C@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C[C@H](O)[C@](O)(CO)[C@@H]12,C35455789_decoy,TRY1,Decoy,0,-8.78207,-7.55,-2.65,-9.293370772962875
C=CCc1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35464215_decoy,TRY1,Decoy,0,-6.29161,-6.55,-2.56,-6.047885282631169
C=CCOC(=O)N[C@H]1[C@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C35636287_decoy,TRY1,Decoy,0,-5.86088,-5.5,-3.5,-4.771525133335076
C=CCOC(=O)N[C@H]1[C@@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](CO)O[C@@H]1O,C36533568_decoy,TRY1,Decoy,0,-6.12514,-6.77,-2.54,-5.816573643346537
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1[N+](=O)[O-],C37246158_decoy,TRY1,Decoy,0,-4.88816,-7.22,-1.42,-4.53316149747889
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1[N+](=O)[O-],C37246160_decoy,TRY1,Decoy,0,-4.58487,-6.63,-3.43,-4.61477256165771
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]1CO,C31156700_decoy,TRY1,Decoy,0,-10.445,-9.84,-2.7,-9.13355002595734
O=C(COC[C@@H](O)NNC1=c2ccccc2=[NH+]C1=O)NNC1=c2ccccc2=[NH+]C1=O,C16662281_decoy,TRY1,Decoy,0,-8.32498,-7.54,-2.22,-7.0974796833521046
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193619_decoy,TRY1,Decoy,0,-6.24359,-5.12,-2.42,-4.96467869671164
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193646_decoy,TRY1,Decoy,0,-6.93316,-6.64,-3.21,-6.182336179015684
CC(C)CC(CC(C)C)O[C@@H]1O[C@@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168291_decoy,TRY1,Decoy,0,-6.37291,-5.35,-3.79,-4.349612853307672
CCCCCCO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168895_decoy,TRY1,Decoy,0,-6.43058,-6.41,-3.85,-4.674700931445207
C=CCOC(=O)N[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C44699060_decoy,TRY1,Decoy,0,-5.46659,-5.61,-2.62,-4.85060604418664
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1O,C44960131_decoy,TRY1,Decoy,0,-6.78297,-6.69,-3.56,-5.808662315107508
CCC[NH+](CCC)C[C@@H]1[C@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NNN1c1nonc1N,C63426947_decoy,TRY1,Decoy,0,-9.61791,-7.42,-2.97,-8.314150946654356
CCC[NH+](CCC)C[C@H]1[C@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NNN1c1nonc1N,C63426948_decoy,TRY1,Decoy,0,-9.2482,-5.85,-2.2,-6.898193000205991
Nc1c(C(=[NH2+])N/N=C/C(Cl)(Cl)Cl)nc2ccccc2[n+]1[O-],C05605041_decoy,TRY1,Decoy,0,-8.54434,-5.15,-1.16,-4.987109518034079
Nc1c(C(=[NH2+])N/N=C/c2cccc([N+](=O)[O-])c2)nc2ccccc2[n+]1[O-],C05605044_decoy,TRY1,Decoy,0,-7.17527,-6.97,-1.63,-5.093927611879998
CC(C)N(c1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H]([NH3+])[C@@H]1O)C(C)C,C05606379_decoy,TRY1,Decoy,0,-7.31673,-5.21,-1.59,-4.913897296638258
COc1cc2c(cc1OC)[C@H]1C[C@@](CC(N)=O)(C(N)=O)CC[NH+]1CC2,C05766726_decoy,TRY1,Decoy,0,-7.55768,-5.91,-0.68,-5.13196166168707
COc1cc2c(cc1OC)[C@@H]1C[C@](CC(N)=O)(C(N)=O)CC[NH+]1CC2,C05766727_decoy,TRY1,Decoy,0,-6.25923,-4.71,-1.81,-4.434547818466413
COc1cc2c(cc1OC)[C@H]1C[C@](CC(N)=O)(C(N)=O)CC[NH+]1CC2,C01612268_decoy,TRY1,Decoy,0,-8.20478,-4.43,-0.82,-4.608713627884471
NS(=O)(=O)c1ccc(CC/[NH+]=C/C2C(=O)NC(=O)NC2=O)cc1,C03877991_decoy,TRY1,Decoy,0,-7.64053,-5.03,-1.6,-5.187732125401595
CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@@H](O)[C@H](O)[C@@H]1[NH3+],C04531015_decoy,TRY1,Decoy,0,-6.97197,-5.43,-2.15,-5.383979224196649
C[NH+](C)CCNC(=O)Nc1sc2c(c1C(N)=O)CC(C)(C)OC2,C06670098_decoy,TRY1,Decoy,0,-7.18526,-5.23,-3.19,-4.611986590377373
NC(=O)c1c(NC(=O)N2CC[NH+](CCO)CC2)sc2c1CCCC2,C06759142_decoy,TRY1,Decoy,0,-8.22162,-6.65,-1.01,-5.519525672309396
C[C@H]1CCc2c(sc(NC(=O)CN3CC[NH2+]CC3)c2C(N)=O)C1,C19497184_decoy,TRY1,Decoy,0,-8.41319,-6.42,-2.39,-5.558450184485224
Cc1n[nH]c(=O)c2c(NC(=O)C[NH+]3CCC(C(N)=O)CC3)oc(C)c12,C22134480_decoy,TRY1,Decoy,0,-8.36511,-5.51,-2.36,-5.529110807960668
C[C@@H]1C[C@@H](C)CN(C(=O)C[NH+]2CCN(Cc3nc(N)nc(N)n3)CC2)C1,C23371484_decoy,TRY1,Decoy,0,-8.17309,-6.32,-1.83,-6.334004850979176
C[C@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN(Cc3nc(N)nc(N)n3)CC2)C1,C23371491_decoy,TRY1,Decoy,0,-8.23713,-7.6,-2.44,-7.641633587639159
Nc1nc(N)nc(C[NH+]2CCN(Cc3ccc(Cl)s3)CC2)n1,C23478531_decoy,TRY1,Decoy,0,-8.82958,-7.38,-2.08,-7.079121089042857
C[C@@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN(Cc3nc(N)nc(N)n3)CC2)C1,C23371487_decoy,TRY1,Decoy,0,-7.79925,-7.7,-1.46,-7.800446795479352
CNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC)[C@@H]1CCCC[C@@H]1C,C31468873_decoy,TRY1,Decoy,0,-7.75624,-4.91,-0.76,-5.242437070899181
CNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC)[C@H]1CCCC[C@@H]1C,C31468877_decoy,TRY1,Decoy,0,-8.16774,-6.0,-1.72,-5.7957970777604855
CNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC)[C@H]1CCCC[C@H]1C,C31468886_decoy,TRY1,Decoy,0,-6.38883,-7.3,-2.43,-6.3469990381435455
NC(=O)c1c(NC(=O)CC[NH+]2CCC(O)CC2)sc2c1CCCC2,C28896463_decoy,TRY1,Decoy,0,-10.3814,-6.65,-3.55,-6.420730925183271
[NH-]C(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H]([NH2+]Cc3ccco3)[C@@H]2O)CC1,C20463908_decoy,TRY1,Decoy,0,-6.45964,-6.51,-0.36,-4.7550400417572405
N[C@@H]1[C@@H]([NH3+])[C@@H](OCc2ccccc2)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]12,C35589903_decoy,TRY1,Decoy,0,-6.45964,-6.8,-1.5,-4.893364199169443
N[C@@H]1[C@@H]([NH3+])[C@@H](OCc2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@@H]12,C35589906_decoy,TRY1,Decoy,0,-6.52086,-5.08,-1.47,-4.387637878216208
Cc1c(CC(=O)NCCc2c[nH+]c[nH]2)c(=O)oc2cc(O)cc(O)c12,C08791907_decoy,TRY1,Decoy,0,-8.59795,-7.64,-1.55,-8.144837145544802
[NH3+]CC(=O)NCC(=O)Nc1cc2c(cc1Br)OCCO2,C37627457_decoy,TRY1,Decoy,0,-7.79875,-7.15,-1.16,-8.089679625914467
NC(=O)CN(Cc1ccc(Br)cc1)C(=O)[C@H]1C[C@H](O)C[NH2+]1,C37822324_decoy,TRY1,Decoy,0,-7.87029,-6.49,-1.97,-7.845143447231518
CC(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661687_decoy,TRY1,Decoy,0,-8.71582,-5.92,-1.27,-5.293209565298757
NC(=O)C[NH+]1CCC(NC(=O)NC[C@H]2COc3ccccc3O2)CC1,C40501132_decoy,TRY1,Decoy,0,-7.54136,-6.74,-0.94,-5.741212945151665
C[NH+]1CCN(Nc2ncnc(N3CCN(CCO)CC3)c2N)CC1,C40734261_decoy,TRY1,Decoy,0,-7.44165,-6.74,-1.36,-5.875918410177293
[NH3+]CC#Cc1ccc(S(=O)(=O)N(CCO)CCO)c(Cl)c1,C40751146_decoy,TRY1,Decoy,0,-8.8925,-4.77,-2.55,-5.4237604229037855
CN(c1ncnc(NNC(=O)c2ccco2)c1N)C1CC[NH+](C)CC1,C40794539_decoy,TRY1,Decoy,0,-8.07028,-4.98,-1.78,-4.816946300096651
CCn1c(-c2nonc2N)nc2cncc(C(=O)N[C@@H]3CCC[NH2+]C3)c21,C40957339_decoy,TRY1,Decoy,0,-7.84153,-6.58,-1.92,-7.3510073552720465
NC(=O)COC[C@H]([NH3+])c1cc2c(cc1Br)OCCCO2,C41072131_decoy,TRY1,Decoy,0,-7.86969,-6.2,-0.95,-6.780497163257639
Cc1ccc(C(=O)NC2CC[NH+](CCC(=O)NC(N)=O)CC2)s1,C51098516_decoy,TRY1,Decoy,0,-8.15912,-5.42,-0.62,-5.245770291398773
Cc1ncsc1C(=O)NC1CC[NH+]([C@@H](C)C(=O)NC(N)=O)CC1,C51100255_decoy,TRY1,Decoy,0,-7.62409,-4.1,-0.76,-4.671371531665532
Cc1ncsc1C(=O)NC1CC[NH+]([C@H](C)C(=O)NC(N)=O)CC1,C51100256_decoy,TRY1,Decoy,0,-8.39949,-4.02,-1.36,-5.213388043043475
Cn1c(=O)n(C)c2cc([C@H]([NH3+])CCC(N)=O)c(Br)cc21,C51952064_decoy,TRY1,Decoy,0,-7.01698,-4.7,-1.99,-3.85279443580844
Cn1c(=O)n(C)c2cc([C@H]([NH3+])CCCC(N)=O)c(Br)cc21,C51952068_decoy,TRY1,Decoy,0,-6.90295,-4.65,-1.3,-4.03446699155873
CNC(=O)NC(=O)[C@H](C)Oc1ccc(Br)cc1[C@H](C)[NH3+],C52066374_decoy,TRY1,Decoy,0,-8.01636,-6.67,-2.67,-7.238988403597273
CNC(=O)NC(=O)[C@H](C)Oc1ccc(Br)cc1[C@@H](C)[NH3+],C52066375_decoy,TRY1,Decoy,0,-9.02896,-6.54,-2.0,-8.206086573701299
Nc1nc(N)nc(CSc2nnc(C3=c4ccccc4=[NH+]C3)o2)n1,C63182437_decoy,TRY1,Decoy,0,-8.2344,-5.18,-0.72,-4.991169807600927
O=C(NCCC1=c2ccccc2=[NH+]C1)C(=O)Nc1c[nH]c(=O)[nH]c1=O,C63271111_decoy,TRY1,Decoy,0,-7.08499,-7.88,-2.98,-7.157220437643918
C[C@@H](Nc1n[nH]c(=O)[nH]c1=O)C(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39983795_decoy,TRY1,Decoy,0,-6.99459,-8.82,-3.57,-6.591106764095528
CCn1cc(NC(=O)C2CC[NH+]([C@@H](C)C(=O)NC(N)=O)CC2)cn1,C63516721_decoy,TRY1,Decoy,0,-7.50545,-6.75,-1.78,-5.552667137162573
C[C@@H]1c2c(O)cc(O)cc2OC(=O)[C@@H]1CC(=O)NCCc1c[nH+]c[nH]1,C53619575_decoy,TRY1,Decoy,0,-10.9566,-5.9,-1.08,-6.236059273015993
C[C@H]1c2c(O)cc(O)cc2OC(=O)[C@@H]1CC(=O)NCCc1c[nH+]c[nH]1,C53619579_decoy,TRY1,Decoy,0,-12.4863,-7.78,-2.23,-10.177404025297989
C[C@@H]1c2c(O)cc(O)cc2OC(=O)[C@H]1CC(=O)NCCc1c[nH+]c[nH]1,C53619582_decoy,TRY1,Decoy,0,-12.5953,-5.26,-2.66,-7.602951172725181
COc1ccc([C@H]2NO[C@@H](C3=C(N)[NH+]=N[C@@H]3SC)N2)cc1OC,C64612588_decoy,TRY1,Decoy,0,-8.59167,-4.54,-1.23,-5.571442097095286
COc1ccc([C@H]2NO[C@H](C3=C(N)[NH+]=N[C@@H]3SC)N2)cc1OC,C64612590_decoy,TRY1,Decoy,0,-8.81641,-6.1,-2.31,-5.57102348173641
O=C(CCNC(=O)[C@]12CNC[C@H]1C[NH2+]C2)Nc1cc(F)ccc1F,C65419203_decoy,TRY1,Decoy,0,-8.16921,-6.12,-1.78,-5.631944183063275
O=C(N/N=C/[C@@H](O)[C@H](O)[C@H](O)CO)c1ccccc1O,C04018058_decoy,TRY1,Decoy,0,-7.40909,-5.26,-2.68,-5.425324354436079
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1NN=C(c2ccccc2)S1,C04154611_decoy,TRY1,Decoy,0,-8.63798,-7.03,-1.98,-8.476803590991265
Nc1ccc2c(c1)C1(NC(=O)NC1=O)c1cc(N)ccc1-2,C01674730_decoy,TRY1,Decoy,0,-6.50162,-7.61,0.44,-5.840202316027497
O=C1CCCC(=O)NNC(=O)Nc2ccc(cc2)Cc2ccc(cc2)NC(=O)NN1,C04962925_decoy,TRY1,Decoy,0,-4.81147,-5.85,-4.85,-2.670098321281525
O=C1CCCC(=O)NNC(=O)NCCCCCCNC(=O)NN1,C04962926_decoy,TRY1,Decoy,0,-4.96699,-5.22,-2.67,-2.7447095781838704
Nc1nonc1NC(=O)N/N=C/c1ccc(O)cc1O,C01899191_decoy,TRY1,Decoy,0,-7.25067,-7.22,-0.4,-6.0695807965203
Oc1ccc2c(O)c3c(O)ccc(O)c3c(O)c2c1O,C05543107_decoy,TRY1,Decoy,0,-7.92019,-6.92,-0.03,-3.578619076664877
O=C1c2c(O)cc(O)c(O)c2C(=O)c2c(O)cc(O)c(O)c21,C05699363_decoy,TRY1,Decoy,0,-7.70433,-8.22,-0.71,-6.745515844429395
C[C@H](NC(=O)NC(C)(C)C)NC(=O)[C@H]([NH3+])CC(=O)[O-],C01643512_decoy,TRY1,Decoy,0,-6.86021,-5.92,-2.35,-7.391935561031492
C[C@@H](NC(=O)NC(C)(C)C)NC(=O)[C@H]([NH3+])CC(=O)[O-],C01643513_decoy,TRY1,Decoy,0,-7.48251,-6.09,-3.16,-7.547239524825335
C[C@H](NC(=O)NC(C)(C)C)NC(=O)[C@@H]([NH3+])CC(=O)[O-],C01643514_decoy,TRY1,Decoy,0,-6.91841,-5.14,-3.59,-4.652633978919451
Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1,C15206446_decoy,TRY1,Decoy,0,-6.48055,-5.35,-2.15,-7.825847988028238
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)c1nnc(Nc2ccccc2)s1,C15775161_decoy,TRY1,Decoy,0,-8.30754,-7.33,-0.63,-7.917315544488094
Cc1ccc(Nc2nnc([C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)s2)cc1,C15775163_decoy,TRY1,Decoy,0,-8.53237,-7.45,-1.43,-6.611802946868019
CSC(=S)N/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C16923537_decoy,TRY1,Decoy,0,-7.61792,-5.75,-1.25,-6.723975547251671
Nc1c(Cl)ncnc1N[C@@H]1C[C@H](CO)[C@@H](O)[C@@H]1O,C16930306_decoy,TRY1,Decoy,0,-8.37951,-5.7,-0.91,-5.4389230360807
Nc1nc2c(ncn2[C@@H]2C=C(CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C05767404_decoy,TRY1,Decoy,0,-6.9079,-7.4,-1.29,-6.358601263376872
C[C@H]1c2cc(O)c(O)c(O)c2[C@H]2[C@@H]1c1cc(O)c(O)c(O)c1[C@@H]2C,C25500428_decoy,TRY1,Decoy,0,-10.7579,-6.15,-2.15,-4.949540827671444
Nc1cc(=O)[nH]c(S[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)n1,C16928915_decoy,TRY1,Decoy,0,-7.52895,-6.09,-2.2,-7.131495667461634
Nc1cc(=O)[nH]c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)n1,C08627910_decoy,TRY1,Decoy,0,-5.39263,-6.35,-0.12,-5.509991653977861
Nc1nonc1NC(=O)N/N=C\c1ccc(O)c(O)c1,C32609457_decoy,TRY1,Decoy,0,-7.9454,-7.99,-0.74,-6.487191967638232
Cc1cc2c(cc1N)N[C@]1(O)c3ccccc3C(=O)[C@]1(O)N2,C00457773_decoy,TRY1,Decoy,0,-7.34309,-8.19,-1.01,-5.49419438446624
Cc1cc2c(cc1N)N[C@@]1(O)c3ccccc3C(=O)[C@]1(O)N2,C00457771_decoy,TRY1,Decoy,0,-6.25245,-7.23,-0.7,-4.148498521810883
Cc1cc2c(cc1N)N[C@@]1(O)c3ccccc3C(=O)[C@@]1(O)N2,C00457770_decoy,TRY1,Decoy,0,-6.55974,-6.58,-2.28,-3.447669379062942
C[C@H]1CC(=O)C2=C(C[C@H](O)[C@@]3(O)[C@@H](O)c4c(O)cccc4C(=O)[C@]23O)[C@@H]1O,C35270766_decoy,TRY1,Decoy,0,-7.4599,-6.2,-2.86,-3.0651549299084024
C[C@H]1CC(=O)C2=C(C[C@H](O)[C@@]3(O)[C@@H](O)c4c(O)cccc4C(=O)[C@]23O)[C@H]1O,C35270769_decoy,TRY1,Decoy,0,-7.90103,-6.14,-1.78,-3.079324301122813
C[C@H]1CC(=O)[C@]2(O)C3=C([C@H](O)c4c(O)cccc4C3=O)[C@H](O)[C@H](O)[C@]2(O)C1,C35458755_decoy,TRY1,Decoy,0,-9.50274,-8.0,-2.77,-4.263418667559583
C[C@@H]1CC(=O)[C@@]2(O)C3=C([C@H](O)c4c(O)cccc4C3=O)[C@H](O)[C@H](O)[C@]2(O)C1,C35458758_decoy,TRY1,Decoy,0,-9.20677,-6.35,-1.23,-3.298964348111193
[H]/N=C(\NC#N)c1sc2nc(N)nc(SC)c2c1N,C04837201_decoy,TRY1,Decoy,0,-7.17103,-6.75,0.4,-11.662617902849332
Nc1cc2c(=O)[nH]cnc2cc1NCCS(N)(=O)=O,C36744637_decoy,TRY1,Decoy,0,-7.48649,-6.24,-0.64,-7.754700324824925
CSC(=S)N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C37263618_decoy,TRY1,Decoy,0,-7.93709,-6.18,-1.22,-7.609455291983988
C[C@@H]1c2cc(O)c(O)c(O)c2[C@@H]2[C@@H]1c1cc(O)c(O)c(O)c1[C@@H]2C,C37263625_decoy,TRY1,Decoy,0,-7.6146,-6.15,-1.61,-3.747961109583438
C=CCN1C(=O)N=C([O-])/C(=C(/CC)NNC(N)=[NH2+])C1=O,C06391000_decoy,TRY1,Decoy,0,-9.18534,-6.36,-0.96,-11.090840801636205
Oc1cc2c3cc(O)c(O)cc3c3cc(O)c(O)cc3c2cc1O,C38229869_decoy,TRY1,Decoy,0,-7.53194,-8.45,-1.31,-7.939651184322613
CC1(C)[C@@H](O)C[C@H]2[C@](C)(O)[C@@H]3CC[C@@H]4[C@@H](O)[C@@]3(C[C@@H](O)[C@@]21O)C[C@]4(C)O,C38337263_decoy,TRY1,Decoy,0,-8.20634,-6.69,-1.76,-3.642237077258756
Oc1cc(/C=C/c2cc(O)c(O)c(O)c2)cc(O)c1O,C38393465_decoy,TRY1,Decoy,0,-8.38686,-6.68,-1.92,-7.987155354915706
Nc1cc(N)nc(Sc2ccc(N)c3nonc23)n1,C41023374_decoy,TRY1,Decoy,0,-7.13983,-6.28,-0.68,-6.230223940236007
Nc1ccc(=O)n(CCSc2nc(N)cc(N)n2)c1,C41023498_decoy,TRY1,Decoy,0,-6.83344,-6.18,-1.05,-5.677828185670213
Nc1nc2c(c(=O)[nH]1)N=C[C@H]2[C@H]1O[C@@H](CO)[C@H](O)[C@H]1O,C43721106_decoy,TRY1,Decoy,0,-6.43651,-7.34,-1.6,-7.70708568793142
Cc1cc(C(c2ccc(N)cc2)c2ccc(N)cc2)ccc1N,C44074980_decoy,TRY1,Decoy,0,-6.39352,-7.04,-0.48,-7.221980239871642
CCCC(CCC)(C(=O)NCCCC(N)=O)/C(N)=N/O,C44870493_decoy,TRY1,Decoy,0,-7.00176,-5.93,-4.14,-7.972886697991492
Nc1cc2c(cc1NCCCS(N)(=O)=O)NC(=O)C2,C45071222_decoy,TRY1,Decoy,0,-8.07874,-6.75,-0.67,-5.708726344635939
CC(C)CCCCCCNC(=O)NC(C(N)=O)C(N)=O,C47651146_decoy,TRY1,Decoy,0,-7.96199,-5.96,-4.29,-7.391288628951269
CCCCOCCCNC(=O)NC(C(N)=O)C(N)=O,C47677936_decoy,TRY1,Decoy,0,-7.46932,-6.02,-4.1,-7.436605926593037
Cc1nn(C)c(NN)c1CSc1nc(N)cc(=O)[nH]1,C51151175_decoy,TRY1,Decoy,0,-7.47183,-7.28,-2.83,-7.459181511292147
Nc1ccc([C@H](O)CSc2nc(N)cc(=O)[nH]2)cc1,C51325693_decoy,TRY1,Decoy,0,-7.08978,-7.29,-1.22,-6.437493252118448
Nc1ccc([C@@H](O)CSc2nc(N)cc(=O)[nH]2)cc1,C51325695_decoy,TRY1,Decoy,0,-6.89312,-7.48,-0.91,-13.889793569728562
Nc1cc(=O)[nH]c(SC[C@H](O)c2ccccc2N)n1,C51328570_decoy,TRY1,Decoy,0,-7.5231,-7.28,-0.71,-7.033703553791309
NNc1nc2c(cc(Cl)c3nc(NN)sc32)s1,C57327734_decoy,TRY1,Decoy,0,-8.88965,-6.76,-0.91,-7.186235440860388
OC1CNc2ccccc2NCC(O)CNc2ccccc2NC1,C59371428_decoy,TRY1,Decoy,0,-6.59113,-5.71,-2.43,-2.9391914156038657
C[NH+]1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(O)cc6)[nH]c5c4)[nH]c3c2)CC1,C00642589_decoy,TRY1,Decoy,0,-9.54896,-7.03,-1.06,-5.631380011758854
Oc1ccc2c3c1O[C@@H]1c4[nH]c5ccccc5c4C[C@@]4(O)[C@@H](C2)[NH+](CC2CC2)CC[C@]314,C03874479_decoy,TRY1,Decoy,0,-8.56333,-9.8,-1.23,-9.70268684823622
CC1=C([C@H](C)[C@@H]2[NH2+]C[C@@H](C)C[C@@H]2O)CC[C@H]2C3=C(C(=O)[C@H]12)[C@]1(C)CC[C@H](O)CC1=CC3,C04008414_decoy,TRY1,Decoy,0,-8.7683,-8.85,-2.12,-5.78234762935913
Cc1ccc(-n2c(O)c([C@H]3c4[nH]c5ccccc5c4CC[NH+]3C)c(=O)[nH]c2=O)c(C)c1,C08491632_decoy,TRY1,Decoy,0,-6.6916,-6.99,-3.52,-4.521598458404507
CC1(C)CC(NC(=O)[C@@H]2Cc3c([nH]c4ccccc34)[C@@H]3c4ccccc4C(=O)N32)CC(C)(C)[NH2+]1,C08790178_decoy,TRY1,Decoy,0,-7.91124,-5.95,-1.36,-4.9788829158456585
Cc1cc(Cl)cc2c1NC(=O)[C@]21[NH2+][C@H](Cc2c[nH]c3ccccc23)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C08790759_decoy,TRY1,Decoy,0,-9.58195,-7.7,-2.36,-6.032646751312916
COc1cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)cc(I)c1O,C08919601_decoy,TRY1,Decoy,0,-9.89842,-5.02,-0.95,-5.765205828303108
CC(C)[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)cc(Cl)c2O)N3)C1,C08923386_decoy,TRY1,Decoy,0,-9.66484,-7.0,-3.42,-5.561063973890503
CC[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2cc(Br)cc(C)c2O)N3)C1,C08927629_decoy,TRY1,Decoy,0,-8.82323,-5.02,-0.94,-4.213287780005487
CC[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)cc(C)c2O)N3)C1,C08927632_decoy,TRY1,Decoy,0,-8.93386,-8.45,-0.85,-8.022966627923633
C[C@@H]1C(=O)[C@@H](C)[C@H](c2cc(Br)ccc2O)[NH2+][C@@H]1c1cc(Br)ccc1O,C09059314_decoy,TRY1,Decoy,0,-9.03309,-5.1,-3.18,-5.124649916977809
C[C@@H]1C(=O)[C@H](C)[C@@H](c2cc(Br)ccc2O)[NH2+][C@@H]1c1cc(Br)ccc1O,C09059315_decoy,TRY1,Decoy,0,-9.13526,-5.77,-3.31,-6.004072796253664
COc1cc(Br)c(Br)c([C@@H]2NC(=O)c3c(sc4c3CC[NH+](C)C4)N2)c1O,C02361245_decoy,TRY1,Decoy,0,-9.3341,-5.71,-0.76,-5.935868303989976
CC[NH+]1CCc2c([nH]c3ccccc23)[C@H]1c1c(O)[nH]c(=O)n(-c2c(C)cc(C)cc2C)c1=O,C09129171_decoy,TRY1,Decoy,0,-7.49402,-6.28,-1.96,-4.737439925806696
Cc1cc(C)c(-n2c(O)nc(O)c([C@@H]3c4[nH]c5ccccc5c4CC[NH+]3C)c2=O)c(C)c1,C09087773_decoy,TRY1,Decoy,0,-7.16752,-6.55,-1.62,-5.080004636773161
Cc1ccc(-n2c(O)nc(O)c([C@@H]3c4[nH]c5ccccc5c4CC[NH+]3C)c2=O)c(C)c1,C09014128_decoy,TRY1,Decoy,0,-7.76712,-8.05,-1.22,-6.206685129831952
Cc1ccc(C)c(-n2c(S)nc(=O)c([C@@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2O)c1,C09320475_decoy,TRY1,Decoy,0,-7.31636,-8.82,-2.28,-9.475110845981288
CC1=C([C@H](C)[C@@H]2[NH2+]C[C@H](C)C[C@@H]2O)CC[C@H]2C3=C(C(=O)[C@H]12)[C@@H]1CC[C@H](O)CC1=CC3,C35023469_decoy,TRY1,Decoy,0,-9.22374,-7.98,-1.82,-5.38796348482098
CC1=C([C@H](C)[C@@H]2[NH2+]C[C@@H](C)C[C@@H]2O)CC[C@H]2C3=C(C(=O)[C@H]12)[C@@H]1CC[C@H](O)CC1=CC3,C35023471_decoy,TRY1,Decoy,0,-7.8692,-6.8,-1.17,-5.241593917325303
C[NH+]1CCC(NS(=O)(=O)c2c(N)cc(Br)cc2Br)CC1,C37267184_decoy,TRY1,Decoy,0,-8.20762,-6.16,-3.73,-5.062385762888445
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(F)C(c4ccccc4O)=C[C@H]3C[C@H]2CO1,C39467116_decoy,TRY1,Decoy,0,-8.39157,-6.89,-2.18,-5.490626382260046
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(Cl)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39467117_decoy,TRY1,Decoy,0,-8.25378,-5.96,-1.82,-4.31924358090706
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(Cl)C(c4ccccc4O)=C[C@H]3C[C@H]2CO1,C39467122_decoy,TRY1,Decoy,0,-8.18129,-7.56,-2.17,-8.27463463580038
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(Br)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39467124_decoy,TRY1,Decoy,0,-6.6551,-6.55,-1.63,-4.180777008607245
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(Br)C(c4ccccc4O)=C[C@H]3C[C@@H]2CO1,C39467126_decoy,TRY1,Decoy,0,-7.24614,-5.47,-0.66,-4.752992891099719
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(F)=C[C@H]3C[C@H]2CO1,C39467340_decoy,TRY1,Decoy,0,-7.06662,-7.81,-1.45,-4.510914566321505
C[NH+]1CCC[C@H](NS(=O)(=O)c2c(N)cc(Br)cc2Br)C1,C40672169_decoy,TRY1,Decoy,0,-8.45357,-4.8,-2.78,-4.578561362989658
CC1(C)Cc2c(c(N3CCCC3)[nH+]c3sc(C(=O)/N=c4\[nH]ccs4)c(N)c23)CO1,C49744617_decoy,TRY1,Decoy,0,-9.04568,-8.32,-1.15,-8.798359333960052
CC(C)[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)cc(Br)c2O)N3)C1,C15946326_decoy,TRY1,Decoy,0,-10.8556,-4.99,-1.75,-5.057686852209457
CC[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Cl)cc(Br)c2O)N3)C1,C15947239_decoy,TRY1,Decoy,0,-10.3936,-7.83,-2.67,-7.821479636254075
Cc1cc(C)c2c(c1)[C@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(C4CCCCCC4)C(=O)[C@H]31)C(=O)N2,C05205151_decoy,TRY1,Decoy,0,-7.81513,-5.91,-3.53,-5.391268716624003
Cc1cc(C)c2c(c1)[C@]1([NH2+][C@H]([C@@H](C)O)[C@H]3C(=O)N(C4CCCCCC4)C(=O)[C@H]31)C(=O)N2,C05205155_decoy,TRY1,Decoy,0,-8.0811,-6.7,-2.67,-5.269359803757392
C[NH2+][C@@H](c1ccccc1Br)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094511_decoy,TRY1,Decoy,0,-7.25175,-5.55,-1.93,-4.334800894395987
CSc1ccc([C@@H]2NN=C3[NH+]=C(Nc4ccccc4)N=C(Nc4ccccc4)N32)cc1,C59226969_decoy,TRY1,Decoy,0,-6.66649,-6.27,-0.43,-5.404268238767429
CC(C)[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2cc(Br)ccc2O)N3)C1,C15946328_decoy,TRY1,Decoy,0,-8.83888,-4.82,-0.85,-4.2437015490418295
Cc1cc(Br)cc([C@H]2N=C(O)c3c(sc4c3CC[NH+](C(C)C)C4)N2)c1O,C15946342_decoy,TRY1,Decoy,0,-8.71236,-5.36,-0.96,-4.928852945473667
[NH3+][C@H]1CCCCC[C@@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C63213119_decoy,TRY1,Decoy,0,-8.04387,-5.75,-3.68,-4.89212740666771
[NH3+][C@@H]1CCCCC[C@H]1NS(=O)(=O)c1cc(Br)sc1Br,C63213389_decoy,TRY1,Decoy,0,-9.50598,-4.7,-2.64,-4.821634674874671
Cc1ccc(C)c(N2C(=S)NC(=O)[C@@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)[C@H]2O)c1,C63375620_decoy,TRY1,Decoy,0,-7.43861,-7.9,-2.4,-5.590292893806443
Cc1ccc(C)c(N2C(=S)NC(=O)[C@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)[C@@H]2O)c1,C63375623_decoy,TRY1,Decoy,0,-7.87089,-7.16,-2.54,-7.599555948489062
O=C1[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@H]32)[C@H](O)N[C@H](S)N1c1ccccc1F,C63641780_decoy,TRY1,Decoy,0,-7.78535,-5.87,-3.12,-4.810857352458293
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@@H](O)N[C@@H](S)N1c1cccc2ccccc12,C63641866_decoy,TRY1,Decoy,0,-8.32558,-8.97,-2.51,-5.583097869399835
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@@H](O)N[C@H](S)N1c1cccc2ccccc12,C63641868_decoy,TRY1,Decoy,0,-9.69593,-9.61,-1.59,-8.466648948406561
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@@H](S)N1c1cccc2ccccc12,C63641870_decoy,TRY1,Decoy,0,-6.91012,-7.14,-1.49,-5.3499171240278445
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@@H](O)N1c1cccc2ccccc12,C63985138_decoy,TRY1,Decoy,0,-7.49792,-7.39,-2.59,-4.710500583277764
O=C1[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@@H](O)N1c1cccc2ccccc12,C63985140_decoy,TRY1,Decoy,0,-7.39939,-8.11,-4.01,-4.639750706662537
Cc1ccc(N2C(=O)[C@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)C(O)=N[C@@H]2O)cc1Cl,C64062235_decoy,TRY1,Decoy,0,-8.54282,-9.68,-1.34,-6.632956031790108
Cc1ccc(Cl)cc1N1C(=O)[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@H]1O,C64062419_decoy,TRY1,Decoy,0,-8.48802,-7.69,-1.11,-5.174929996225907
COc1ccc(C)cc1NC(=O)N1CCC[C@@]2(C1)Nc1ccccc1N/C2=[NH+]\C(C)(C)C,C65260141_decoy,TRY1,Decoy,0,-7.71412,-5.4,-1.74,-5.109609154583987
COc1ccc(C2=NC3(CC[NH2+]CC3)N[C@H](c3cc(Br)ccc3O)C2)cc1,C65298109_decoy,TRY1,Decoy,0,-9.16968,-7.36,0.26,-5.995641619977301
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1NC(=S)N(c2ccccc2Cl)[C@@H]1O,C04376003_decoy,TRY1,Decoy,0,-7.1008,-7.61,-1.31,-8.128987802695605
OC[C@@H](O)[C@@H](O)[C@H](O)[C@H]1NC(=S)N(c2ccccc2Cl)[C@H]1O,C00088657_decoy,TRY1,Decoy,0,-8.16938,-4.66,-2.34,-4.574884383700444
O=[N+]([O-])c1ccc(N[C@H](CO)[C@H](O)[C@H](O)[C@H](O)CO)c([N+](=O)[O-])c1,C04823343_decoy,TRY1,Decoy,0,-5.7027,-5.2,-2.9,-4.901903142065555
C[C@H](O)[C@H](O)[C@H](O)[C@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C05368328_decoy,TRY1,Decoy,0,-7.85683,-7.7,-3.34,-8.330081258761743
C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C05372413_decoy,TRY1,Decoy,0,-8.42129,-6.89,-2.01,-6.082235776214639
C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C05372841_decoy,TRY1,Decoy,0,-7.80172,-6.69,-3.23,-7.064803880612059
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C05742780_decoy,TRY1,Decoy,0,-7.52404,-9.13,-1.58,-6.761478264379811
Oc1c(O)c(O)c(/C=N/Nc2cc(Cl)cc(Cl)n2)c(O)c1O,C06328668_decoy,TRY1,Decoy,0,-9.61795,-5.65,-1.0,-7.45712424776411
O=C(CCCCC(=O)NNC(=S)NC1CC1)NNC(=S)NC1CC1,C06361325_decoy,TRY1,Decoy,0,-9.10672,-5.25,-1.75,-7.022809611084741
Nc1ccc(-c2nc(-c3ccc(N)cc3)nc(-c3ccc(N)cc3)n2)cc1,C01437390_decoy,TRY1,Decoy,0,-6.81103,-9.42,-0.67,-9.28175079100509
Nc1ncnc2c1nc(NCc1ccco1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08984696_decoy,TRY1,Decoy,0,-6.77136,-7.44,-1.2,-8.364216399171426
CCCCNC(=S)NNC(=O)C(=O)NNC(=S)NCCCC,C04928463_decoy,TRY1,Decoy,0,-7.75361,-5.47,-1.94,-9.37186218376503
Cc1sc2nc([C@H](C)Sc3nc(N)cc(N)n3)nc(N)c2c1C,C10658656_decoy,TRY1,Decoy,0,-8.09731,-6.77,-1.67,-5.094773235812384
Nc1ncnc2c1nc(NCc1ccco1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12318176_decoy,TRY1,Decoy,0,-6.79753,-7.24,-2.38,-9.72110151144008
Nc1ncnc2c1nc(N/N=C/c1ccco1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12660315_decoy,TRY1,Decoy,0,-7.053,-8.05,-1.42,-8.067538379189596
Nc1ncnc2c1nc(N/N=C/c1ccco1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12660317_decoy,TRY1,Decoy,0,-8.16497,-7.92,-1.18,-8.066221019298936
Nc1ncnc2c1[nH]/c(=N\N=C\c1ccco1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C09271721_decoy,TRY1,Decoy,0,-7.54003,-7.54,-1.46,-7.802319332322581
Nc1ncnc2c1nc(N/N=C/c1ccco1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740526_decoy,TRY1,Decoy,0,-7.29053,-7.94,-1.23,-7.007101725327846
Nc1ncnc2c1nc(N/N=C/c1ccco1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740524_decoy,TRY1,Decoy,0,-6.49407,-7.95,-1.88,-8.129701187466544
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C01530009_decoy,TRY1,Decoy,0,-9.04146,-8.49,-1.72,-6.828074112276714
C[C@H](/C=C/[C@@]1(O)[C@@H](C)C[C@@H](O)CC1(C)C)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C13660035_decoy,TRY1,Decoy,0,-7.05535,-5.71,-1.31,-4.521296623490133
C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775371_decoy,TRY1,Decoy,0,-7.38819,-7.04,-2.52,-5.6092486084954025
C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775375_decoy,TRY1,Decoy,0,-7.42616,-8.02,-1.55,-7.354270053419198
C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nnc2c(n1)[nH]c1ccccc12,C15775377_decoy,TRY1,Decoy,0,-7.68013,-7.55,-4.97,-7.401658747555982
Cc1ccc(C2=NN[C@@H]([C@](C)(O)[C@@](C)(O)[C@@](C)(O)[C@@](C)(O)CO)S2)cc1,C16292184_decoy,TRY1,Decoy,0,-9.35592,-7.17,-1.84,-6.755886304780831
C/C(CCCCCCCC/C(C)=N/NC(N)=S)=N/NC(N)=S,C04916661_decoy,TRY1,Decoy,0,-10.2003,-5.76,-2.93,-7.941611594834285
C/C(CCCCCCCC/C(C)=N\NC(N)=S)=N/NC(N)=S,C17376146_decoy,TRY1,Decoy,0,-8.50073,-5.05,-3.83,-6.706265817296258
Cc1cc(C)c2c(N)c(C(=O)NNC(=O)c3ccc[nH]c3=O)sc2[nH+]1,C24843344_decoy,TRY1,Decoy,0,-7.7754,-6.91,-1.43,-5.506451587386483
CCNC(=S)NNC(=O)CCCCC(=O)NNC(=S)NCC,C06783723_decoy,TRY1,Decoy,0,-9.90373,-5.5,-2.41,-7.887839987871537
CCCc1c(O)ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1CO,C31163896_decoy,TRY1,Decoy,0,-6.91737,-5.26,-2.34,-4.78275210407007
CCCc1c(O)ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1CO,C31163903_decoy,TRY1,Decoy,0,-6.95485,-5.14,-2.04,-4.803485046015177
Nc1ncnc2c1nc(N/N=C/c1ccncc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740483_decoy,TRY1,Decoy,0,-7.60233,-7.79,-1.0,-8.252370978256232
O=c1c(-c2ccc(O)cc2)coc2c(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c(O)ccc12,C35050940_decoy,TRY1,Decoy,0,-8.35154,-8.9,-1.84,-8.001300298158752
Nc1ncnc2c1c(-c1nnc([S-])[nH]1)cn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C16956561_decoy,TRY1,Decoy,0,-7.67138,-5.62,-0.49,-4.267550410000704
CCCc1c(O)ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1CO,C35458533_decoy,TRY1,Decoy,0,-7.37787,-5.3,-1.47,-4.9262337658434685
CCCc1c(O)ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1CO,C35458536_decoy,TRY1,Decoy,0,-6.51063,-5.82,-2.85,-5.1118094538485614
CCc1c(Cc2[nH]c(C(=O)NN)c(C)c2CC)[nH]c(C(=O)NN)c1C,C37624766_decoy,TRY1,Decoy,0,-8.61005,-7.24,-3.66,-7.640212994584683
Oc1cccc(/C=N/NC(=S)N/N=C/c2cccc(O)c2O)c1O,C03320264_decoy,TRY1,Decoy,0,-8.5073,-8.01,-2.88,-6.95143936909628
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(O)(O)=S)[C@@H](O)[C@H]1O,C03871397_decoy,TRY1,Decoy,0,-6.41951,-7.79,-4.0,-10.739934795603409
Cc1cc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)no1,C40680965_decoy,TRY1,Decoy,0,-8.08858,-5.46,-0.94,-5.050839484933345
Cc1cccnc1Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40757990_decoy,TRY1,Decoy,0,-7.08303,-6.62,-1.43,-6.799545913507052
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)cc1,C42959836_decoy,TRY1,Decoy,0,-8.35668,-6.81,-1.61,-9.916862600593742
NC(=O)N/N=C/c1cccn1CCCn1cccc1/C=N/NC(N)=O,C22590388_decoy,TRY1,Decoy,0,-6.87699,-6.28,-2.35,-5.842207515207313
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)s1,C43284237_decoy,TRY1,Decoy,0,-10.4844,-6.66,-1.58,-8.239580712235147
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C43465483_decoy,TRY1,Decoy,0,-8.71171,-8.1,-1.83,-6.70300866557416
Nc1nnc(N)n1NC(=O)C(=O)Nc1c(Cl)cc([N+](=O)[O-])cc1Cl,C48553248_decoy,TRY1,Decoy,0,-7.64766,-7.25,-1.4,-7.092581807585183
Nc1nc2c(c(=O)[nH]1)N[C@@H](N1CCCCC1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C35225153_decoy,TRY1,Decoy,0,-6.61606,-8.86,-2.03,-8.54021759036672
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@H]1c1ccc([N+](=O)[O-])s1,C58950405_decoy,TRY1,Decoy,0,-5.31945,-6.06,-0.36,-4.466850385491398
Nc1cc(=O)[nH]c(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)n1,C12745896_decoy,TRY1,Decoy,0,-6.98979,-6.55,-2.08,-4.960272657481467
Nc1nc2c(c(=O)[nH]1)N[C@H](N1CCCCC1)N2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C13425030_decoy,TRY1,Decoy,0,-8.03972,-8.15,-2.3,-8.483195476850499
CC1(C)CC(NC(=O)C[NH2+]C2CCCCC2)CC(C)(C)[NH2+]1,C04662066_decoy,TRY1,Decoy,0,-7.85484,-4.76,-1.78,-4.617301277001797
C[NH+](C)CCCNc1nc(N)c([N+](=O)[O-])c(N2CC[NH+](C)CC2)n1,C04306015_decoy,TRY1,Decoy,0,-7.22566,-5.12,-0.11,-5.566268362696126
CC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc([C@@H](C)O)cc2)o1,C13735262_decoy,TRY1,Decoy,0,-8.00082,-4.99,-2.26,-5.074789363404924
CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(O)cc1O,C19915053_decoy,TRY1,Decoy,0,-7.48244,-6.21,-1.58,-8.51451538608635
CC[C@H](CC[NH3+])[NH+]1CCN([C@@H](C)C(=O)NC(C)(C)C)CC1,C37049582_decoy,TRY1,Decoy,0,-8.662,-5.54,-2.11,-9.66627840500795
C[C@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2cccc(Cl)c2)o1,C32496990_decoy,TRY1,Decoy,0,-8.55322,-5.09,-1.26,-5.7551211519410925
C[C@@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2cccc(Cl)c2)o1,C32496989_decoy,TRY1,Decoy,0,-7.93297,-5.96,-1.71,-5.126324000307552
C[C@@H]1CCC[C@@](CNC(=O)CCCCCC[NH3+])([NH+](C)C)C1,C40670680_decoy,TRY1,Decoy,0,-8.54934,-5.69,-3.82,-8.500578343354908
CN(c1ncnc(Nc2cc[nH+]cc2)c1N)C1CC[NH+](C)CC1,C40687678_decoy,TRY1,Decoy,0,-8.27263,-6.62,-0.46,-5.522671167818137
CCC[C@H]1CC[C@H](C[NH3+])[C@H]([NH+](C)CC(=O)NCCOC)C1,C42428484_decoy,TRY1,Decoy,0,-8.90505,-4.67,-2.05,-5.454181651766203
CC(C)C[NH+](C[C@H](O)COc1ccccc1C[NH3+])C(C)C,C42563039_decoy,TRY1,Decoy,0,-7.56864,-5.03,-2.01,-6.929327106916085
C[C@H]([NH+](C)C[C@H](O)COc1ccccc1C[NH3+])C(C)(C)C,C42739373_decoy,TRY1,Decoy,0,-6.88406,-4.93,-2.69,-4.869013904958605
CC[C@H]([NH3+])[C@@H](c1ccccc1Cl)[NH+](C)C[C@H](O)COC,C43052659_decoy,TRY1,Decoy,0,-6.87108,-4.42,-1.85,-5.050168383277399
CC[C@@H]([NH3+])[C@@H](c1ccccc1OC)[NH+](C)C[C@H](O)COC,C43098399_decoy,TRY1,Decoy,0,-6.96168,-3.88,-2.84,-4.744151894536478
CC[C@@H]([NH3+])[C@H](c1ccccc1OC)[NH+](C)C[C@H](O)COC,C43098403_decoy,TRY1,Decoy,0,-6.9435,-3.77,-1.67,-4.775286275855032
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)[NH+](C)C[C@H](O)COC,C43253938_decoy,TRY1,Decoy,0,-9.29906,-4.18,-1.0,-5.891106910998804
CC[NH+](CC(=O)NC(C)C)Cc1sccc1C#CC[NH3+],C43684071_decoy,TRY1,Decoy,0,-8.67757,-5.0,-2.3,-8.257024969233782
C[C@H]([NH2+]CCCC[NH3+])c1ccc(S(=O)(=O)N(C)C)cc1,C44493947_decoy,TRY1,Decoy,0,-7.82814,-4.69,-2.02,-6.189386861636131
CC[NH+](CC)CCC[C@H](C)NC(=O)C1(C[NH3+])CCCCC1,C44762221_decoy,TRY1,Decoy,0,-7.58694,-5.38,-1.72,-5.75381401596401
CCC[NH+]1CCC(NC(=O)C(C[NH3+])(CCC)CCC)CC1,C44806431_decoy,TRY1,Decoy,0,-6.63776,-4.4,-4.36,-4.559682539227797
CCCC(C[NH3+])(CCC)C(=O)NC[C@H](C)[NH+]1CCCCC1,C44995386_decoy,TRY1,Decoy,0,-7.4434,-4.62,-2.1,-5.216209636829335
CCC1CCC([NH+](C)CC[C@@](C)([NH2+]C2CC2)C(N)=O)CC1,C45281163_decoy,TRY1,Decoy,0,-7.65929,-6.23,-1.49,-5.879721790723693
CCC[NH2+][C@](C)(CCN1CC[NH+](CC2CC2)CC1)C(N)=O,C45282457_decoy,TRY1,Decoy,0,-7.70494,-5.47,-1.45,-5.741922579981761
CC(C)[NH2+][C@](C)(CCN1CC[NH+](CC2CC2)CC1)C(N)=O,C45282463_decoy,TRY1,Decoy,0,-8.54125,-5.91,-1.19,-5.894913566903848
C[NH+](CCC[C@](C)([NH2+]C1CC1)C(N)=O)C[C@@H]1CCCCO1,C45421262_decoy,TRY1,Decoy,0,-7.58959,-5.45,-1.62,-5.352715187425409
CCC[NH2+][C@](C)(CCC[NH+](C)[C@@H]1CCCC[C@@H]1C)C(N)=O,C45423634_decoy,TRY1,Decoy,0,-7.0189,-5.61,-1.57,-5.352578898553947
C[NH2+][C@@](C)(CCCC[NH+]1CCO[C@H]2CCCC[C@@H]21)C(N)=O,C45425733_decoy,TRY1,Decoy,0,-7.6589,-4.18,-1.13,-5.610539691435564
CC1CCC([NH+](C)CCC[C@](C)([NH2+]C2CC2)C(N)=O)CC1,C45426162_decoy,TRY1,Decoy,0,-7.76019,-6.04,-1.35,-5.924536199233118
CC1CCC([NH+](C)CCC[C@@](C)([NH2+]C2CC2)C(N)=O)CC1,C45426165_decoy,TRY1,Decoy,0,-8.08196,-6.06,-1.87,-5.9002129138559
CCC1CCC([NH+](C)CCCC[C@@](C)([NH2+]C)C(N)=O)CC1,C45427487_decoy,TRY1,Decoy,0,-8.03851,-5.79,-2.14,-5.226550110104493
C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(S(N)(=O)=O)cc1,C45663932_decoy,TRY1,Decoy,0,-7.20363,-5.25,-4.15,-4.853139603992714
Cc1[nH+]c(Nc2ccccc2)nc(NC2CC[NH2+]CC2)c1C,C45947831_decoy,TRY1,Decoy,0,-7.57057,-6.91,-1.76,-6.912258776412596
C[NH+](C[C@H](O)COc1ccccc1C[NH3+])C[C@H]1CCCO1,C48946878_decoy,TRY1,Decoy,0,-7.94896,-5.65,-1.22,-7.221845189485018
CCCC1CC[NH+](CCC[C@](C)([NH2+]C(C)C)C(N)=O)CC1,C50905792_decoy,TRY1,Decoy,0,-7.34812,-5.59,-1.32,-5.244735160133074
CCC[NH2+][C@](C)(CCN1CC[NH+]([C@H](C)CC)CC1)C(N)=O,C55070591_decoy,TRY1,Decoy,0,-7.5041,-5.56,-1.18,-5.222026451647052
CCC[NH2+][C@@](C)(CCN1CC[NH+](CC(C)C)CC1)C(N)=O,C55081280_decoy,TRY1,Decoy,0,-7.4706,-4.16,-0.35,-5.462194672728144
CC1(C)CC[NH+](CCCC[C@@](C)([NH2+]C2CC2)C(N)=O)CC1,C61821959_decoy,TRY1,Decoy,0,-7.89235,-5.34,-1.56,-5.411164506104508
Cc1cc(C)c(C(N)=S)c(NC[C@H](C)C[NH+]2CCCC2)[nH+]1,C62080410_decoy,TRY1,Decoy,0,-7.94981,-5.24,-1.42,-5.948766454946449
CCC1(C)CC[NH+](CCC[C@](C)([NH2+]C(C)C)C(N)=O)CC1,C62956272_decoy,TRY1,Decoy,0,-7.63224,-5.28,-0.84,-5.857701282020675
CCC1(C)CC[NH+](CCC[C@@](C)([NH2+]C(C)C)C(N)=O)CC1,C62956273_decoy,TRY1,Decoy,0,-7.09037,-6.07,-1.26,-5.162573491439152
CC[NH2+][C@@](C)(CCCC[NH+]1CCC(C)(CC)CC1)C(N)=O,C62956344_decoy,TRY1,Decoy,0,-7.03105,-4.34,-1.79,-5.102485995128141
CC[NH2+][C@](C)(CCC[NH+]1CCC(CC)(CC)CC1)C(N)=O,C62956475_decoy,TRY1,Decoy,0,-7.71117,-5.34,-2.18,-5.786395487767625
CCC(CC)[C@@H](CN/C(N)=[NH+]/C[C@@H]1CCCO1)[NH+]1CCCC1,C66242763_decoy,TRY1,Decoy,0,-8.18386,-4.4,-1.69,-4.752258441990398
CCC(CC)[C@@H](CN/C(N)=[NH+]/Cc1ccco1)[NH+]1CCCC1,C66242769_decoy,TRY1,Decoy,0,-7.08179,-5.18,-2.55,-5.084078247518687
CCC(CC)[C@H](CN/C(N)=[NH+]/Cc1ccco1)[NH+]1CCCC1,C66242770_decoy,TRY1,Decoy,0,-8.56098,-4.53,-2.97,-5.4049789027885895
CC(C)C[C@@H](CN/C(N)=[NH+]/C[C@@H]1CCCO1)[NH+]1CCCC1,C66245069_decoy,TRY1,Decoy,0,-8.02672,-4.53,-3.11,-4.851672076603416
CC[NH+]1CCN(C[C@@H](C)CN/C(N)=[NH+]/C[C@H]2CCCO2)CC1,C66245629_decoy,TRY1,Decoy,0,-7.81737,-5.86,-0.42,-5.631963773418763
CCCC[NH+]1CCCC[C@H]1CN/C(N)=[NH+]/C[C@@H]1CCCO1,C66245817_decoy,TRY1,Decoy,0,-7.7453,-4.63,-1.2,-4.847398595858201
COCC/[NH+]=C(/N)NC[C@@H](c1ccc(C)o1)[NH+]1CCCC1,C66246483_decoy,TRY1,Decoy,0,-8.25674,-6.03,-1.32,-7.169298746416177
c1cncc(NCCC[NH2+]C2CCC3(CC[NH2+]CC3)CC2)c1,C67540925_decoy,TRY1,Decoy,0,-8.42608,-5.96,-0.98,-5.231702477555873
CCc1nc(N)nc(N)c1-c1ccc(N)cc1,C01588893_decoy,TRY1,Decoy,0,-7.09804,-7.16,-3.04,-7.171279070597165
Oc1cc(-c2cc(O)c(O)c(O)c2)cc(O)c1O,C05085514_decoy,TRY1,Decoy,0,-8.68272,-5.61,-0.76,-4.950258197369248
Cc1nc(NN)nc(NN)c1Br,C03164392_decoy,TRY1,Decoy,0,-7.96731,-5.27,-0.13,-7.457459171246673
NC(=O)NC(NC(N)=O)C(Cl)(Cl)Cl,C05500747_decoy,TRY1,Decoy,0,-6.8915,-3.63,-0.52,-4.303853277103494
NNc1nc(NN)c2c3c(sc2n1)CCC3,C00346436_decoy,TRY1,Decoy,0,-7.94919,-6.68,-2.6,-7.7402431402832415
C/C(C/C(C)=N/NC(N)=S)=N/NC(N)=S,C04737209_decoy,TRY1,Decoy,0,-7.34501,-4.7,-0.83,-7.809602978237787
NC(=S)N/N=C\CCC/C=N\NC(N)=S,C04915687_decoy,TRY1,Decoy,0,-7.43021,-4.46,-1.99,-5.703280540786329
O=C1NC(=O)NC(c2ccc(O)c(O)c2O)N1,C06668374_decoy,TRY1,Decoy,0,-7.38864,-5.82,-0.45,-3.890936963825205
C/C(C/C=N/NC(N)=S)=N/NC(N)=S,C06754087_decoy,TRY1,Decoy,0,-7.2908,-4.37,-3.37,-5.936073177378834
C/C(CC/C(C)=N/NC(N)=O)=N\NC(N)=O,C16137009_decoy,TRY1,Decoy,0,-5.95793,-5.33,-3.3,-4.677914861049097
CC(C)(C)NC(=O)CSc1nnc(NN)n1N,C21035314_decoy,TRY1,Decoy,0,-8.33812,-6.98,-0.95,-8.938500261084998
CCC[C@@H](C)NC(=O)NC(C(N)=O)C(N)=O,C29723410_decoy,TRY1,Decoy,0,-6.83732,-6.49,-3.85,-7.417969777291002
CCC[C@H](C)NC(=O)NC(C(N)=O)C(N)=O,C29723412_decoy,TRY1,Decoy,0,-6.81683,-6.21,-3.22,-6.730896753508581
Nc1cc(=O)[nH]c(CCc2nc(N)cc(=O)[nH]2)n1,C17164096_decoy,TRY1,Decoy,0,-6.81012,-6.75,-2.68,-7.852930987089281
Nc1nc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n[nH]1,C33413802_decoy,TRY1,Decoy,0,-6.97848,-7.2,-1.02,-9.380442334132294
Cc1ccc(Cc2ccc(N)cc2N)cc1N,C33637490_decoy,TRY1,Decoy,0,-7.11271,-8.54,-3.23,-7.209895296235251
NC(=O)CNc1cc2c(cc1N)NC(=O)CC2,C35341213_decoy,TRY1,Decoy,0,-6.80811,-4.68,-1.71,-3.732192959564133
NC(=O)CNc1cc2c(cc1N)OCC(=O)N2,C35452791_decoy,TRY1,Decoy,0,-6.95435,-5.44,-0.49,-4.859826715642621
C[C@@H](Nc1cc2c(cc1N)OCC(=O)N2)C(N)=O,C35793827_decoy,TRY1,Decoy,0,-7.29837,-5.2,-1.7,-4.149470868543904
C[C@@H](Nc1cc2c(cc1N)CC(=O)N2)C(N)=O,C35793859_decoy,TRY1,Decoy,0,-6.485,-5.66,0.24,-4.1771039878656175
NC(=O)CCNc1cc2c(cc1N)CC(=O)N2,C36747096_decoy,TRY1,Decoy,0,-6.45386,-4.54,-0.74,-4.116129002686424
CC(C)(CO)Nc1cc(N)cc(S(N)(=O)=O)c1,C37934206_decoy,TRY1,Decoy,0,-8.4444,-4.96,-1.67,-6.555782609480738
C[C@@H](CO)Nc1cc(N)cc(S(N)(=O)=O)c1,C37934211_decoy,TRY1,Decoy,0,-7.49798,-4.47,-2.45,-4.223415122287888
NC(=O)C1=C(N)NN/C1=C1\C=C2CCCCC2=N1,C06025480_decoy,TRY1,Decoy,0,-7.13492,-6.51,-0.06,-3.909405346338432
CC(C)(/N=N/C(C)(C)/C(N)=N/O)/C(N)=N/O,C05167671_decoy,TRY1,Decoy,0,-6.75623,-4.23,-1.22,-4.549829648446379
NC(=O)C[C@@H]([NH3+])C(=O)NCCCCCCC(=O)[O-],C40479848_decoy,TRY1,Decoy,0,-7.75367,-5.7,-1.21,-7.0978739755156735
CC(C)c1ccc(Nc2ncnc(NN)c2N)cc1,C40706195_decoy,TRY1,Decoy,0,-7.53262,-7.64,-0.05,-5.400068391073924
NNc1ncnc(Nc2ccccc2Cl)c1N,C40781296_decoy,TRY1,Decoy,0,-7.32717,-7.11,-0.38,-8.590202280861252
NNc1ncnc(Nc2cc(F)ccc2F)c1N,C40783891_decoy,TRY1,Decoy,0,-7.4786,-6.81,-0.19,-8.425165588392842
Nc1ccc(Sc2nc(N)cc(N)n2)nc1,C41023245_decoy,TRY1,Decoy,0,-6.95356,-6.8,-0.36,-6.687570062360885
Nc1cnc(Sc2nc(N)cc(N)n2)nc1,C41023284_decoy,TRY1,Decoy,0,-7.08598,-3.48,-0.51,-3.347482604497114
C[C@H](NC(=O)NC(C(N)=O)C(N)=O)[C@H]1CCCO1,C42325964_decoy,TRY1,Decoy,0,-7.15498,-6.56,-4.92,-7.514022051195584
CC(C)[NH+]1C[C@H]2CCC[C@@H](C1)C2[NH2+]CCC[NH3+],C44374745_decoy,TRY1,Decoy,0,-7.02812,-3.24,-0.21,-3.9303651766125287
CCC(CC)(C(=O)N[C@H](C)C(N)=O)/C(N)=N/O,C44785230_decoy,TRY1,Decoy,0,-5.83836,-3.99,-2.84,-4.0149532004611554
NC(=O)CCNC(=O)C1(/C(N)=N/O)CCCC1,C44785255_decoy,TRY1,Decoy,0,-6.75475,-6.36,-2.81,-7.049273239859173
CC(C)(C(=O)NCCCC(N)=O)/C(N)=N/O,C44785503_decoy,TRY1,Decoy,0,-6.39995,-5.71,-1.05,-6.121160350727582
CCC[C@H](C(=O)NCCC(N)=O)/C(N)=N/O,C44868894_decoy,TRY1,Decoy,0,-6.57236,-4.55,-4.32,-4.840754732855595
CCC[C@@H](C(=O)NCCC(N)=O)/C(N)=N/O,C44868897_decoy,TRY1,Decoy,0,-6.95955,-5.78,-2.76,-7.709886139788116
CC[C@@H](C(=O)NCCCC(N)=O)/C(N)=N/O,C44870511_decoy,TRY1,Decoy,0,-7.38478,-4.77,-1.46,-5.10939432465033
CC(C)[C@@H](C(=O)NC(C)(C)C(N)=O)/C(N)=N/O,C45113031_decoy,TRY1,Decoy,0,-5.92342,-3.87,-3.51,-3.782884119246985
Cc1n[nH]c(N)c1C(=O)NC(C)(C)C(N)=O,C45113063_decoy,TRY1,Decoy,0,-6.96958,-7.28,-0.48,-10.70611154872204
Cc1[nH]ncc1CCCNC(=O)NNC(N)=S,C45539698_decoy,TRY1,Decoy,0,-6.50296,-5.98,-2.59,-6.763213930774105
CC(C)[C@H](C)NC(=O)NC(C(N)=O)C(N)=O,C29726656_decoy,TRY1,Decoy,0,-6.75107,-6.56,-3.05,-7.706236201619588
CC(C)CNC(=O)NNC(=O)CNC(N)=O,C49182938_decoy,TRY1,Decoy,0,-6.22683,-6.48,-3.41,-9.454596237606989
CCC[C@@H](NC(N)=O)C(=O)NNC(=O)NCC,C49183746_decoy,TRY1,Decoy,0,-6.17343,-4.32,-1.36,-4.667802217613883
[H]/N=C(/N)N/C(N)=N/c1ccc(Cl)cc1C#N,C19925086_decoy,TRY1,Decoy,0,-6.04024,-6.65,-0.65,-6.162805996268346
Nc1nc(N)c(Cc2ccccc2F)c(N)n1,C12340545_decoy,TRY1,Decoy,0,-7.14089,-8.08,-0.41,-10.49623662524414
C[C@@H](NC(=O)C1(/C(N)=N/O)CCCC1)C(N)=O,C44785220_decoy,TRY1,Decoy,0,-6.36551,-4.2,-1.75,-4.053058782510314
NC(=O)C1CCC(NC(=O)c2n[nH]cc2N)CC1,C62811854_decoy,TRY1,Decoy,0,-7.51968,-6.45,-0.61,-6.571087284191798
CC[C@@H](NC(=O)NC(C(N)=O)C(N)=O)C(C)C,C66368267_decoy,TRY1,Decoy,0,-6.55465,-5.97,-4.18,-7.027418420229993
CSc1ccc(-c2ccc3c(c2)C(=O)N2CCN(C(=O)[C@@H]([NH3+])C(C)C)C[C@H]2C(=O)N3)cc1,C04222694_decoy,TRY1,Decoy,0,-10.5876,-7.93,-1.29,-8.604422913053124
CCc1ccc2c(c1)[C@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08789922_decoy,TRY1,Decoy,0,-6.71622,-6.9,-1.59,-4.815237661408756
CCc1ccc2c(c1)[C@@]1([NH2+][C@H]([C@@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08789925_decoy,TRY1,Decoy,0,-8.57601,-6.24,-0.99,-6.156079424910668
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790623_decoy,TRY1,Decoy,0,-6.93079,-6.6,-1.9,-4.965254224839178
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790625_decoy,TRY1,Decoy,0,-8.26514,-7.64,-2.82,-5.504158550448151
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790626_decoy,TRY1,Decoy,0,-7.86441,-7.79,-2.63,-5.775744420377498
CC(=O)Nc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)[C@H]4C2=O)cc1,C09134419_decoy,TRY1,Decoy,0,-8.54968,-5.77,-3.68,-5.871205278110824
Nc1nc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)[nH]/c(=N\c2ccc3c(c2)OCCO3)n1,C09111177_decoy,TRY1,Decoy,0,-10.4887,-6.96,-2.03,-5.805658503936685
COc1ccc(CN2C(=O)[C@@H]3[C@H]([C@H](C)O)[NH2+][C@]4(C(=O)Nc5c4ccc(C)c5C)[C@@H]3C2=O)cc1,C12875302_decoy,TRY1,Decoy,0,-7.85247,-7.94,-1.66,-5.796989773784848
COc1ccccc1CN1C(=O)[C@@H]2[C@@H]([C@H](C)O)[NH2+][C@]3(C(=O)Nc4c(C)cc(C)cc43)[C@@H]2C1=O,C12876101_decoy,TRY1,Decoy,0,-8.34435,-6.78,-2.43,-6.945538301754517
C[C@@H](O)[C@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C12882702_decoy,TRY1,Decoy,0,-7.97159,-8.8,-0.6,-5.83545306736904
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12883889_decoy,TRY1,Decoy,0,-7.27444,-6.26,-4.2,-4.837660255073016
COc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(C)ccc2O3)cc1NC(C)=O,C19219221_decoy,TRY1,Decoy,0,-9.57118,-6.59,-2.07,-7.005599962282328
COc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@@H](O)c3c[nH]c4cc(OC)ccc34)CC1)O2,C19562180_decoy,TRY1,Decoy,0,-8.8482,-7.47,-1.36,-5.280213434694367
COc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@H](O)c3c[nH]c4cc(OC)ccc34)CC1)O2,C19562183_decoy,TRY1,Decoy,0,-9.8493,-7.02,-1.85,-6.507940394432604
O=C(NCCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1ccc(Br)o1,C20590227_decoy,TRY1,Decoy,0,-8.73391,-7.91,-1.64,-7.367797076834366
O=C(/C=C/c1ccc(CNC(=O)c2ccc(N3CC[NH+](Cc4ccncc4)CC3)cc2)cc1)NO,C27646555_decoy,TRY1,Decoy,0,-9.34706,-6.89,-3.57,-5.266850868124103
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)C[NH+]1CCC2=C(CCS2)[C@@H]1c1ccccc1,C38797084_decoy,TRY1,Decoy,0,-8.18416,-5.87,-0.88,-5.413323821586577
O=C([C@@H]1C[C@@H](c2ccccc2O)C2=[NH+]c3ccccc3CN21)N(c1ccccc1O)c1ccccc1O,C39545403_decoy,TRY1,Decoy,0,-7.94238,-9.19,-0.12,-7.261816280555598
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCc2nc3ccccc3c(=O)[nH]2)C2(CC[NH2+]CC2)C1,C39676345_decoy,TRY1,Decoy,0,-7.48231,-8.44,-1.41,-5.703114645929989
C=CCN1C(=O)[C@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@@H](O)c2ccccc21,C39142942_decoy,TRY1,Decoy,0,-8.54698,-8.18,-2.62,-8.66300648418683
CNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)NCCN3CCOCC3)[C@@H](O)[C@H]1[C@@H]2C,C43548353_decoy,TRY1,Decoy,0,-10.6542,-6.18,-1.25,-6.837965059870833
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C44713602_decoy,TRY1,Decoy,0,-6.71226,-6.41,-2.04,-5.088576308706163
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C44713614_decoy,TRY1,Decoy,0,-9.92721,-6.84,-2.0,-6.644135344473815
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Br)c2)CC12CC[NH2+]CC2,C44713698_decoy,TRY1,Decoy,0,-8.41708,-7.01,-2.23,-6.861311684792577
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713729_decoy,TRY1,Decoy,0,-7.75256,-7.61,-0.66,-6.7943238548565805
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2)CC12CC[NH2+]CC2,C44713777_decoy,TRY1,Decoy,0,-7.53818,-5.34,-2.05,-4.766129526819038
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1F,C44713853_decoy,TRY1,Decoy,0,-8.60708,-7.71,-0.93,-7.290321451452567
Cc1ccc(F)cc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714022_decoy,TRY1,Decoy,0,-8.01211,-7.97,-0.85,-6.118413845122957
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C44714163_decoy,TRY1,Decoy,0,-7.65071,-6.13,-1.95,-5.381459932947049
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C44714380_decoy,TRY1,Decoy,0,-8.56438,-7.38,-2.84,-6.715564392191443
Cc1ccccc1C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714384_decoy,TRY1,Decoy,0,-7.87503,-8.41,-1.29,-6.82575088670915
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)C(C)C)CC12CC[NH2+]CC2,C44714392_decoy,TRY1,Decoy,0,-8.5514,-7.27,-2.12,-6.018078832660432
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(C)n(C)n4)CC34CC[NH2+]CC4)[nH]c2c1,C44737626_decoy,TRY1,Decoy,0,-9.16664,-7.91,-2.58,-6.879205551947427
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(C)n(C)n4)CC34CC[NH2+]CC4)[nH]c2c1,C44737634_decoy,TRY1,Decoy,0,-8.98642,-6.51,-1.84,-6.033911210470586
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)C4CCOCC4)CC34CC[NH2+]CC4)[nH]c2c1,C39695864_decoy,TRY1,Decoy,0,-9.15216,-8.95,-0.93,-7.47152918655904
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccccc4C)CC34CC[NH2+]CC4)[nH]c2c1,C44736995_decoy,TRY1,Decoy,0,-9.55535,-9.02,-3.53,-6.850624445355646
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)C4CCOCC4)CC34CC[NH2+]CC4)[nH]c2c1,C44737623_decoy,TRY1,Decoy,0,-9.3415,-6.56,-1.92,-5.1385738685065965
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1,C23377726_decoy,TRY1,Decoy,0,-8.31564,-6.33,-2.33,-5.658117840819879
O=C(NCCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1ccc(Br)cc1,C20573493_decoy,TRY1,Decoy,0,-9.90556,-7.25,-2.54,-6.849080229105209
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)NC(=S)N(Cc4ccccc4)[C@H]3O)[C@@H]1[NH+]=2,C63375706_decoy,TRY1,Decoy,0,-8.27863,-6.96,-1.56,-6.799405803967704
COc1cccc(N2C(=O)[C@@H]([C@H]3NCCC4=c5cc(OC)ccc5=[NH+][C@@H]43)C(O)=N[C@H]2O)c1,C64062319_decoy,TRY1,Decoy,0,-7.3792,-8.68,-2.12,-11.108915869343235
COc1cccc(N2C(=O)[C@H]([C@H]3NCCC4=c5cc(OC)ccc5=[NH+][C@@H]43)C(O)=N[C@H]2O)c1,C64062321_decoy,TRY1,Decoy,0,-7.98986,-7.85,-2.5,-6.1321938479193
COc1cccc(N2C(=O)[C@H]([C@H]3NCCC4=c5cc(OC)ccc5=[NH+][C@@H]43)C(O)=N[C@@H]2O)c1,C64062322_decoy,TRY1,Decoy,0,-8.24909,-8.92,-3.37,-6.635585976116782
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4ccccc4OC)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097904_decoy,TRY1,Decoy,0,-8.69139,-6.62,-1.37,-5.693863643695032
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4ccccc4OC)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64097905_decoy,TRY1,Decoy,0,-6.89922,-6.69,-2.48,-5.049010174435898
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccccc4OC)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097906_decoy,TRY1,Decoy,0,-7.82713,-6.65,-3.04,-5.521919785708587
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccccc4OC)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64097907_decoy,TRY1,Decoy,0,-8.16971,-6.99,-1.88,-5.87454602961389
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4cccc(C(F)(F)F)c4)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64136863_decoy,TRY1,Decoy,0,-7.79622,-8.9,-2.55,-7.524467905620872
CC1=c2cc(Cl)ccc2=[NH+][C@H]1C(=O)NC1CCC(N2C=C(C(=O)N3CCCC3)NN2)CC1,C64167013_decoy,TRY1,Decoy,0,-8.3425,-8.49,-1.94,-9.400357333555952
CO/N=C(/C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(COC(C)=O)CS[C@H]12)c1csc(N)c1,C04066585_decoy,TRY1,Decoy,0,-9.89364,-5.54,-1.26,-7.089735989384268
O=[N+]([O-])c1ccc(CSc2ncnc3c2ncn3[C@H]2O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H]2O)cc1,C05641826_decoy,TRY1,Decoy,0,-6.03128,-6.64,-1.48,-4.951462741401696
O=C(CSc1nnc(C[C@@H]2CCS(=O)(=O)C2)o1)NN1C(=O)NC2(CCCCC2)C1=O,C08726696_decoy,TRY1,Decoy,0,-9.57284,-6.42,-2.25,-6.976377936453177
O=C(CSc1nnc(C[C@H]2CCS(=O)(=O)C2)o1)NN1C(=O)NC2(CCCCC2)C1=O,C08726697_decoy,TRY1,Decoy,0,-8.21162,-6.46,-1.57,-5.838256939581944
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(COC(C)=O)CS[C@H]12)c1cnc(N)s1,C08739991_decoy,TRY1,Decoy,0,-8.60411,-6.26,-2.26,-7.089853367625711
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3ccccc3F)o2)C1,C08972373_decoy,TRY1,Decoy,0,-10.0164,-7.69,-3.69,-7.979463372852162
O=S1(=O)C[C@@H](S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3ccc(F)cc3)o2)[C@@H](O)C1,C08972474_decoy,TRY1,Decoy,0,-9.40496,-7.12,-3.25,-6.985994108679067
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NC[C@H](c2cccnc2)S(=O)(=O)c2cccs2)C1,C09005117_decoy,TRY1,Decoy,0,-9.78888,-7.24,-2.5,-8.097965581563265
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NC[C@H](c2cccnc2)S(=O)(=O)c2ccc(F)cc2)C1,C09005836_decoy,TRY1,Decoy,0,-8.6317,-7.99,-2.05,-8.211000593129118
O=S1(=O)C[C@@H](O)[C@@H](S(=O)(=O)NCCc2nnc(S(=O)(=O)Cc3ccc(F)cc3)o2)C1,C09025064_decoy,TRY1,Decoy,0,-9.73546,-5.79,-3.17,-5.960809967655545
O=S1(=O)C[C@@H](S(=O)(=O)NCCCc2nnc(S(=O)(=O)Cc3ccc(F)cc3)o2)[C@@H](O)C1,C09027738_decoy,TRY1,Decoy,0,-9.41828,-6.25,-3.07,-6.528001063748494
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3c(F)cccc3Cl)o2)C1,C09029999_decoy,TRY1,Decoy,0,-9.61603,-5.51,-3.03,-5.7500595115632125
O=S1(=O)C[C@@H](S(=O)(=O)NC[C@H](c2cccs2)S(=O)(=O)c2ccc3c(c2)OCO3)[C@@H](O)C1,C09102721_decoy,TRY1,Decoy,0,-9.74582,-8.38,-1.6,-9.676933117728392
[H]/N=C1C(=C\c2cc(OC)c(O)c(OC)c2)/C(=O)N=C2SC(CC(=O)N3CCOCC3)=NN2/1,C09281143_decoy,TRY1,Decoy,0,-8.89832,-6.99,-1.78,-6.139793364899235
O=c1[nH]nc(N2CCN(c3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])CC2)c(=O)[nH]1,C09463139_decoy,TRY1,Decoy,0,-6.81714,-6.56,-1.98,-4.554134013574775
Cc1cc(NC(=O)[C@H](C)NS(=O)(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2C)no1,C11997825_decoy,TRY1,Decoy,0,-7.4185,-9.17,-2.76,-7.00318788286335
COCCn1c(N)c(C(=O)CSc2ncnc3c2cnn3-c2ccc(F)cc2)c(=O)[nH]c1=O,C13296595_decoy,TRY1,Decoy,0,-7.44126,-7.75,-3.45,-5.801843864466791
CO[C@@H]1O[C@@H](CO)[C@H](S(=O)(=O)[O-])[C@@H](O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](C)[C@@H](O)[C@H]2O)[C@H]1NC(C)=O,C15205560_decoy,TRY1,Decoy,0,-4.35779,-4.9,-4.21,-4.284063948898408
CC(=O)N[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](COC(C)=O)O[C@@H]1SC[C@@H](O)CCl,C15276026_decoy,TRY1,Decoy,0,-8.27739,-5.77,-4.78,-6.760040437551316
O=P([O-])([O-])[C@](O)(CC[n+]1c(-c2ccccc2)csc1Nc1ccccc1)[P@@](=O)([O-])O,C20082545_decoy,TRY1,Decoy,0,-7.47328,-7.56,-2.18,-8.068945527201699
CCc1nnc(CN(CC)C(=O)CSc2n[nH]c(N/N=C/c3cc(OC)c(OC)c(OC)c3)n2)o1,C20909890_decoy,TRY1,Decoy,0,-8.79267,-7.55,-2.73,-6.783330829894539
CCCn1c(SCC(=O)N2CCN(C(=O)CSc3n[nH]c(=O)n3CCC)CC2)n[nH]c1=O,C21119764_decoy,TRY1,Decoy,0,-8.20996,-5.73,-4.4,-7.128562201517147
CNC(=O)NC(=O)[C@H](C)OC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1,C21441666_decoy,TRY1,Decoy,0,-8.37938,-7.45,-1.79,-7.200616183605617
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[n+]3cccc4c3CCC4)CS[C@H]12)c1csc(N)n1,C21985852_decoy,TRY1,Decoy,0,-8.41403,-5.6,-3.07,-5.759452356006948
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]12)c1cnc(N)s1,C22001545_decoy,TRY1,Decoy,0,-9.89682,-7.18,-2.35,-13.619051791214446
CC(=O)N[C@@H]1[C@H](Oc2ccc3c(c2)OC(=O)C[C@@H]3C)O[C@@H](CO)[C@H](OS(=O)(=O)[O-])[C@H]1O,C22063992_decoy,TRY1,Decoy,0,-7.03245,-5.72,-1.49,-3.9517308198268895
C=CCn1c(SCC(=O)c2c(N)n(CCC)c(=O)n(C)c2=O)nnc1[C@H]1CCS(=O)(=O)C1,C24509121_decoy,TRY1,Decoy,0,-8.46299,-6.63,-3.94,-6.741139705679222
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccc4ccoc4c3)CS[C@H]12)c1csc(N)n1,C26253127_decoy,TRY1,Decoy,0,-8.01093,-7.17,-0.75,-6.994395133761972
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(/C=C/c3cc[n+](C)cc3)SC[C@H]12)c1csc(N)n1,C26290257_decoy,TRY1,Decoy,0,-9.2826,-6.06,-1.16,-6.0902966353682215
C=C(CO)C(=O)O[C@H]1C[C@@]2(C)OC(=O)/C(=C/C)[C@@]23CC[C@@](C)(O)CC(=O)[C@]1(C(=C)C(=O)OC)O3,C31155482_decoy,TRY1,Decoy,0,-5.65159,-5.5,-2.51,-4.483240943228875
Nc1nc2c(ncn2[C@@H]2O[C@H](CO[P@@](O)(=S)OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)[nH]1,C31543228_decoy,TRY1,Decoy,0,-6.26205,-8.01,-2.92,-7.611856294097171
C[C@@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(N(C)C)cc2)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C33628116_decoy,TRY1,Decoy,0,-7.66667,-6.19,-2.64,-5.425947059624476
C[C@H](O)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(N(C)C)cc2)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C33628119_decoy,TRY1,Decoy,0,-8.61275,-6.16,-3.07,-5.779934220897705
Cc1ccc(C)c([C@@H]2[NH2+][C@@](C(=O)[O-])([C@@H](C)O)[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@H]32)c1,C34262161_decoy,TRY1,Decoy,0,-7.03582,-7.92,-2.93,-5.72350056913301
Cc1noc(C)c1S(=O)(=O)N[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1,C14021397_decoy,TRY1,Decoy,0,-8.90036,-7.62,-3.21,-7.365207995696992
CC(=O)OC[C@@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H]3OC[C@@H]2O3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C35636359_decoy,TRY1,Decoy,0,-5.44518,-5.08,-2.61,-4.556207610640847
Cc1noc(C)c1S(=O)(=O)N1CCN(CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)CC1,C14076123_decoy,TRY1,Decoy,0,-8.69943,-6.67,-4.74,-5.8254863191378
O=C([O-])c1ccccc1/N=N/c1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(O)c2c1O,C34414121_decoy,TRY1,Decoy,0,-7.70268,-7.84,-2.04,-7.386840377491794
C/C1=C/CC/C(CO)=C\[C@H]2OC(=O)[C@@H](C[NH+]3CCC[C@@H]3C(=O)[O-])[C@@H]2[C@@H](OC(=O)[C@@H](C)CO)C1,C36375174_decoy,TRY1,Decoy,0,-7.87012,-5.41,-3.12,-5.761493615987693
Nc1cc(S(=O)(=O)[O-])cc2c1C(=O)/C(=N/Nc1ccc([N+](=O)[O-])cc1)C(S(=O)(=O)[O-])=C2,C17303082_decoy,TRY1,Decoy,0,-8.20398,-7.3,-2.37,-6.463263115106935
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CN1CCN(S(=O)(=O)[C@@H]2CC=CS2)CC1,C38796822_decoy,TRY1,Decoy,0,-9.42335,-7.41,-2.14,-6.179708709937
CC(C)S(=O)(=O)c1ccc(NS(=O)(=O)[O-])c(N2CCN[C@@H](S(=O)(=O)C(C)C)C2)c1,C39483077_decoy,TRY1,Decoy,0,-8.48755,-5.76,-3.81,-5.589584706120913
O=S1(=O)CC[C@@H](NC(=S)OCCOCCOC(=S)N[C@@H]2CCS(=O)(=O)C2)C1,C40168543_decoy,TRY1,Decoy,0,-9.51919,-5.19,-2.09,-6.690011247692113
C[C@]1(NC(=S)OCCOCCOC(=S)N[C@]2(C)CCS(=O)(=O)C2)CCS(=O)(=O)C1,C40168550_decoy,TRY1,Decoy,0,-9.13833,-5.61,-2.93,-6.852995915400545
Cc1cc([C@@H]2N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]3C(=O)N(CCO)C(=O)[C@H]32)oc1C,C33928414_decoy,TRY1,Decoy,0,-7.75712,-5.78,-2.22,-5.660079073774894
COc1cc([C@@H]2[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C([O-])=NC(=O)[C@H]32)cc(Br)c1OC,C33934189_decoy,TRY1,Decoy,0,-5.96306,-5.76,-2.85,-4.462676790377507
CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](COS(=O)(=O)[O-])O[C@H]1O,C44019091_decoy,TRY1,Decoy,0,-5.84894,-5.13,-2.11,-5.5997065671839765
CC[C@@H](c1nnnn1C[C@@H]1CCCO1)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C57641342_decoy,TRY1,Decoy,0,-9.22735,-7.15,-1.13,-7.843969735517977
O=S(=O)([O-])OC[C@@H]1O[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@H](O)[C@H](O)[C@@H]1O,C65734976_decoy,TRY1,Decoy,0,-7.66392,-7.09,-1.53,-6.172234134277969
CC(C)COC(=O)C[C@H]1C(=O)NCCN1CC(=O)N1CCNC(=O)[C@@H]1CC(=O)OCC(C)C,C66229003_decoy,TRY1,Decoy,0,-7.81871,-5.15,-3.73,-5.380572213725834
C[C@@H](O)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)OCC(=O)NC(=O)NC(C)(C)C,C09083443_decoy,TRY1,Decoy,0,-9.18856,-6.73,-4.33,-7.377390215782942
CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1C,C09158448_decoy,TRY1,Decoy,0,-10.7128,-7.33,-2.54,-7.002350959862366
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)NNC(=O)c1ccc([N+](=O)[O-])cc1,C09224315_decoy,TRY1,Decoy,0,-7.17542,-6.58,-3.32,-6.036955785960507
Cc1ccccc1OCC(=O)NNC(=O)CNC(=O)CNC(=O)c1ccc(Cl)cc1Cl,C09440083_decoy,TRY1,Decoy,0,-9.13062,-7.26,-1.85,-7.165376645385094
CCCn1c(N)c(N(CCOC)C(=O)CSc2nc3ccc(Cl)cc3[nH]2)c(=O)[nH]c1=O,C09484290_decoy,TRY1,Decoy,0,-8.46109,-6.85,-2.38,-7.968370882095667
CCCCN(C(=O)CSc1nnc(NCC)s1)c1c(N)n(CCC)c(=O)[nH]c1=O,C10344516_decoy,TRY1,Decoy,0,-7.91192,-4.65,-2.66,-5.979022620974575
CCCCn1c(N)c(N(CCC)CC(=O)Nc2ccsc2C(=O)OC)c(=O)[nH]c1=O,C11351072_decoy,TRY1,Decoy,0,-8.29227,-6.33,-3.71,-5.842039819682397
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CSc2nnc(CC)[nH]2)c(=O)[nH]c1=O,C11716739_decoy,TRY1,Decoy,0,-8.38521,-6.1,-4.44,-7.813754507812189
COc1ccc(/C=N/N2C(=O)c3cccc4c(NC(CO)(CO)CO)ccc(c34)C2=O)c(OC)c1,C16215491_decoy,TRY1,Decoy,0,-9.98755,-7.38,-1.73,-9.661949642732113
CCN(CC)c1ccc(/C=N/N2C(=O)c3cccc4c(NC(CO)(CO)CO)ccc(c34)C2=O)cc1,C19143518_decoy,TRY1,Decoy,0,-9.93144,-5.35,-1.95,-6.53796190026333
CCCCCCc1nc(SCc2nc(N)nc(N)n2)c2c(=O)n(C)c(=O)n(CCC)c2n1,C19297935_decoy,TRY1,Decoy,0,-8.56804,-7.16,-4.68,-7.246094743310297
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C(\C)c3ccccn3)n2)c1,C20159943_decoy,TRY1,Decoy,0,-9.10286,-9.12,-2.11,-7.66900069015373
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3nc(C)cs3)n2N)cc1,C20527710_decoy,TRY1,Decoy,0,-10.8411,-8.34,-1.1,-7.982495672256304
CC(=O)Nc1cccc(NC(=O)CCSc2nnc(N/N=C/c3ccc([N+](=O)[O-])cc3)[nH]2)c1,C21037649_decoy,TRY1,Decoy,0,-8.39495,-6.82,-4.09,-6.123907626107809
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cccnc3)n2)cc1,C21038572_decoy,TRY1,Decoy,0,-8.63934,-8.38,-3.71,-8.165072465621973
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccccc3F)n2)c1,C21077514_decoy,TRY1,Decoy,0,-8.13323,-9.15,-3.33,-9.541606820459926
COc1ccc(/C=N/Nc2nc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3)n[nH]2)cc1O,C21078740_decoy,TRY1,Decoy,0,-8.94528,-6.78,-2.72,-6.45625991012508
CCOC(=O)c1c(C)[nH]c(C(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)c1C,C21320452_decoy,TRY1,Decoy,0,-7.22361,-4.99,-2.43,-5.597873108008287
NC(=O)N[C@H](CC(=O)OCC(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1Cl,C21842915_decoy,TRY1,Decoy,0,-6.82213,-7.89,-1.77,-5.959784273953826
Cc1[nH]c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(C)c1C(=O)OC(C)C,C22306704_decoy,TRY1,Decoy,0,-9.03887,-6.98,-3.45,-5.809914436726301
O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)NNC(=S)NC[C@@H]1CCCO1,C22617588_decoy,TRY1,Decoy,0,-9.55825,-7.32,-2.71,-6.755543100828538
CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NNC(=S)NC[C@H]1CCCO1,C25262120_decoy,TRY1,Decoy,0,-8.39036,-4.92,-1.2,-5.936005567856614
CC[C@@H](C)[C@H](NC(=O)CCC(=O)[O-])C(=O)N[C@@H](C)C(=O)[NH+]=c1ccc2c(C)cc(O)oc-2c1,C25758961_decoy,TRY1,Decoy,0,-7.98185,-7.03,-2.61,-6.233978622986777
CCc1cc(C(C)=O)c(O)cc1OCc1cccc(C(=O)Nc2nc(CC(=O)NO)cs2)n1,C28458854_decoy,TRY1,Decoy,0,-10.8239,-7.55,-2.6,-7.912380894609158
C[C@H](Sc1nnc(CCC(N)=O)n1C[C@@H]1CCCO1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C28945826_decoy,TRY1,Decoy,0,-7.96023,-6.08,-1.28,-5.878497172471761
CCOc1cc(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)cc(OCC)c1OCC,C30982060_decoy,TRY1,Decoy,0,-9.36182,-8.29,-1.75,-9.022035788523777
COC(=O)c1ccc([C@@H]2[NH2+][C@](CO)(C(=O)[O-])[C@@H]3C(=O)N(CCNc4ccccc4)C(=O)[C@H]32)cc1,C33657477_decoy,TRY1,Decoy,0,-8.28338,-6.7,-1.7,-6.477372390806871
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccnc1,C36505722_decoy,TRY1,Decoy,0,-8.5387,-5.26,-3.33,-6.2068143566896765
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36528105_decoy,TRY1,Decoy,0,-6.54339,-4.93,-4.57,-5.468152094765019
CCCN(C(=O)CCl)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36574196_decoy,TRY1,Decoy,0,-8.33397,-8.0,-2.96,-10.458654625229451
CCCN(C(=O)CCl)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36574197_decoy,TRY1,Decoy,0,-8.48922,-7.39,-1.5,-7.415309576599863
Cc1cc(C)c(NC(=O)CNC(=O)CSc2nc(C)c(CCC(=O)O)c(=O)[nH]2)c(C)c1,C13449423_decoy,TRY1,Decoy,0,-7.08245,-5.99,-2.39,-5.0707480881200375
CCOCCCN1C(=O)c2[nH]nc(-c3ccccc3O)c2[C@H]1c1ccc(OCC(N)=O)cc1,C38610673_decoy,TRY1,Decoy,0,-9.29229,-6.61,-4.39,-7.176099592890897
Cc1ccccc1C(=O)NNc1ncnc(NNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1[N+](=O)[O-],C40657718_decoy,TRY1,Decoy,0,-7.36845,-8.01,-2.93,-6.12934002874006
O=C(COc1ccccc1)NNc1ncnc(NNC(=O)c2ccccc2F)c1[N+](=O)[O-],C40658202_decoy,TRY1,Decoy,0,-7.23439,-6.7,-2.2,-6.16078481400257
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)NC(N)=O)CCC3)cc1,C44452627_decoy,TRY1,Decoy,0,-9.68977,-5.06,-2.6,-5.885413700781684
CCCCCC(=O)[C@](CCCC)(C1=Nc2nnc(N)n2C1=O)C1=NC(=O)c2nnc(N)n21,C48552264_decoy,TRY1,Decoy,0,-7.29614,-7.67,-3.22,-7.932926071137484
COCCN(C(=O)CN[C@@H](C)c1cccc(Cl)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13056863_decoy,TRY1,Decoy,0,-8.38287,-6.64,-1.94,-6.20475714375263
COCCN(C(=O)CN[C@H](C)c1cccc(Cl)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13056865_decoy,TRY1,Decoy,0,-8.32013,-6.28,-2.98,-5.653271634939528
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)NCc1ccc2c(c1)OCO2,C58997418_decoy,TRY1,Decoy,0,-8.3554,-8.52,-2.66,-7.364968543095651
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(CC)s3)n[nH]2)c1O,C59004790_decoy,TRY1,Decoy,0,-10.1338,-7.0,-3.14,-6.823434212135537
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)NNc3ccc(F)cc3)n[nH]2)c1C,C59831595_decoy,TRY1,Decoy,0,-9.66533,-7.14,-3.23,-7.669510623500733
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccccc3[N+](=O)[O-])n2)c1,C59844262_decoy,TRY1,Decoy,0,-6.65289,-8.93,-3.32,-6.993961316419207
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2cccc(Cl)c2C)n[nH]1,C59888006_decoy,TRY1,Decoy,0,-10.3229,-8.76,-2.63,-8.562352056500096
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1Cl,C59888012_decoy,TRY1,Decoy,0,-9.87208,-8.55,-1.87,-8.094949443151124
CCOc1ccc2nc(NC(=O)CSc3n[nH]c(N/N=C/c4c(C)nn(CCO)c4C)n3)sc2c1,C59888314_decoy,TRY1,Decoy,0,-11.1329,-9.02,-1.9,-10.054813555119196
CCCCN1C(=O)N=C([O-])[C@@H](N(CC(C)C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)[C@H]1[NH3+],C39779349_decoy,TRY1,Decoy,0,-7.38206,-4.78,-3.64,-5.315541641990114
CCCCN1C(=O)N=C([O-])[C@H](N(CC(C)C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)[C@H]1[NH3+],C39779351_decoy,TRY1,Decoy,0,-7.72736,-5.39,-2.57,-5.304300776764165
CCCCN1C(=O)N=C([O-])[C@H](N(CC(C)C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)[C@@H]1[NH3+],C39779352_decoy,TRY1,Decoy,0,-7.10088,-5.53,-3.66,-5.195432623553348
OCCNc1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1,C65739899_decoy,TRY1,Decoy,0,-10.1456,-4.59,-2.39,-7.54204858241885
CC(C)(O)[C@@H]1Cc2cc3ccc(=O)oc3c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2O1,C04098003_decoy,TRY1,Decoy,0,-7.09028,-6.44,-1.65,-4.486760874871304
Nc1nc(N)c2nc(SCc3nc4ccccc4c(=O)n3-c3ccccc3)[nH]c2n1,C04066908_decoy,TRY1,Decoy,0,-7.6167,-9.16,-1.07,-8.043999146970599
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C)C(=O)NC(C)(C)C)c1C,C04191660_decoy,TRY1,Decoy,0,-7.05822,-7.54,-0.53,-9.9573323816213
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC(C)(C)C)c1C,C04191663_decoy,TRY1,Decoy,0,-7.15145,-7.27,-2.96,-7.160461714114438
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C)C(=O)NC(C)(C)C)cc1C,C04191667_decoy,TRY1,Decoy,0,-6.70618,-6.15,-1.37,-5.653593893762575
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC(C)(C)C)cc1C,C04191669_decoy,TRY1,Decoy,0,-7.61217,-4.7,-2.01,-5.100611959368307
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC(C)(C)C)c1,C04191679_decoy,TRY1,Decoy,0,-8.07637,-6.99,-1.87,-9.521518449671994
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12,C04349764_decoy,TRY1,Decoy,0,-7.70836,-6.83,-2.87,-5.9124304682361855
O=C1C[C@@H](c2ccccc2)Oc2cc(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c21,C04557376_decoy,TRY1,Decoy,0,-7.15998,-6.08,-0.44,-5.151749637348787
CCOC(=O)[C@@H]1CC[C@@]2(O)[C@H]3CC[C@@]4(O)CC(=O)C[C@@H](O)[C@]4(CO)[C@@H]3[C@@H](O)C[C@]12C,C05247505_decoy,TRY1,Decoy,0,-8.01798,-5.44,-3.29,-5.3707758972604696
CCOC(=O)[C@@H]1CC[C@]2(O)[C@H]3CC[C@@]4(O)CC(=O)C[C@@H](O)[C@]4(CO)[C@@H]3[C@@H](O)C[C@]12C,C05247515_decoy,TRY1,Decoy,0,-9.14655,-5.0,-4.24,-5.482904683217071
CCOC(=O)[C@H]1CC[C@@]2(O)[C@H]3CC[C@@]4(O)CC(=O)C[C@@H](O)[C@]4(CO)[C@@H]3[C@@H](O)C[C@]12C,C05247537_decoy,TRY1,Decoy,0,-8.10721,-5.67,-3.37,-4.8049654966943285
CCOC(=O)[C@H]1CC[C@]2(O)[C@H]3CC[C@@]4(O)CC(=O)C[C@@H](O)[C@]4(CO)[C@@H]3[C@@H](O)C[C@]12C,C05247543_decoy,TRY1,Decoy,0,-10.0371,-5.8,-2.98,-5.998763830665014
CC1(C)CC(Nc2ncnc3c2ncn3[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC(C)(C)N1O,C05374313_decoy,TRY1,Decoy,0,-8.04301,-6.15,-1.15,-5.137287258031947
Cc1cccc(-n2c(C)nc3ccc(N[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3c2=O)c1,C05541660_decoy,TRY1,Decoy,0,-7.64061,-7.94,-0.65,-6.8799539078121095
COc1cc([C@@H]2c3cc4c(cc3O[C@H](NNC(N)=O)[C@@H]2C)OCO4)cc(OC)c1O,C01644283_decoy,TRY1,Decoy,0,-8.82259,-6.74,-2.78,-5.832849120888351
COc1cc([C@H]2c3cc4c(cc3O[C@H](NNC(N)=O)[C@@H]2C)OCO4)cc(OC)c1O,C06004080_decoy,TRY1,Decoy,0,-8.16232,-6.74,-1.75,-5.824571028576522
COc1cc([C@H]2c3cc4c(cc3O[C@H](NNC(N)=O)[C@H]2C)OCO4)cc(OC)c1O,C06004082_decoy,TRY1,Decoy,0,-8.32153,-6.12,-1.0,-5.596026972504056
Cn1c2c(c(=O)[nH]c1=O)[C@@](NS(=O)(=O)c1ccc(N)cc1)(C(F)(F)F)C(=O)N2,C02884531_decoy,TRY1,Decoy,0,-7.01736,-7.87,-3.51,-8.214034915169542
Cn1c2c(c(=O)[nH]c1=O)[C@](NS(=O)(=O)c1ccc(N)cc1)(C(F)(F)F)C(=O)N2,C02884532_decoy,TRY1,Decoy,0,-7.81173,-7.72,-2.1,-7.882508425128722
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@]12C(=O)N(CC(N)=O)c1ccccc12,C10186404_decoy,TRY1,Decoy,0,-7.28433,-6.29,-1.69,-5.279556899513617
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C10186405_decoy,TRY1,Decoy,0,-6.48487,-5.66,-2.38,-4.970794653679712
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)ccc12,C12501593_decoy,TRY1,Decoy,0,-8.3636,-7.02,-2.42,-6.416407143081588
O=C1C[C@H](c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C13322014_decoy,TRY1,Decoy,0,-6.87768,-7.3,-2.05,-5.329043701788619
O=c1c(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)coc2cc(O)ccc12,C13328778_decoy,TRY1,Decoy,0,-8.75509,-9.05,-1.63,-5.962134902677614
O=c1c(-c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc2)coc2cc(O)ccc12,C13328782_decoy,TRY1,Decoy,0,-8.65918,-7.54,-1.6,-5.45758480392973
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@@H](O)[C@@H](O)CO)c1ccccc1Cl,C15774934_decoy,TRY1,Decoy,0,-8.06436,-8.12,-0.96,-9.99776253870377
COc1cc([C@H]2c3cc4c(cc3O[C@@H](NNC(N)=O)[C@@H]2C)OCO4)cc(OC)c1O,C16958706_decoy,TRY1,Decoy,0,-7.92181,-6.19,-0.85,-4.780821674155808
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc12,C00689734_decoy,TRY1,Decoy,0,-7.62084,-7.57,-1.81,-6.269086363449177
N#Cc1c(N)nc(SCC(=O)c2ccc(O)c(O)c2)c(C#N)c1-c1ccc(O)cc1,C19880132_decoy,TRY1,Decoy,0,-8.90045,-6.4,-2.71,-5.479179368021498
Cc1ccc(S(=O)(=O)[C@@H](O)[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)cc1,C21299512_decoy,TRY1,Decoy,0,-7.36686,-9.26,-0.44,-12.98434432425156
Cc1ccc(S(=O)(=O)[C@H](O)[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)cc1,C21299516_decoy,TRY1,Decoy,0,-8.21594,-6.73,-3.09,-6.150920589028245
CC(C)(O)[C@H]1Oc2cc3oc(=O)ccc3cc2[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31163752_decoy,TRY1,Decoy,0,-7.50166,-7.18,-2.84,-5.488662954947526
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc21,C33832983_decoy,TRY1,Decoy,0,-8.49201,-8.48,-1.69,-7.49864797601322
Cc1c(C(=O)NN)sc2c1c(=O)n(CC(N)=O)c(=O)n2CC(=O)N1CCCCC1,C34782749_decoy,TRY1,Decoy,0,-9.58589,-6.18,-1.05,-6.759789220157435
O=C1C[C@@H](c2ccccc2)Oc2cc(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c21,C37246185_decoy,TRY1,Decoy,0,-6.68341,-7.3,-1.45,-5.021331281812004
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C12374721_decoy,TRY1,Decoy,0,-7.72146,-6.93,-1.0,-6.19744363693924
CCc1ccc(-c2c(C#N)c(N)nc3sc(C(=O)Nc4cc(C)on4)c(N)c23)cc1,C39432527_decoy,TRY1,Decoy,0,-7.69817,-5.87,-5.51,-4.758266362584187
Nc1c(NNC(=O)c2ccc(F)cc2)ncnc1Nc1ccc(Br)cn1,C40779807_decoy,TRY1,Decoy,0,-8.46057,-7.35,-2.07,-6.139748304616695
NC(=O)c1c(Nc2nc(N3CCCCC3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026390_decoy,TRY1,Decoy,0,-7.7639,-7.54,-2.24,-6.830714856343698
NC(=O)c1c(Nc2nc(N3CCOCC3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026441_decoy,TRY1,Decoy,0,-7.49126,-7.41,-1.54,-6.464312075715714
NC(=O)c1c(Nc2nc(N3CCCCCC3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301857_decoy,TRY1,Decoy,0,-8.54353,-7.43,-2.47,-7.3024034162341875
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)ccc12,C44019634_decoy,TRY1,Decoy,0,-7.95895,-6.62,-1.35,-5.953893039209005
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)ccc12,C44019643_decoy,TRY1,Decoy,0,-7.9851,-6.68,-3.49,-5.997454807816841
COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccncc4)c32)ccc1OCC(N)=O,C04019826_decoy2,TRY1,Decoy,0,-7.23431,-4.98,,-5.054737890703196
CC1=C(C(=O)N/N=C/c2ccc3c(c2)OCO3)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59385048_decoy,TRY1,Decoy,0,-8.01134,-7.71,-1.95,-5.834321127884606
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=NN1c1ccc(O)cc1,C38667410_decoy,TRY1,Decoy,0,-7.4689,-8.37,-3.02,-6.520113590997374
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=NN1c1ccc(O)cc1,C38667414_decoy,TRY1,Decoy,0,-7.48798,-7.57,-1.67,-6.645005911108519
O=c1c(-c2ccccc2)coc2cc(O[C@@]3(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C64220075_decoy,TRY1,Decoy,0,-6.55896,-5.89,-2.1,-4.418458656229836
O=c1c(-c2ccccc2)coc2cc(O[C@]3(O)O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc12,C64220078_decoy,TRY1,Decoy,0,-6.73022,-6.36,-1.34,-5.522088782553069
C[NH2+][C@H](C(=O)N[C@@H]1C=C(C(=O)N[C@H]2CCCNC2=O)C[C@@H](O)[C@@H]1O)C(C)C,C05414149_decoy,TRY1,Decoy,0,-9.0797,-7.01,-1.13,-7.248034644971068
Cc1ccc(S(=O)(=O)OC[C@H]2O[C@@H](O)[C@@H]([NH2+]CC=O)[C@@H](O)[C@@H]2O)cc1,C05700061_decoy,TRY1,Decoy,0,-6.34024,-5.63,-1.53,-6.020529345095903
Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@@H](O)[C@@H]([NH2+]CC=O)[C@@H](O)[C@@H]2O)cc1,C05700064_decoy,TRY1,Decoy,0,-6.68397,-7.0,-1.65,-6.011916481007273
Cn1c(=O)c2c(ncn2CC[NH2+]C[C@H](O)c2ccc(O)c(O)c2)n(C)c1=O,C01843003_decoy,TRY1,Decoy,0,-6.54482,-8.51,-1.72,-7.86898045507977
[NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08738349_decoy,TRY1,Decoy,0,-8.62121,-6.43,-1.42,-7.4880240759705154
Nc1nonc1C(=[NH2+])N/N=C/c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1,C09307098_decoy,TRY1,Decoy,0,-10.9721,-6.66,-2.36,-6.82595264280434
Cn1c(=O)c2c(nc(C[NH+]3CCC(C(N)=O)CC3)n2CC(N)=O)n(C)c1=O,C09187787_decoy,TRY1,Decoy,0,-7.87953,-4.86,-1.75,-4.745397407556411
Cn1c(=O)c2c(ncn2CC[NH2+]C[C@@H](O)c2ccc(O)c(O)c2)n(C)c1=O,C13207386_decoy,TRY1,Decoy,0,-7.4994,-7.24,-1.84,-6.867346514529577
[NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13424993_decoy,TRY1,Decoy,0,-8.78382,-6.56,-1.92,-7.7990077591869875
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCCOC)C[NH+]12,C15708461_decoy,TRY1,Decoy,0,-6.99982,-3.99,-2.72,-5.22097294225835
Cn1c(=O)[nH]c(=O)c2c1nc(Br)n2CCCCSC(N)=[NH2+],C04730658_decoy,TRY1,Decoy,0,-9.0361,-6.51,-1.48,-8.83238125268986
Cc1nnc(C[NH+]2CCCN(C(=O)CSc3nnc(NN)n3N)CC2)o1,C20922375_decoy,TRY1,Decoy,0,-7.62806,-8.69,-1.39,-9.14959132577672
N/C(=N\O)c1ccc2nc(-c3ccc(-c4ccc(C(=[NH2+])NO)cc4)o3)cn2c1,C27193399_decoy,TRY1,Decoy,0,-9.78482,-9.7,-1.59,-10.87311427911162
CC[C@@H](C)[NH+](Cc1nc(N)nc(N(C)C)n1)Cc1nc(N)nc(N(C)C)n1,C28973689_decoy,TRY1,Decoy,0,-7.70468,-6.92,-3.73,-9.094973254726115
CC[C@H](C)[NH+](Cc1nc(N)nc(N(C)C)n1)Cc1nc(N)nc(N(C)C)n1,C28973696_decoy,TRY1,Decoy,0,-7.34043,-5.9,-2.01,-7.097148217304074
Nc1c(C(=O)C[NH+]2CCC(NC(=O)C3CC3)CC2)c(=O)[nH]c(=O)n1C1CC1,C30284168_decoy,TRY1,Decoy,0,-7.52342,-5.31,-2.64,-5.027481008392139
Cc1sc2nc(N3CC[NH+](CC(N)=O)CC3)n(CC(N)=O)c(=O)c2c1C,C34748612_decoy,TRY1,Decoy,0,-7.68462,-6.19,-0.96,-5.610913626335871
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H]([NH2+]Cc3ccccc3[O-])[C@@H]2O)CC1,C12529667_decoy,TRY1,Decoy,0,-7.53439,-7.78,-1.51,-5.740302958846665
[NH3+]CCCCCCN[C@H]1N=C2C(=O)N=CN=C2N1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345364_decoy,TRY1,Decoy,0,-7.98619,-5.57,-2.77,-6.244629100989659
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NCc3ccc(CO)o3)C[NH+]12)NC1CC1,C22936894_decoy,TRY1,Decoy,0,-7.89122,-6.78,-3.04,-5.695528908624774
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NCc3ccc(CO)o3)C[NH+]12,C22936916_decoy,TRY1,Decoy,0,-7.38169,-4.54,-3.59,-4.579215363007911
Nc1c(NNC(=O)c2ccco2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40794500_decoy,TRY1,Decoy,0,-7.43451,-6.08,-0.56,-4.410120652847765
CCCNC(=O)C[NH+]1CCC(NC(=O)NCCCNS(C)(=O)=O)CC1,C41171909_decoy,TRY1,Decoy,0,-7.85867,-5.05,-1.23,-5.086082885580115
CC[C@@H](CNC(=O)NNC(=O)C(=O)NC1CC1)[NH+]1CCc2ccccc2C1,C46312570_decoy,TRY1,Decoy,0,-8.55056,-7.05,-1.46,-7.298362093706341
CN(C)c1nc(N)nc(C[NH+](Cc2nc(N)nc(N(C)C)n2)CC2CC2)n1,C47614261_decoy,TRY1,Decoy,0,-8.38992,-7.17,-4.02,-8.822390913560243
NC(=O)c1ccsc1NC(=O)C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1,C47963936_decoy,TRY1,Decoy,0,-8.4411,-7.14,-1.07,-7.337976487023175
C=CCNC(=O)NC(=O)C[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C16556748_decoy,TRY1,Decoy,0,-7.93541,-6.39,-3.46,-6.688093659323313
CCCNC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C1,C50998815_decoy,TRY1,Decoy,0,-7.78701,-5.85,-2.11,-4.836208657500003
CCCNC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C1,C50998818_decoy,TRY1,Decoy,0,-7.56578,-6.95,-2.41,-6.403644290256437
Nc1c(C(=O)C[NH+]2CCC[C@H](C(=O)NC3CC3)C2)c(=O)[nH]c(=O)n1C1CC1,C51046224_decoy,TRY1,Decoy,0,-7.78566,-5.83,-1.74,-5.08273355400294
Nc1c(C(=O)C[NH+]2CCC[C@@H](C(=O)NC3CC3)C2)c(=O)[nH]c(=O)n1C1CC1,C51046226_decoy1,TRY1,Decoy,0,-7.39662,-6.68,,-6.921541711203451
CCCC[C@@H]1CC(=O)[C@]2(O)O[C@@H]3[C@@H](NC)[C@@H](O)[C@@H]([NH2+]C)[C@H](O)[C@H]3O[C@@H]2O1,C56898742_decoy,TRY1,Decoy,0,-8.80868,-6.76,-2.16,-6.377859537551339
CC[NH+]1CCN(Cc2c(C(=O)N/N=C3/C(=O)Nc4ccccc43)nnn2-c2nonc2N)CC1,C19905430_decoy,TRY1,Decoy,0,-8.16992,-7.74,-2.54,-8.067698425553187
Nc1nc(N)nc(CSc2nnc(C3=c4ccccc4=[NH+]C3)n2C2CC2)n1,C63194375_decoy,TRY1,Decoy,0,-8.84808,-7.46,-1.41,-6.8813595492480175
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)C(=O)Nc1c[nH]c(=O)[nH]c1=O,C63328940_decoy,TRY1,Decoy,0,-9.16512,-7.71,-1.99,-6.755165427198478
CCCNC(=O)C[NH+](CCC)CC(=O)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C63525804_decoy,TRY1,Decoy,0,-6.23459,-5.24,-1.45,-5.4170367432118445
CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)NCCCn1cc[nH+]c1,C64885188_decoy,TRY1,Decoy,0,-6.93789,-5.31,-2.29,-5.332255089099042
CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)c1C,C64885267_decoy,TRY1,Decoy,0,-7.09449,-6.63,-3.17,-5.129300838968017
CCCc1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)[nH]c(C)c1C(C)=O,C64885856_decoy,TRY1,Decoy,0,-8.15035,-5.57,-3.04,-5.526935824214855
O=C(CCNc1ccccc1[N+](=O)[O-])NNC(=O)NCCCn1cc[nH+]c1,C64886369_decoy,TRY1,Decoy,0,-6.91841,-6.09,-2.44,-6.978791124312173
CCc1[nH]c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)c(C)c1C(=O)OC,C64886584_decoy,TRY1,Decoy,0,-6.35726,-6.24,-3.86,-4.730665686720323
Cc1cc(=O)[nH]c(NCCNc2nc(CC[NH3+])nc3sc(C)c(C)c23)n1,C65432379_decoy,TRY1,Decoy,0,-9.50947,-7.31,-2.13,-7.20906850197067
NC(=O)CC[C@H]1CCC[NH+](CC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C66156516_decoy,TRY1,Decoy,0,-8.98766,-6.89,-2.69,-7.803123324883383
NC(=O)CC[C@@H]1CCC[NH+](CC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C66156518_decoy,TRY1,Decoy,0,-8.06344,-5.26,-2.54,-5.601236231130139
CC(=O)NC[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)C1,C67415227_decoy,TRY1,Decoy,0,-7.46258,-6.23,-2.46,-5.86866522400585
CNC(=O)[C@@H]1C[C@@H](n2cc(CNC(=O)Nc3ccc(Cl)nc3)nn2)C[NH2+]1,C67447161_decoy,TRY1,Decoy,0,-8.75767,-7.65,-0.37,-6.733589503016723
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(O)c1O,C04252629_decoy,TRY1,Decoy,0,-9.27599,-10.06,-1.95,-8.42909394208776
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(O)c1O,C04252633_decoy,TRY1,Decoy,0,-9.54621,-10.38,-2.06,-10.661852566900864
Nc1nc(N)nc(CCP(CCc2nc(N)nc(N)n2)CCc2nc(N)nc(N)n2)n1,C05086592_decoy,TRY1,Decoy,0,-9.26706,-8.78,-2.69,-11.72071898037967
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(O)c1O,C13424695_decoy,TRY1,Decoy,0,-9.19742,-9.76,-1.91,-8.303427082121543
[NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)[O-],C05700395_decoy,TRY1,Decoy,0,-8.1705,-7.04,-3.66,-7.547999259512385
Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)cc1,C22048728_decoy,TRY1,Decoy,0,-6.56431,-8.19,-2.75,-8.788480654021102
Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C22048752_decoy,TRY1,Decoy,0,-6.04085,-7.72,-1.96,-6.274955445360591
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)cc1,C22048780_decoy,TRY1,Decoy,0,-6.99295,-7.13,-4.14,-6.610717969076041
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)cc1,C22048790_decoy,TRY1,Decoy,0,-6.99087,-7.0,-2.24,-6.591863539580289
Nc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C35636321_decoy,TRY1,Decoy,0,-5.84748,-4.61,-1.69,-4.32918198501269
Cc1cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1C,C08740318_decoy,TRY1,Decoy,0,-5.01333,-6.72,-2.47,-6.339952797555151
Cc1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1C,C08740319_decoy,TRY1,Decoy,0,-6.48892,-7.34,-1.1,-6.438058891593922
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C39935780_decoy,TRY1,Decoy,0,-6.74886,-6.73,-1.71,-6.375349401363692
Nc1ccc(S[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C43193628_decoy,TRY1,Decoy,0,-7.09967,-7.63,-3.37,-6.618047485915043
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C43193631_decoy,TRY1,Decoy,0,-5.90746,-7.13,-1.58,-6.366288032231225
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(O)c1O,C43465388_decoy,TRY1,Decoy,0,-9.50043,-6.59,-3.82,-5.720002271157
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)c(O)c1O,C43465390_decoy,TRY1,Decoy,0,-8.87386,-6.91,-2.89,-5.914228206792656
O[C@@H]1[C@H](O)[C@H](OP(O)(O)=S)[C@@H](OP(O)(O)=S)[C@@H](O)[C@@H]1OP(O)(O)=S,C43763982_decoy,TRY1,Decoy,0,-8.25,-4.45,-3.49,-5.172883131488714
Nc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C44019175_decoy,TRY1,Decoy,0,-6.96716,-6.93,-2.42,-5.960799539554717
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C44135695_decoy,TRY1,Decoy,0,-5.48524,-6.07,-2.76,-5.344644270313559
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44135728_decoy,TRY1,Decoy,0,-6.87206,-7.42,-2.57,-7.503354918878544
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2O)cc1,C44960162_decoy,TRY1,Decoy,0,-6.75767,-7.65,-2.5,-6.778411970729256
Nc1ccc(S[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2O)cc1,C44960174_decoy,TRY1,Decoy,0,-6.78859,-7.52,-3.36,-5.916536689134986
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C04096846_decoy,TRY1,Decoy,0,-7.85427,-8.58,-4.09,-6.239620572840191
OC[C@@H]1O[C@@H](Nc2ccccc2N[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C15135219_decoy,TRY1,Decoy,0,-6.26444,-5.84,-1.35,-5.739228320797573
C[C@H](O)C[NH2+]CCNc1ccc(NCC[NH2+]C[C@H](C)O)c2c1C(=O)c1c(O)ccc(O)c1C2=O,C05386712_decoy,TRY1,Decoy,0,-9.53091,-6.71,-3.09,-7.4310227381136
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C22061384_decoy,TRY1,Decoy,0,-9.08166,-5.44,-3.7,-6.640212619848219
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@@H](O)CO)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C22061387_decoy,TRY1,Decoy,0,-8.90679,-6.07,-3.06,-7.2348875151702625
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C22061390_decoy,TRY1,Decoy,0,-9.66286,-5.61,-3.7,-8.301993913663111
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,C22061393_decoy,TRY1,Decoy,0,-9.11478,-5.56,-3.27,-6.511659514894072
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C33792636_decoy,TRY1,Decoy,0,-8.42387,-6.42,-2.18,-7.728857077182631
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C33792637_decoy,TRY1,Decoy,0,-9.84721,-4.92,-2.78,-6.6357565498148325
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C33792638_decoy,TRY1,Decoy,0,-8.61623,-4.73,-2.98,-6.028469955177605
O=C(NCCC[NH2+]CCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C33792639_decoy,TRY1,Decoy,0,-8.72312,-4.79,-4.05,-7.311466381077624
NC(=O)OC[C@@H](O)[C@@H](O)[C@@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@@H]1O[C@H](n2cc(CO)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C38654171_decoy,TRY1,Decoy,0,-6.57947,-6.99,-2.7,-6.869408482939411
NC(=O)OC[C@@H](O)[C@@H](O)[C@@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C38654176_decoy,TRY1,Decoy,0,-7.46213,-7.33,-2.97,-7.535225846674754
NC(=O)OC[C@@H](O)[C@@H](O)[C@@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@@H]1O[C@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@@H]1O,C38654181_decoy,TRY1,Decoy,0,-6.04957,-8.2,-4.07,-7.0769305379986
NC(=O)OC[C@@H](O)[C@@H](O)[C@@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@@H]1O,C38654185_decoy,TRY1,Decoy,0,-7.8199,-6.71,-2.6,-5.653083893823017
CN1C(N[C@H]2O[C@@H](CO)[C@@H](OC(N)=O)[C@@H](O)[C@H]2NC(=O)C[C@H]([NH3+])CCC[NH3+])=[NH+][C@@H]2[C@H](O)CNC(=O)[C@H]21,C40476913_decoy,TRY1,Decoy,0,-7.59143,-6.94,-2.53,-6.601449923198214
CN1C(N[C@@H]2O[C@@H](CO)[C@@H](OC(N)=O)[C@@H](O)[C@H]2NC(=O)C[C@H]([NH3+])CCC[NH3+])=[NH+][C@@H]2[C@H](O)CNC(=O)[C@H]21,C40476915_decoy,TRY1,Decoy,0,-8.62339,-5.92,-2.15,-6.758410650412411
CN1C(N[C@H]2O[C@@H](CO)[C@@H](OC(N)=O)[C@@H](O)[C@@H]2NC(=O)C[C@H]([NH3+])CCC[NH3+])=[NH+][C@@H]2[C@H](O)CNC(=O)[C@H]21,C40476917_decoy,TRY1,Decoy,0,-9.50878,-5.99,-3.06,-6.459245134899695
CN1C(N[C@@H]2O[C@@H](CO)[C@@H](OC(N)=O)[C@@H](O)[C@@H]2NC(=O)C[C@H]([NH3+])CCC[NH3+])=[NH+][C@@H]2[C@H](O)CNC(=O)[C@H]21,C40476919_decoy,TRY1,Decoy,0,-8.29131,-6.17,-2.77,-6.8934274708410825
CC(=O)NCCNC(=O)C[C@@H]1c2nc(NC(=O)c3c(F)cccc3F)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222402_decoy,TRY1,Decoy,0,-11.2472,-6.61,-2.26,-7.2264538646883585
COc1cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(O)c3c(=O)cc(C)oc3cc2c1,C05665630_decoy,TRY1,Decoy,0,-6.38728,-8.26,-1.62,-7.02415190735642
COc1nc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)n1C,C05760530_decoy,TRY1,Decoy,0,-6.59759,-4.8,-2.15,-4.209613242426441
O=c1c2cc(Br)ccc2nc(-c2ccccc2)n1NC[C@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C05885450_decoy,TRY1,Decoy,0,-6.51064,-6.76,-0.15,-4.484766775001878
CC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06074916_decoy,TRY1,Decoy,0,-7.64791,-4.51,-0.99,-5.207760580318276
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(C)o2)cc1,C06822065_decoy,TRY1,Decoy,0,-8.36305,-5.28,-3.92,-6.062078664914022
NC(=O)C1CCN(C(=O)[C@H]2C[C@@H](O)[C@H](O)[C@@H]3N=C(Nc4ccc(Cl)cc4)S[C@@H]32)CC1,C08300888_decoy,TRY1,Decoy,0,-10.3526,-8.16,-3.02,-8.328950347565439
N#CC1=C(N)Oc2cc(O)c(/C=N/c3ccc(S(N)(=O)=O)cc3)cc2[C@H]1c1ccco1,C08382547_decoy,TRY1,Decoy,0,-6.69972,-5.42,-2.73,-4.605832555127099
CC(C)c1ccc(N2C(=O)N=C(O)[C@H](/C=N/[C@@H]3[C@H](O)[C@H](O)[C@H](CO)O[C@@H]3O)C2=O)cc1,C09358419_decoy,TRY1,Decoy,0,-6.88288,-8.29,-2.69,-5.804750430201478
CC(C)c1ccc(N2C(=O)N=C(O)[C@H](/C=N/[C@@H]3[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]3O)C2=O)cc1,C09358426_decoy,TRY1,Decoy,0,-7.64986,-6.16,-1.04,-5.330523991137704
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@](C)(CO)[C@@](C)(O)[C@@]1(C)O,C09915656_decoy,TRY1,Decoy,0,-6.00717,-7.0,-2.21,-5.316113715746955
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3cc(Cl)ccc23)O[C@@](C)(CO)[C@](C)(O)[C@@]1(C)O,C09915666_decoy,TRY1,Decoy,0,-5.7831,-5.86,-1.6,-4.241328313892747
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@](C)(CO)[C@](C)(O)[C@@]1(C)O,C09970494_decoy,TRY1,Decoy,0,-7.63546,-6.67,-3.86,-5.254590687426191
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@H](C(=O)Nc2ccc(Cl)cc2Cl)CC(=O)N3)CC1,C12408389_decoy,TRY1,Decoy,0,-9.83504,-8.58,-1.02,-7.166240036117247
NC(=O)c1nsc(C(=O)N(Cc2ccc(F)cc2)[C@@H](C(=O)NC2CCCC2)c2ccc(F)cc2)c1N,C12473635_decoy,TRY1,Decoy,0,-8.75186,-7.51,-1.96,-9.114051806856136
CCOc1cc(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3)coc2c1,C04257552_decoy,TRY1,Decoy,0,-8.679,-8.25,-2.94,-6.164149961343735
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(C)o2)c1,C12714618_decoy,TRY1,Decoy,0,-7.48237,-7.31,-2.84,-8.009219129030157
Cc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)o1,C12714743_decoy,TRY1,Decoy,0,-9.08906,-5.99,-2.64,-6.270621575123867
Nc1nc(SCCC/C=C/I)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05733404_decoy,TRY1,Decoy,0,-9.18956,-4.26,-1.86,-4.980293187994363
NC(=O)c1nsc(C(=O)N(Cc2ccc(F)cc2)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccncc2)c1N,C06444815_decoy,TRY1,Decoy,0,-8.91743,-7.83,-1.42,-9.198009484104308
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@@H](CO)[C@@H](O)[C@H]1O,C15205866_decoy,TRY1,Decoy,0,-6.95804,-6.97,-0.83,-5.20239112627746
CC(C)c1ccc(N2C(=O)N=C(O)[C@@H](/C=N/[C@H]3[C@@H](O)[C@H](O)[C@H](CO)O[C@H]3O)C2=O)cc1,C17249344_decoy,TRY1,Decoy,0,-6.60419,-5.68,-4.22,-4.462769608126244
COc1ccc(-c2[nH]c3[nH]c(=O)[nH]c(=O)c3c2-c2c(-n3cccc3)[nH]c(=O)[nH]c2=O)cc1,C20896832_decoy,TRY1,Decoy,0,-6.44013,-5.93,-1.56,-4.710286977478068
Cc1cc(C)cc(NC(=O)[C@@H]2CC(=O)Nc3nc(N4CCC(C(N)=O)CC4)[nH]c(=O)c32)c1,C22610494_decoy,TRY1,Decoy,0,-8.50877,-7.32,-1.01,-7.573821935826553
O=C(Nc1nc2c(ncn2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2,C27562859_decoy,TRY1,Decoy,0,-8.31431,-8.21,-2.16,-6.242629298675506
O=C(Nc1nc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2,C27562865_decoy,TRY1,Decoy,0,-8.89557,0.87,-1.72,-3.15118374263208
Cc1cc(=O)c2c(O)c3c(cc2o1)O[C@@H](C(C)(C)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)C3,C31156015_decoy,TRY1,Decoy,0,-7.89785,-6.53,-4.67,-5.0679753779836245
O=C(Nc1nc2c(ncn2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1)C12CC3CC(CC(C3)C1)C2,C35088768_decoy,TRY1,Decoy,0,-9.1099,-7.21,-3.77,-5.850987646384979
Cc1cc(=O)c2c(O)c3c(cc2o1)O[C@H](C(C)(C)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C3,C35454976_decoy,TRY1,Decoy,0,-6.64865,-7.38,-1.71,-4.995681560739484
Cc1cc(=O)c2c(O)c3c(cc2o1)O[C@@H](C(C)(C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C3,C35454967_decoy,TRY1,Decoy,0,-6.50998,-8.24,-1.98,-5.718421047696457
NC(=O)c1cc(N/N=C2/C(=O)N(c3c(Cl)cc(Cl)cc3Cl)N=C2N)ccc1Cl,C13555319_decoy,TRY1,Decoy,0,-9.57378,-8.4,-2.14,-9.902405851266016
COc1ccc2[nH]cc(CCN/C(=N\C(=O)CS[C@H]3NN[C@@H](C)S3)Nc3nc(C)cc(C)n3)c2c1,C38787630_decoy,TRY1,Decoy,0,-9.22423,-6.01,-3.57,-6.106215926989301
COc1cc(N2C(=O)[C@@H]([C@H]3NCCc4c3[nH]c3ccccc43)[C@H](O)N[C@H]2O)cc(OC)c1OC,C39006677_decoy,TRY1,Decoy,0,-7.92341,-8.5,-2.84,-6.059483358400681
CC1=C[C@@H]([C@@H]2NN[C@H](SCC(=O)Nc3ccc(Br)cc3F)N2N)N=N1,C39007342_decoy,TRY1,Decoy,0,-8.18424,-7.15,-1.71,-7.637344756945089
CC1=C[C@@H]([C@H]2NN[C@H](SCC(=O)Nc3ccc(Br)cc3F)N2N)N=N1,C39007344_decoy,TRY1,Decoy,0,-9.35129,-8.52,-1.7,-7.496396633114765
NN1[C@@H](SCC(=O)Nc2ccc(F)c(Cl)c2)NN[C@@H]1[C@@H]1C=C(c2ccc(Cl)cc2)N=N1,C39007655_decoy,TRY1,Decoy,0,-11.5654,-6.27,-2.24,-6.83229959109213
NN1[C@@H](SCC(=O)Nc2ccc(F)c(Cl)c2)NN[C@@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C39012503_decoy,TRY1,Decoy,0,-11.3997,-6.42,-2.13,-6.730254805643392
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccc2c(c1)OCO2,C40684992_decoy,TRY1,Decoy,0,-8.73124,-6.53,-1.56,-5.713995605996786
Nc1c(NNC(=O)c2ccco2)ncnc1Nc1ccc(I)cc1,C40782378_decoy,TRY1,Decoy,0,-7.80735,-5.53,-4.08,-4.856184198085162
C[C@@H]1CN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCC4)n2)C[C@H](C)O1,C41301963_decoy,TRY1,Decoy,0,-9.48127,-7.83,-2.8,-8.071138510677237
C[C@@H]1CN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCC4)n2)C[C@@H](C)O1,C41301971_decoy,TRY1,Decoy,0,-7.91543,-7.53,-4.01,-7.713732720922949
CC(=O)N[C@H]1[C@@H](Oc2cc3c(Cl)c(Br)ccc3[nH]2)O[C@H](CO)[C@H](O)[C@@H]1O,C44699205_decoy,TRY1,Decoy,0,-8.81473,-5.01,-1.07,-5.702638770185433
Nc1c(C(=[NH2+])N/N=C/c2cc3c(cc2Br)OCO3)nc2ccccc2[n+]1[O-],C16545147_decoy,TRY1,Decoy,0,-9.04426,-6.51,-3.0,-4.943658623703146
C/C(=N\NC(=O)c1nc(Cl)c(Cl)c(N)c1Cl)c1ccc(S(N)(=O)=O)cc1,C57411192_decoy,TRY1,Decoy,0,-10.336,-8.1,-1.41,-7.123234327645926
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@@H](c2ccc(Br)cc2)NC(=O)N1,C59385518_decoy,TRY1,Decoy,0,-9.7986,-6.82,-1.37,-5.898059738436461
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(Cl)cc2Cl)NC(=O)N1,C59385728_decoy,TRY1,Decoy,0,-10.1993,-6.04,-2.05,-6.0069522614752495
C[C@H](Sc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2O)n1)C(=O)NNC(=O)C1CCC1,C59879476_decoy,TRY1,Decoy,0,-10.1045,-8.09,-3.05,-7.096206042374537
CC1=C2C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)S[C@H]2N(Cc2ccc(Cl)cc2)N1,C39939992_decoy,TRY1,Decoy,0,-10.8671,-9.59,-0.41,-15.857394604138635
CCc1ccc(C2=C[C@@H](C(=O)N[C@@H]3S[C@@H](Nc4ccc(C)cc4)N[C@H]3C(N)=O)N=N2)cc1,C64728950_decoy,TRY1,Decoy,0,-8.90007,-7.75,-1.45,-5.946976417610698
COc1ccc(N2CC[NH+]([C@H](CNC(=O)C(=O)NCCO)c3ccco3)CC2)cc1,C04273043_decoy,TRY1,Decoy,0,-6.80822,-6.99,-2.24,-5.136791710994308
C[C@@H](C(=O)NNC(=S)NCC[NH+]1CCOCC1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O,C06084746_decoy,TRY1,Decoy,0,-8.5011,-6.39,-2.5,-5.722863095732388
CN(C)c1ccc([C@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2CC[NH2+]CCO)cc1,C05986015_decoy,TRY1,Decoy,0,-7.93709,-7.01,-0.9,-7.4167636578112575
NS(=O)(=O)c1ccc(CC[NH2+][C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1,C06182961_decoy,TRY1,Decoy,0,-8.98366,-7.75,-1.68,-7.981246689045973
CC[NH+]1CCc2c(sc(NC(=O)CCS(=O)(=O)c3ccccc3)c2C(N)=O)C1,C04325555_decoy,TRY1,Decoy,0,-8.56512,-6.91,-2.08,-5.919773353153894
C[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1cnn(-c2ccccc2)c1,C08157007_decoy,TRY1,Decoy,0,-8.29274,-7.7,-2.29,-6.581805297585797
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2Cn1cc(-c2cccc(O)c2)nn1,C08299024_decoy,TRY1,Decoy,0,-8.29057,-8.48,-1.71,-7.891276954216644
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@H]1C[C@@H]2Cn1cc(-c2cccc(O)c2)nn1,C08299025_decoy,TRY1,Decoy,0,-9.669,-7.64,-2.34,-6.939915100016956
COc1ccc(C[NH+](C)[C@@H](C)C(=O)Nc2sccc2C(N)=O)c(OC)c1OC,C08983140_decoy,TRY1,Decoy,0,-6.80851,-5.9,-1.2,-6.465550801835901
CC[NH+]1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc([C@@]2(CC)CCC(=O)NC2=O)cc1,C12409047_decoy,TRY1,Decoy,0,-7.88443,-8.01,-3.87,-6.1776784519216
CC[NH+]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc([C@@]2(CC)CCC(=O)NC2=O)cc1,C12409050_decoy,TRY1,Decoy,0,-8.05172,-7.71,-2.29,-6.3215861145163865
CCc1ccc(OC[C@@H](O)Cn2c(N3CC[NH2+]CC3)nc3c2c(=O)[nH]c(=O)n3C)cc1,C05360316_decoy,TRY1,Decoy,0,-7.99946,-7.78,-2.16,-9.033258608224754
Cn1c(=O)[nH]c(=O)c2c1nc(NCC[NH+]1CCOCC1)n2C[C@@H](O)c1ccccc1,C04945681_decoy,TRY1,Decoy,0,-7.78939,-7.01,-2.49,-6.912351562001638
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(=O)NCCC[NH+](C)C)cc2)no1,C13728116_decoy,TRY1,Decoy,0,-7.88414,-6.49,-3.93,-6.879851317018713
CSCC[C@H]([NH3+])c1nnc(SCC(=O)Nc2ccc(Br)cc2)o1,C02431779_decoy,TRY1,Decoy,0,-10.0931,-7.06,-2.94,-7.311621492812755
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)CC(=O)N(CC)CC)c(=O)[nH]c1=O,C15484861_decoy,TRY1,Decoy,0,-7.26283,-4.78,-3.98,-5.286391188345686
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3ccc(N(C)C)cc3)C[NH+]12,C15708418_decoy,TRY1,Decoy,0,-8.50884,-6.37,-1.98,-6.175888539665692
Cc1c(C(N)=O)sc(NC(=O)C[NH+](C)Cc2cnn(C)c2)c1C(=O)OC(C)C,C17087735_decoy,TRY1,Decoy,0,-8.33328,-6.54,0.26,-6.06642216280782
COC(=O)c1c(NC(=O)C[NH+](C)Cc2c(C)nn(C)c2C)sc(C(N)=O)c1C,C17087738_decoy,TRY1,Decoy,0,-8.4154,-5.33,-1.63,-5.9233543263133885
OC[C@@H]1O[C@H](C[NH2+]Cc2ccc(F)cc2)[C@H](N2CCN(c3ncccn3)CC2)[C@@H]1O,C20465093_decoy,TRY1,Decoy,0,-6.79809,-6.06,-2.29,-5.260521361171898
CC[NH+]1CCN(CCCNC(=O)c2ccc(-n3ncc(C(=O)OC)c3N)cc2)CC1,C21652399_decoy,TRY1,Decoy,0,-9.21398,-5.51,-2.07,-4.726814341384781
CCOC(=O)C1=C(CN2CC[NH+](CC(=O)NCCOC)CC2)NC(=O)N[C@@H]1CC,C21672325_decoy,TRY1,Decoy,0,-8.49537,-6.3,-2.68,-7.911655216876152
CCCCn1c(N)c(N(CC)C(=O)C[NH+]2CCC[C@H]2C(=O)N(C)C)c(=O)[nH]c1=O,C22014623_decoy,TRY1,Decoy,0,-7.56712,-5.89,-1.58,-9.778703304073325
Cc1n[nH]c(=O)c2c(NC(=O)CN3CC[NH+](CC(=O)NCC(C)C)CC3)oc(C)c12,C22134665_decoy,TRY1,Decoy,0,-8.36988,-6.85,-1.86,-6.4655962031165
CNC(=O)C[NH+]1CCN(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)CC1,C22799546_decoy,TRY1,Decoy,0,-7.18491,-7.94,-1.57,-6.969593409939574
Cc1c(C)c2c(c(C)c1OC(=O)CCC[NH3+])C[C@@H](CCn1ccc(=O)c(O)c1C)O2,C26974841_decoy,TRY1,Decoy,0,-8.7775,-7.27,-2.45,-7.800656395992054
C=CCNc1scc(-c2ccc(O)c(C(N)=O)c2)[n+]1/N=C/c1ccc([N+](=O)[O-])o1,C34873177_decoy,TRY1,Decoy,0,-8.43341,-7.18,-1.29,-7.856095095551678
C[NH+]1[C@@H](CCC(=O)NCc2cccs2)CNC(=O)[C@@H]2[C@H]1CCN2Cc1ncc[nH]1,C22923088_decoy,TRY1,Decoy,0,-7.8089,-6.32,-1.73,-6.600977125972727
CCCCNC(=O)CSc1nc2n[nH]c(C)c2c(N)[n+]1-c1cccc(Cl)c1C,C33617603_decoy,TRY1,Decoy,0,-9.07839,-6.78,-3.22,-7.23939730357273
C[NH+](C)CC(C)(C)CNC(=O)C1CCN(c2cc(N3CCOCC3)nc(N)n2)CC1,C39300848_decoy,TRY1,Decoy,0,-8.5806,-5.53,-1.53,-5.918662804547257
Cc1nc(C[NH2+]Cc2cccc(OC[C@H](O)CN3CCc4ccccc4C3)c2)n[nH]1,C19741703_decoy1,TRY1,Decoy,0,-8.58807,-7.22,,-6.317923269618458
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39601605_decoy,TRY1,Decoy,0,-8.73087,-7.45,-2.11,-6.566561935706127
O=C(NCCOCCO)[C@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C39601621_decoy,TRY1,Decoy,0,-7.70599,-7.65,-1.11,-8.148351759323022
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C39601623_decoy,TRY1,Decoy,0,-8.26087,-6.86,-2.76,-5.875133139122062
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601829_decoy,TRY1,Decoy,0,-8.41923,-6.69,-0.67,-5.887068821499018
CSCCC(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631728_decoy,TRY1,Decoy,0,-9.24175,-5.93,-2.85,-6.179443595648171
CSCCC(=O)N1C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631729_decoy,TRY1,Decoy,0,-10.079,-6.73,-1.81,-8.055821466648068
CSCCC(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631731_decoy,TRY1,Decoy,0,-10.8439,-6.47,-1.3,-7.778159362747245
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39632135_decoy,TRY1,Decoy,0,-9.28711,-6.82,-1.87,-6.625450379343921
CCCCC(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693371_decoy,TRY1,Decoy,0,-8.88646,-5.89,-2.86,-6.0893838111151535
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39693442_decoy,TRY1,Decoy,0,-7.8897,-6.03,-2.16,-5.569942596877423
C[NH+]1CCN(NC(=S)Nc2ccc(S(=O)(=O)NCc3ccco3)cc2)CC1,C39971195_decoy,TRY1,Decoy,0,-7.55147,-5.53,-4.65,-4.583140909912737
CC1(C)CC(Nc2ncnc(NCCN3CCOCC3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645274_decoy,TRY1,Decoy,0,-8.58015,-4.99,-1.48,-5.102866728496013
C/N=C(/NCC[C@H]1CCCC[C@@]1(C(=S)NC)c1ccc[nH+]c1)NS(C)(=O)=O,C13590029_decoy,TRY1,Decoy,0,-7.31848,-5.91,-3.29,-5.149239681181472
CCCCNC(=O)CSc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(Cl)c(C)c1,C49539676_decoy,TRY1,Decoy,0,-9.34269,-7.95,-2.69,-9.920901119911576
COCCNC(=O)c1ccccc1NC(=O)C(=O)NCCC1=c2ccccc2=[NH+]C1,C63271873_decoy,TRY1,Decoy,0,-7.71258,-8.23,-3.24,-7.337741563484624
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)C1=C([O-])N(C)C(=O)N(CC(C)C)[C@H]1N)[NH+]=2,C63731670_decoy,TRY1,Decoy,0,-7.81737,-6.93,-2.16,-5.378742474832912
O=C(NCCNC(=O)[C@H]1C=c2ccccc2=[NH+]1)C(=O)NCc1ccc2c(c1)OCO2,C63780985_decoy,TRY1,Decoy,0,-8.33541,-7.3,-2.48,-5.90776449802537
Cc1n[nH]c(CNCc2cccc(OC[C@H](O)C[NH+]3CCc4ccccc4C3)c2)n1,C19741703_decoy2,TRY1,Decoy,0,-7.50601,-6.69,,-5.713310349739171
Cc1n[nH]c(CNCc2cccc(OC[C@@H](O)C[NH+]3CCc4ccccc4C3)c2)n1,C19741701_decoy,TRY1,Decoy,0,-8.84413,-7.51,-2.22,-6.409291778096087
Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc(O)c2)c1C[NH+]1CCCCC1,C01911770_decoy,TRY1,Decoy,0,-9.06617,-6.53,-2.96,-6.405421588408048
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)c4ccco4)nc3[C@@H](CC(=O)NCC[NH+]3CCOCC3)[C@]2(C)CC[C@H]1O,C04222436_decoy,TRY1,Decoy,0,-10.8134,-6.17,-2.29,-6.905670105549644
CC(=O)/C(=C/c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1)C(=O)CC[NH+](C)C,C05567135_decoy,TRY1,Decoy,0,-6.77909,-6.35,-2.26,-4.999255862651212
C[NH+](C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(Cl)cc3)S[C@@H]21,C08643788_decoy,TRY1,Decoy,0,-10.2207,-5.03,-2.1,-6.333175321728564
Nc1nc2c(c(=O)[nH]1)N[C@@H]([NH2+]CCc1ccccc1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08738367_decoy,TRY1,Decoy,0,-6.94661,-8.31,-3.11,-7.918099175624584
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)[NH2+][C@@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C08789966_decoy,TRY1,Decoy,0,-10.0845,-9.9,-2.24,-10.637351234543583
Cc1cc(Cl)cc2c1NC(=O)[C@@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08791195_decoy,TRY1,Decoy,0,-8.14846,-6.21,-1.96,-7.166256664220892
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2nc3ccccc3[nH]2)nnn1-c1nonc1N,C08809508_decoy,TRY1,Decoy,0,-7.74967,-5.48,-2.67,-5.3757395870746345
Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccccc2O)c1C[NH+]1CCOCC1,C01812146_decoy,TRY1,Decoy,0,-7.70047,-5.55,-2.48,-5.093069240904709
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)ccc1O,C01872614_decoy,TRY1,Decoy,0,-9.15049,-6.18,-4.45,-6.311414057782067
CCOc1ccc(Nc2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C09311917_decoy,TRY1,Decoy,0,-6.823,-6.76,-0.72,-11.642422849660909
COc1cccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)c1O,C02381755_decoy,TRY1,Decoy,0,-8.56459,-7.1,-3.74,-6.568464210767381
COc1ccc(OC)c(Nc2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])c1,C09363539_decoy,TRY1,Decoy,0,-7.08567,-7.14,-0.23,-11.164611694781014
NS(=O)(=O)c1ccc(NNC(=S)NCC[NH+]2CCOCC2)c([N+](=O)[O-])c1,C09540147_decoy,TRY1,Decoy,0,-9.23181,-6.63,-0.28,-6.716984038959232
CCC[C@@H]1C[C@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)O)[NH+](C)C1,C11592628_decoy,TRY1,Decoy,0,-7.58007,-5.84,-2.59,-6.382677020367981
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12795355_decoy,TRY1,Decoy,0,-8.52188,-7.39,-1.45,-6.169977702306483
COCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@@]3(C(=O)Nc4c(C)cccc43)[C@@H]2C1=O,C12902423_decoy,TRY1,Decoy,0,-7.49264,-4.73,-1.91,-4.958592779346633
C[NH+](C)Cc1c(C(=O)N/N=C/c2cc(Cl)ccc2O)nnn1-c1nonc1N,C03640439_decoy,TRY1,Decoy,0,-8.89143,-7.84,-2.9,-7.069337064998692
COc1cc(/C=N/Nc2nnc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n2N)cc(OC)c1OC,C20920316_decoy,TRY1,Decoy,0,-9.82927,-6.0,-2.37,-6.17032225987462
COc1ccccc1Nc1nc(N)nc(C[NH+]2CC=C(c3ccc(O)cc3)CC2)n1,C25680442_decoy,TRY1,Decoy,0,-9.4513,-5.94,-0.87,-5.958048659013949
C/C(=N\NC(=O)c1c(C[NH+]2CCCC2)nnn1-c1nonc1N)c1ccc(O)cc1,C25781909_decoy,TRY1,Decoy,0,-8.72108,-8.29,-3.7,-7.233107680610684
C/C(=N\NC(=O)c1c(C[NH+]2CCCC2)nnn1-c1nonc1N)c1ccccc1O,C25781953_decoy,TRY1,Decoy,0,-7.64688,-8.29,-1.05,-8.857319389090419
CCc1c(C)nc(N)nc1N1N=C1SSC1=[NH+]N1c1nc(N)nc(C)c1CC,C26895494_decoy,TRY1,Decoy,0,-8.44286,-5.69,-2.7,-6.735662064032863
NC1=NON[C@@H]1N1N=N[C@@H](C(=O)N/N=C/c2ccncc2)[C@@H]1C[NH+]1CCCCC1,C28529843_decoy,TRY1,Decoy,0,-8.53263,-8.63,-0.2,-9.878643326828552
C[C@@H](NC(=O)[C@H]1C=CC2(CC[NH2+]CC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21)C(N)=O,C29405276_decoy,TRY1,Decoy,0,-7.93917,-7.42,-1.46,-6.101375397431186
NC1=NON[C@@H]1N1N=N[C@H](C(=O)N/N=C/c2ccncc2)[C@H]1C[NH+]1CCCCC1,C35983668_decoy,TRY1,Decoy,0,-8.00709,-5.42,-1.36,-6.446207051842983
Cc1ccc(CNc2[nH+]c3c(n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)N[C@H](N)NC3=O)cc1,C36281909_decoy,TRY1,Decoy,0,-7.98795,-9.08,-2.54,-9.705668911235872
COc1ccc(-c2cc3ccccc3n2C[C@@H](O)C[NH2+]C(CO)(CO)CO)cc1,C04058421_decoy,TRY1,Decoy,0,-6.81533,-5.76,-2.71,-6.704564061979017
Nc1ncnc2c1nc(NNC1=c3ccccc3=[NH+]C1=O)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636785_decoy,TRY1,Decoy,0,-8.01299,-7.96,-1.49,-7.650891604556336
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@H](c2cc(C)on2)ON1,C39656097_decoy,TRY1,Decoy,0,-10.2932,-7.86,-1.69,-8.357096153746992
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39661755_decoy,TRY1,Decoy,0,-10.3118,-9.12,-3.16,-8.264407093888028
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c1F,C39661797_decoy,TRY1,Decoy,0,-9.00776,-7.04,-4.16,-6.254476486121011
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39661877_decoy,TRY1,Decoy,0,-9.86374,-11.13,-2.16,-8.240450230651055
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C39936969_decoy,TRY1,Decoy,0,-6.98652,-6.2,-1.64,-5.181162446353893
Nc1ncnc2c1N[C@H](N/N=C/C1=c3ccccc3=[NH+]C1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39939249_decoy,TRY1,Decoy,0,-8.37722,-8.39,-1.54,-7.156777003857495
Nc1nc(NCCCn2cc[nH+]c2)nc(Nc2cccc3cccnc23)c1[N+](=O)[O-],C41333985_decoy,TRY1,Decoy,0,-6.96471,-7.66,-0.93,-7.139894087811694
COC(=O)[C@H](CCC/N=C(\N)N[N+](=O)[O-])NC(=O)c1coc(C2CC[NH2+]CC2)n1,C43216317_decoy,TRY1,Decoy,0,-8.46927,-6.05,-1.69,-6.0229271685764445
CSc1ccccc1NC(=O)C[NH+](C)CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C31039990_decoy,TRY1,Decoy,0,-10.3417,-7.56,-2.5,-7.701285588253713
COc1ccccc1/N=C1/NC(CSc2nnc(-c3ccncc3)o2)=[NH+][C@H](N)N1,C38966313_decoy,TRY1,Decoy,0,-8.05491,-6.86,-1.48,-5.620398462459781
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1N[C@@H](COc3ccccc3NC(C)=O)NO1)C[NH+]=2,C63818740_decoy,TRY1,Decoy,0,-7.7475,-7.55,-2.08,-6.427200614297311
COc1ccccc1NC(=O)C[C@@H]1NO[C@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)N1,C63818748_decoy,TRY1,Decoy,0,-7.82036,-7.26,-1.86,-5.5487238178642855
NC(=O)CS[C@@H]1NN[C@@H](N2CCN(C(=O)CC3=c4ccccc4=[NH+]C3)CC2)S1,C64409697_decoy,TRY1,Decoy,0,-8.4828,-7.83,-2.27,-7.276512064068224
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@H]1NNS[C@H]1NC(=O)N1CCCCC1,C65330194_decoy,TRY1,Decoy,0,-7.68562,-6.41,-1.41,-5.872270585479839
COC(=O)[C@@H]1O[C@@H](Oc2ccc(OC[C@H](O)C[NH2+]C(C)C)c3ccccc23)[C@H](O)[C@H](O)[C@@H]1O,C65743002_decoy,TRY1,Decoy,0,-7.64257,-5.99,-2.25,-5.588189275192531
NC(=O)c1nnn([C@H]2C[C@H]3C(=O)N4CC[C@H](NC(=O)C5CCC5)[C@H]4C(=O)N3C2)c1C(N)=O,C04221576_decoy,TRY1,Decoy,0,-7.39613,-6.4,-3.2,-5.197605173430568
O=C1C[C@@H](c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C08681832_decoy,TRY1,Decoy,0,-8.47858,-7.36,-1.31,-5.22436711576907
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)ccc21,C12429155_decoy,TRY1,Decoy,0,-8.79061,-7.54,-1.53,-7.105864674814445
O=C1C[C@@H](c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)Oc2cc(O)ccc21,C12654549_decoy,TRY1,Decoy,0,-7.6634,-6.27,-1.59,-5.236647396580123
COc1ccccc1/C=N/Nc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C16228350_decoy,TRY1,Decoy,0,-6.63728,-8.1,-1.44,-7.207321700937553
NC(=O)C1([NH+]2CCCCC2)CCN(Cc2c(C(=O)[O-])nnn2-c2nonc2N)CC1,C20572348_decoy,TRY1,Decoy,0,-8.56651,-7.44,-1.42,-6.889380316406982
CC(C)(O)C[C@H](O)c1ccc(O)c2c(=O)c3c(O)c4c(cc3oc12)O[C@@H]1OC=C[C@]41O,C31164801_decoy,TRY1,Decoy,0,-9.22746,-8.16,-0.98,-5.958177428817786
CSc1nc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)[nH]1,C17175365_decoy,TRY1,Decoy,0,-8.15429,-4.26,-3.78,-4.4628017168649246
CSc1nc(N[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(I)c(=O)[nH]1,C17175366_decoy,TRY1,Decoy,0,-8.08426,-5.81,-3.12,-5.093940729606643
Cc1c(C(=O)NN)sc2c1c(=O)n(CC(N)=O)c(=O)n2CC(=O)N1CCOCC1,C34782751_decoy,TRY1,Decoy,0,-8.05811,-6.91,-1.24,-8.650779266623058
OC[C@@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@H](O)[C@@H]1O,C35051232_decoy,TRY1,Decoy,0,-8.52686,-8.91,-1.85,-7.813589928033252
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@@H]1O,C35051234_decoy,TRY1,Decoy,0,-8.03403,-9.11,-1.59,-9.137411453355533
OC[C@@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@@H]1O,C35051236_decoy,TRY1,Decoy,0,-9.13575,-8.67,-1.8,-8.016899996666016
Cc1cc(=O)c2c(C)cc3cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2o1,C35464245_decoy,TRY1,Decoy,0,-6.92897,-6.94,-2.35,-4.43844713630577
Oc1cc(O)c2cc(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)c(-c3ccc(O)c(O)c3)[o+]c2c1,C35465764_decoy,TRY1,Decoy,0,-7.72844,-9.08,-2.31,-7.749361769527165
CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31156007_decoy,TRY1,Decoy,0,-6.83418,-7.22,-1.44,-4.55306317072799
O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)Oc2cc(O)ccc21,C08829785_decoy,TRY1,Decoy,0,-7.8185,-6.38,-2.86,-5.118604132603322
Cc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4nccs4)N3N)N=N2)cc1,C39000931_decoy,TRY1,Decoy,0,-9.31483,-5.52,-1.7,-5.74718724883107
Cc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4nccs4)N3N)N=N2)cc1,C39000932_decoy,TRY1,Decoy,0,-9.03759,-8.93,-1.29,-10.39490227637043
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4nccs4)N3N)N=N2)cc1,C39000933_decoy,TRY1,Decoy,0,-9.99551,-7.87,-2.28,-7.031364990338166
COc1ccc([C@]2(O)c3c(ccc(C[C@@H](O)C(C)(C)O)c3O)NC(=O)[C@H]2OC)cc1,C39559705_decoy,TRY1,Decoy,0,-8.2762,-7.04,-1.16,-8.209688628494005
COc1ccc([C@]2(O)c3c(ccc(C[C@H](O)C(C)(C)O)c3O)NC(=O)[C@H]2OC)cc1,C39559706_decoy,TRY1,Decoy,0,-8.46841,-8.24,-1.85,-7.314665489276719
CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C39560181_decoy,TRY1,Decoy,0,-7.37355,-6.58,-3.54,-4.638089028109762
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)ccc12,C43465479_decoy,TRY1,Decoy,0,-7.53603,-6.85,-3.08,-6.093013002268077
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C44136604_decoy,TRY1,Decoy,0,-6.89687,-8.45,-1.21,-7.9317277488338895
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@H](O)[C@@H]1O,C44963086_decoy,TRY1,Decoy,0,-6.16498,-8.54,-1.83,-5.036407563846933
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@@H](O)[C@@H]1O,C44963088_decoy,TRY1,Decoy,0,-5.87983,-7.15,-1.94,-4.343434003689433
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@@H](O)[C@@H](O)[C@@H]1O,C44963090_decoy,TRY1,Decoy,0,-6.43098,-7.63,-3.44,-4.942873422187592
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c(c2)[C@@]24CCCC[C@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@H](O)[C@@H]1O,C44963092_decoy,TRY1,Decoy,0,-4.45902,-6.14,-2.07,-3.779396889980719
OC[C@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@H](O)[C@@H]1O,C44964065_decoy,TRY1,Decoy,0,-7.97041,-8.46,-1.21,-8.013420103096568
OC[C@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C44964067_decoy,TRY1,Decoy,0,-8.25946,-8.48,-1.18,-7.684937503655107
Cc1cc2c(c(=O)n1C)[C@H](c1cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c1=O)C(C#N)=C(N)O2,C45374664_decoy,TRY1,Decoy,0,-5.69197,-5.02,-2.28,-4.121836675636607
Cc1cc2c(c(=O)n1C)[C@@H](c1cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c1=O)C(C#N)=C(N)O2,C45374670_decoy,TRY1,Decoy,0,-5.3638,-6.28,-3.26,-4.232985427580317
CCc1nnc(N/N=C/c2cc(Br)c(O)c(Br)c2O)n1N,C16162585_decoy,TRY1,Decoy,0,-9.69389,-5.8,-1.71,-5.299832102667902
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C04741514_decoy,TRY1,Decoy,0,-5.847,-5.25,-2.32,-4.526084584466908
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@]12C(=O)N(CC(N)=O)c1ccccc12,C04741515_decoy,TRY1,Decoy,0,-5.70415,-5.37,-2.04,-3.951260232692648
CC1=NC(=O)[C@@H]2C(=C1)OC(N)=C(C#N)[C@H]2c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O,C52569976_decoy,TRY1,Decoy,0,-7.88817,-7.04,-2.53,-5.257211351409105
CC1=NC(=O)[C@H]2C(=C1)OC(N)=C(C#N)[C@@H]2c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O,C52569977_decoy,TRY1,Decoy,0,-6.82033,-6.1,-2.18,-5.117611277642056
CC1=NC(=O)[C@@H]2C(=C1)OC(N)=C(C#N)[C@@H]2c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O,C52569978_decoy,TRY1,Decoy,0,-5.74466,-6.74,-0.91,-4.723187118317867
COC(=O)[C@@H]1NNN(c2nonc2N)[C@H]1CSc1nc2ccc([N+](=O)[O-])cc2[nH]1,C39205283_decoy,TRY1,Decoy,0,-8.71851,-7.52,-1.87,-7.288624130474545
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(C(F)(F)F)cc2)=N[C@@H]2NC(=O)NC(=O)[C@H]12,C63529336_decoy,TRY1,Decoy,0,-5.82087,-5.4,-2.22,-4.320143476557676
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(C(F)(F)F)cc2)=N[C@H]2NC(=O)NC(=O)[C@@H]12,C63529337_decoy,TRY1,Decoy,0,-6.69107,-6.03,-1.42,-4.383479957620549
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(C(F)(F)F)cc2)=N[C@@H]2NC(=O)NC(=O)[C@@H]12,C63529338_decoy,TRY1,Decoy,0,-8.45557,-6.58,-1.77,-4.9814624663223
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/NC(CO)(CO)CO,C06225697_decoy,TRY1,Decoy,0,-8.06183,-4.92,-1.26,-4.95560427964731
O=c1c(-c2ccccc2)coc2cc(O[C@]3(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C64220076_decoy,TRY1,Decoy,0,-6.33757,-6.0,-1.26,-5.030208924912657
Oc1cc(O)c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c(-c3ccc(O)c(O)c3)[o+]c2c1,C34296981_decoy,TRY1,Decoy,0,-8.92028,-8.56,-2.91,-7.547404109719245
Oc1cc(O)c2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@@H]3O)c(-c3ccc(O)c(O)c3)[o+]c2c1,C65739500_decoy,TRY1,Decoy,0,-7.22739,-9.43,-1.62,-8.260938212275327
O=C([O-])[C@@H]1O[C@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@H](O)[C@@H]1O,C65739927_decoy,TRY1,Decoy,0,-6.05672,-7.38,-2.68,-4.635764191843572
O=C([O-])[C@@H]1O[C@H](Oc2ccc3c(c2)[C@@]24CCCC[C@@H]2[C@@H](C3)[NH2+]CC4)[C@@H](O)[C@H](O)[C@@H]1O,C65739930_decoy,TRY1,Decoy,0,-5.15416,-7.37,-1.25,-4.260790253082128
O=C([O-])[C@@H]1O[C@H](Oc2ccc3c(c2)[C@@]24CCCC[C@H]2[C@@H](C3)[NH2+]CC4)[C@H](O)[C@H](O)[C@@H]1O,C65739931_decoy,TRY1,Decoy,0,-4.58485,-6.29,-4.77,-3.5678963648364665
COc1ccc(CN2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@@]4(C(=O)Nc5c(C)cc(Cl)cc54)[C@@H]3C2=O)cc1,C02132098_decoy,TRY1,Decoy,0,-7.67748,-5.67,-0.31,-4.946950489280073
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@H]1c1ccc(O)cc1)c1ccc(F)cc1,C04629678_decoy,TRY1,Decoy,0,-7.20979,-5.8,-2.07,-5.17936556560749
CC[NH+](CC)CCCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C)C(=O)NC1CCCCC1,C06511191_decoy,TRY1,Decoy,0,-8.751,-7.15,-3.47,-8.732836781804645
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C08789041_decoy,TRY1,Decoy,0,-6.80325,-6.1,-1.38,-5.489035723338647
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C08789044_decoy,TRY1,Decoy,0,-8.08897,-7.19,-1.25,-8.343568798126265
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790657_decoy,TRY1,Decoy,0,-9.32226,-6.6,-1.87,-6.286659568871474
NC(=O)C[C@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]21,C08790668_decoy,TRY1,Decoy,0,-7.61545,-6.19,-2.18,-5.081537176516356
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N([C@H](C)c3ccccc3)C(=O)[C@H]21,C02130478_decoy,TRY1,Decoy,0,-7.83185,-7.13,-1.09,-5.946611497158262
Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc(O)c2)c1C[NH+]1CCOCC1,C01826936_decoy,TRY1,Decoy,0,-8.72404,-6.66,-0.62,-6.880512171259643
CC1(C)Cc2c(sc(NC(=O)CCS(=O)(=O)c3ccccc3)c2C(N)=O)C(C)(C)[NH2+]1,C09831995_decoy,TRY1,Decoy,0,-8.81787,-6.99,-1.57,-7.313966987630079
NC(=O)C[NH+]1CCC(NC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)CC1,C11542255_decoy,TRY1,Decoy,0,-9.616,-6.97,-1.87,-6.0659061335149405
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2ccc(Cl)cc21,C12877658_decoy,TRY1,Decoy,0,-9.19879,-5.52,-2.46,-6.235673599871107
Cc1cc(C)cc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+](C)C)[C@H]3S2)c1,C08636328_decoy,TRY1,Decoy,0,-9.50915,-5.55,-0.51,-7.0030731802720965
O=c1nc[nH]c2c1nc(N1CC[NH+](CCO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C06445051_decoy,TRY1,Decoy,0,-7.46311,-5.89,-1.57,-5.250480228438063
CCC[C@]12CN3C[C@](CCC)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323236_decoy,TRY1,Decoy,0,-9.59395,-5.03,-1.78,-6.191695086937699
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1,C20905207_decoy,TRY1,Decoy,0,-9.12485,-8.18,-3.76,-8.09007871396687
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C21985988_decoy,TRY1,Decoy,0,-7.6875,-5.92,-1.19,-5.770069483340632
[NH3+][C@H](CS)C(=O)NCCNC(=O)CCCC[C@H]1SC[C@@H]2NC(=O)N[C@@H]21,C22051885_decoy,TRY1,Decoy,0,-10.6801,-6.32,-1.97,-8.127922014304453
[NH3+][C@@H](CS)C(=O)NCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21,C22052060_decoy,TRY1,Decoy,0,-10.8338,-4.29,-2.9,-6.14518180318272
COc1cc(C[NH2+]CCNC[C@H](C)O)cc(Br)c1OCC(N)=O,C22075594_decoy,TRY1,Decoy,0,-8.47615,-4.34,-3.68,-5.55670104478672
COc1ccccc1COC[C@@H](O)C[NH2+]CCc1ccc(S(N)(=O)=O)cc1,C32682388_decoy,TRY1,Decoy,0,-8.10922,-6.33,-3.67,-5.602369542156339
NNC(=O)[C@@H]([NH3+])CCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C04521227_decoy,TRY1,Decoy,0,-9.10988,-6.52,-2.59,-7.278279874069563
CCOc1nc(NC(=O)C[NH+]2CCC(C(=O)NC(C)C)CC2)cc(N)c1C#N,C14960129_decoy,TRY1,Decoy,0,-7.60261,-6.45,-3.68,-6.3329584358511
COc1ccc(C[C@@H]([NH3+])C(=O)N[C@H]2[C@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@H]2CO)cc1,C03874812_decoy,TRY1,Decoy,0,-8.47973,-5.09,-3.31,-5.967817990775894
Cc1cccc(C)c1NC(=O)C[NH+](C)CC(=O)Nc1sc2c(c1C(N)=O)CCC2,C12941143_decoy,TRY1,Decoy,0,-7.63529,-7.35,-1.27,-5.8960262387603946
COc1ccc(C[C@H]([NH3+])C(=O)N[C@H]2[C@@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1,C03861788_decoy,TRY1,Decoy,0,-7.85441,-7.66,-1.82,-6.824563153520288
O=C(NCCOCCO)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228716_decoy,TRY1,Decoy,0,-9.01213,-8.25,-2.28,-6.729985766583951
C/C=C/C=C/C=C\C(=O)N[C@@H](C(=O)O[C@H](C1=C2C=CC(Cl)=C[C@@H]2N=C1)[C@H]1NC(=O)CNC1=O)[C@@H](C)[NH3+],C39559755_decoy,TRY1,Decoy,0,-8.9074,-6.17,,99.0
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661903_decoy,TRY1,Decoy,0,-9.5557,-8.67,-1.48,-8.456895854059878
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](c2cc(C)on2)ON1,C39674064_decoy,TRY1,Decoy,0,-8.98694,-7.21,-2.09,-6.523165326563321
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C40447743_decoy,TRY1,Decoy,0,-7.33722,-4.36,-1.33,-4.703433518705043
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)oc2c1/C(=N/NC(N)=[NH2+])CCC2,C40824953_decoy,TRY1,Decoy,0,-11.311,-6.03,-1.35,-9.377213449790036
CCC(CC)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCC1,C41327688_decoy,TRY1,Decoy,0,-7.32153,-6.72,-1.33,-6.220960526293864
CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C42743166_decoy,TRY1,Decoy,0,-7.87054,-6.21,-2.51,-5.923303261847496
NC(=O)C[C@@H]([NH3+])c1ccc(Sc2ccc(C(F)(F)F)cn2)c([N+](=O)[O-])c1,C44253872_decoy,TRY1,Decoy,0,-7.12443,-7.31,-1.8,-5.838957976788175
Cc1occc1-c1nc(N)c(OC[C@@H]([NH3+])Cc2ccccc2)cc1-c1cnc2[nH]nc(C)c2n1,C45352391_decoy,TRY1,Decoy,0,-8.41569,-7.42,-2.77,-7.624134681204626
CN(C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2[NH+]=C(Nc3ccc(Cl)cc3)S[C@@H]21,C20504117_decoy,TRY1,Decoy,0,-8.90757,-5.16,-0.85,-5.561845760904443
CCCCNC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C1,C51060472_decoy,TRY1,Decoy,0,-8.10393,-6.47,-3.84,-5.547218239410538
C[NH+](C)C1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CCCCC1,C54095339_decoy,TRY1,Decoy,0,-8.35781,-4.86,-1.88,-5.026116919278082
Cc1ccc(C(=O)NCCC[NH+](CCO)CCO)cc1/N=C1\N[C@H]2CS(=O)(=O)C[C@@H]2S1,C20354820_decoy,TRY1,Decoy,0,-10.8403,-5.89,-4.31,-7.164809941368432
Cc1cc(C)nc(/N=C(\NC(=S)NCc2ccco2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161190_decoy,TRY1,Decoy,0,-9.88739,-7.33,-3.44,-7.721996749155338
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1N[C@@H](CC(=O)Nc3ccccc3)NO1)C[NH+]=2,C63818638_decoy,TRY1,Decoy,0,-8.51083,-7.86,-1.4,-7.600238773445023
CC[C@H](C)[NH+](C)CCNC(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C66196138_decoy,TRY1,Decoy,0,-7.77414,-5.93,-1.4,-5.7501112853543415
CC[NH+](CC)[C@@H](CNC(=O)C[C@@H](NC(N)=O)c1ccccc1C)c1ccco1,C67275148_decoy,TRY1,Decoy,0,-7.65528,-6.9,-3.52,-7.232202332058325
O=C(NCCN1C(=O)S/C(=C/c2ccc(OC(F)F)cc2)C1=O)c1cc(Br)ccc1Cl,C03330254_decoy,TRY1,Decoy,0,-8.2506,-7.45,-1.91,-6.074237373977357
Cc1cccc(OCc2nnc(SCC(=O)Nc3sc(C)c(C)c3C#N)n2Cc2ccccc2)c1C,C00902854_decoy,TRY1,Decoy,0,-8.90645,-8.56,-3.44,-8.601840762413753
CC(=O)c1ccc(N(C(=O)[C@H]2COc3ccccc3O2)[C@@H](C(=O)NC2CCCCC2)c2cccs2)cc1,C00931000_decoy,TRY1,Decoy,0,-7.79533,-6.81,-2.68,-6.569318229614856
CC(C)(C)c1ccc(S(=O)(=O)N(Cc2cccs2)Cc2cc3cc4c(cc3[nH]c2=O)OCCO4)cc1,C00925581_decoy,TRY1,Decoy,0,-8.22008,-8.4,-1.83,-6.42630723370693
O=c1[nH]c2cc3c(cc2cc1CN(CCc1ccccc1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)OCCO3,C01222227_decoy,TRY1,Decoy,0,-8.0901,-8.32,-3.15,-7.991781790700531
COc1ccc(OC)c([C@@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N([C@H](C)CCc4ccccc4)CC(=O)N23)c1,C02106319_decoy,TRY1,Decoy,0,-8.60353,-6.49,-1.62,-6.107713618452586
COc1ccc(C)cc1S(=O)(=O)NC[C@@H](c1ccc(N(C)C)cc1)S(=O)(=O)c1ccc(Cl)cc1,C09080803_decoy,TRY1,Decoy,0,-8.52272,-5.65,-3.09,-6.344049533070907
CCOCCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1cc(OC)c(OC)cc1Br,C02955613_decoy,TRY1,Decoy,0,-7.86076,-4.75,-4.26,-5.891267165535279
COc1cc([C@H](c2cc(Cl)c3cccnc3c2O)N2CCN(c3ccccc3)CC2)cc(OC)c1OC,C19902798_decoy,TRY1,Decoy,0,-10.079,-5.78,-1.23,-6.199203525118054
Cc1ccccc1NC(=O)Cc1nc(COC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)cs1,C12568418_decoy,TRY1,Decoy,0,-8.2006,-7.7,-3.23,-6.069697151452907
CCOc1ccc(S(=O)(=O)N(CC(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)c2ccc(F)cc2)cc1,C22370438_decoy,TRY1,Decoy,0,-9.37651,-7.77,-2.79,-8.565072388209085
CCOC(=O)C1=CC2(SC(C(=O)OC)=C(C(=O)OC)S2)C2=C(S1)C(C)(C)Nc1c(C)cccc12,C05947882_decoy,TRY1,Decoy,0,-8.35758,-5.99,-1.57,-5.869968653486626
COc1ccccc1N(C(=O)C[C@@H](NC(C)=O)c1ccccc1Cl)c1nc(-c2ccc(C)cc2)cs1,C32937431_decoy,TRY1,Decoy,0,-8.64535,-8.26,-1.1,-7.577753836922905
COC(=O)c1c(NC(=O)c2cc(OC)c(OC)c(OC)c2Br)sc(C)c1-c1ccccc1,C01973951_decoy,TRY1,Decoy,0,-8.5846,-6.27,-3.51,-6.563824078850913
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)o2)[C@@H]1c1ccc(I)cc1,C33498196_decoy,TRY1,Decoy,0,-7.31701,-6.98,-1.68,-9.065877800307716
COCCCN(CC(=O)N(Cc1ccccc1)Cc1ccc(C)s1)C(=O)Nc1ccc(F)c(Cl)c1,C33567349_decoy,TRY1,Decoy,0,-7.97174,-5.45,-1.74,-5.911655123630861
CCCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@@H]2c2cccc(Br)c2)c1,C33723436_decoy,TRY1,Decoy,0,-9.74033,-5.04,-3.26,-6.574986798672069
COCCN(CCC(=O)Nc1nnc(-c2cccc(Br)c2)s1)C(=O)Cc1ccc(F)cc1,C35700662_decoy,TRY1,Decoy,0,-8.72271,-8.9,-2.19,-8.382297466200553
C=CCN(Cc1cnc(S(=O)(=O)Cc2cccc(Cl)c2)n1C(C)C)C(=S)Nc1ccc(F)cc1,C36042907_decoy,TRY1,Decoy,0,-9.68137,-7.24,-4.15,-7.175325157925536
COc1ccc(-n2cc(-c3ccc(Cl)cc3)nc2NC(=O)CN(CC2CC2)C(=O)c2cccs2)cc1,C36060993_decoy,TRY1,Decoy,0,-9.82767,-7.87,-1.38,-8.993025137219417
C=CCN(CC(=O)N1CCc2sccc2[C@@H]1COc1cccc(OC)c1)C(=O)Nc1cccc(Cl)c1,C36122397_decoy,TRY1,Decoy,0,-8.31815,-8.1,-3.13,-7.166258983102054
COCCN(CC(=O)N1CCc2sccc2[C@H]1COc1ccc(C)cc1)C(=O)Nc1cccc(Cl)c1,C36122792_decoy,TRY1,Decoy,0,-9.08286,-7.86,-1.86,-8.030563377499504
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccccc2C)N(C(=O)CC(C)C)c2cccc(Cl)c2)cc1,C36480885_decoy,TRY1,Decoy,0,-8.76641,-7.48,-3.77,-7.518308633915942
CCCCNC(=O)[C@H](c1ccc2c(c1)OCO2)N(Cc1ccco1)C(=O)Cc1cccc(Cl)c1Cl,C36501069_decoy,TRY1,Decoy,0,-9.99849,-6.93,-1.28,-9.12187084701848
C/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)c1ccccc1OC)c1ccccc1Cl,C36540722_decoy,TRY1,Decoy,0,-8.3385,-7.53,-4.12,-6.765338175481248
CCCCC(=O)N(c1cccc(Cl)c1)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(C)cc1,C36555296_decoy,TRY1,Decoy,0,-9.16647,-8.54,-2.93,-8.517011362216788
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc(C)cc2C)N(C(=O)Cc2ccccc2C)C(C)(C)C)cc1,C36581123_decoy,TRY1,Decoy,0,-8.46734,-8.3,-3.01,-7.209418360759646
Cc1ccc(CN(C(=O)Cc2ccc3c(c2)OCO3)[C@@H](C(=O)NC2CCCCC2)c2ccc(Cl)cc2)o1,C36598967_decoy,TRY1,Decoy,0,-7.92945,-6.07,-1.19,-5.467511377894032
Cc1ccc(CN(C(=O)c2ccc(F)cc2)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccc(N(C)C)cc2)o1,C36602956_decoy,TRY1,Decoy,0,-8.21829,-5.13,-4.9,-5.738180362325794
CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@H](C)C[C@H]2[C@@H]3[C@@H]([C@@H](O)C[C@@]21C)[C@@]1(C)C=CC(=O)C=C1C[C@H]3Cl,C15449289_decoy,TRY1,Decoy,0,-8.71571,-6.35,-2.14,-5.8790226696449945
C[C@H]1Cc2cc(C(=O)C3=C([O-])C(=O)N(CCCn4cc[nH+]c4)[C@H]3c3ccc(Br)cc3)ccc2O1,C15934763_decoy,TRY1,Decoy,0,-8.0102,-7.42,-2.26,-6.905848044994275
C[C@@H]1Cc2cc(C(=O)C3=C([O-])C(=O)N(CCCn4cc[nH+]c4)[C@H]3c3ccc(Br)cc3)ccc2O1,C15934762_decoy,TRY1,Decoy,0,-8.25771,-7.24,-1.48,-6.85226852706343
O=C(CCCCCN1C(=O)/C(=C/c2ccccc2OC2CCCCC2)SC1=S)Nc1nccs1,C39793755_decoy,TRY1,Decoy,0,-9.91754,-8.53,-3.07,-7.972308789027986
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(Br)cc1,C39827960_decoy,TRY1,Decoy,0,-8.33337,-6.29,-2.65,-6.792778570063204
CCCCCCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CCC)c2NCc2ccc(F)cc2)SC1=S,C39851692_decoy,TRY1,Decoy,0,-8.92264,-7.24,-3.39,-9.85880917423026
Cc1sc(NC(=O)CSc2nnc(-c3csc4c3CCCCC4)n2C[C@@H]2CCCO2)c(C#N)c1C,C39966983_decoy,TRY1,Decoy,0,-11.1513,-8.01,-2.97,-9.813430532138664
CSc1ccc(CN2CCN(C(=S)Nc3ccc(S(=O)(=O)N4[C@H](C)CCC[C@@H]4C)cc3)CC2)cc1,C39974442_decoy,TRY1,Decoy,0,-9.81302,-6.13,-3.02,-5.770754331516744
Cc1ccc(Sc2nc(C)c(C(=O)C3=C([O-])C(=O)N(CCC[NH+](C)C)[C@H]3c3ccc(F)cc3)s2)cc1,C39991601_decoy,TRY1,Decoy,0,-9.38332,-6.91,-4.93,-6.045930811103792
CCCn1c(NCc2ccccc2Cl)c(/C=C2\SC(=S)N(C3CCCC3)C2=O)c(C)c(C#N)c1=O,C40066900_decoy,TRY1,Decoy,0,-8.8011,-6.01,-2.49,-5.972660918050005
COc1cc([C@@H]2c3c(-c4ccc(Cl)cc4)n[nH]c3C(=O)N2Cc2cccnc2)ccc1OCCC(C)C,C40343689_decoy,TRY1,Decoy,0,-8.84016,-7.04,-2.98,-7.167828506379196
COCCN(C(=O)Nc1ccccc1C(F)(F)F)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(C)cc1,C40360501_decoy,TRY1,Decoy,0,-6.28082,-6.25,-2.44,-5.387023741752396
COc1ccc([C@H](CNC(=O)c2cnc(SCc3ccc(F)cc3)nc2Cl)N2CCOCC2)cc1,C40985864_decoy,TRY1,Decoy,0,-10.9637,-7.33,-3.08,-7.753670734464375
CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@@]4(C)[C@]3(Cl)[C@@H](O)C[C@]21C,C43743746_decoy,TRY1,Decoy,0,-7.31533,-6.26,-3.2,-5.783064109176423
Cc1ccc(/C=C2\SC(=S)N(CCCC(=O)Nc3nonc3-c3ccc4c(c3)CCCC4)C2=O)cc1,C47133701_decoy,TRY1,Decoy,0,-9.71514,-7.74,-3.23,-6.590493347938898
C=CCn1c(SCC(=O)Nc2c(Br)cc(Br)cc2Br)nnc1-c1ccccn1,C01283253_decoy,TRY1,Decoy,0,-10.2448,-6.39,-1.55,-6.324749611455369
Cc1cc2oc(=O)cc(COC(=O)CNS(=O)(=O)c3c(F)cc(F)cc3Br)c2cc1C(C)C,C03427957_decoy,TRY1,Decoy,0,-9.56022,-7.29,-3.44,-6.92406438598997
CCOc1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)/C(=N/c3ccc(Cl)cc3)S2)cc1,C34887988_decoy,TRY1,Decoy,0,-9.25819,-5.86,-1.19,-6.125526178657695
CCOc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)/C(=N/c3ccc(Cl)cc3)S2)c1,C33732744_decoy,TRY1,Decoy,0,-10.0244,-7.56,-1.24,-7.266570164596391
Cc1oc(-c2ccc(Cl)cc2)nc1CSCC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1,C63481294_decoy,TRY1,Decoy,0,-8.90781,-8.35,-3.54,-7.146253929594908
C[C@@H](CC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)CC1=NS(=O)(=O)c2ccccc2N1,C32961390_decoy,TRY1,Decoy,0,-7.69958,-8.3,-4.35,-6.680495416488113
CC(=O)Nc1cccc(N(C(=O)[C@H]2COc3ccccc3O2)[C@H](C(=O)NC2CCCCC2)c2cccs2)c1,C00930995_decoy,TRY1,Decoy,0,-8.30613,-7.13,-2.93,-6.036927530148143
C=CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@]2(C)Cc3sc(NS(=O)(=O)c4cccc5cccnc45)nc3[C@@H](C)[C@@H]2[C@H]1O,C04149989_decoy,TRY1,Decoy,0,-10.125,-8.39,-1.78,-7.658832552924177
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCCc2ccc(F)cc2)S(=O)(=O)c2ccc(F)cc2)cc1,C09080714_decoy,TRY1,Decoy,0,-9.05391,-7.67,-2.24,-6.628978617569183
CCOc1cc(/C=N/NC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)cc(Br)c1OC(C)C,C10001274_decoy,TRY1,Decoy,0,-9.38348,-6.17,-2.25,-6.118324384027652
CCOc1cc(/C=N/NC(=O)[C@H](NC(=O)c2ccc(F)cc2)C(C)C)cc(Br)c1OC(C)C,C10002052_decoy,TRY1,Decoy,0,-9.61828,-5.23,-2.58,-7.229426453208068
COc1cc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@@H]3c2cccc(OC)c2OC)cc(OC)c1OC,C09805244_decoy,TRY1,Decoy,0,-8.47725,-5.58,-2.64,-5.509338437835905
Cc1cccc(CCN(Cc2cc3cc4c(cc3[nH]c2=O)OCCO4)C(=S)Nc2cccc(Cl)c2)c1,C00891494_decoy,TRY1,Decoy,0,-10.4945,-8.04,-2.1,-7.0546668968751725
Cc1ccc([C@H](C(=O)NCc2ccco2)N(C(=O)CNC(=O)c2cccs2)c2ccc3c(c2)CCC3)cc1,C12485546_decoy,TRY1,Decoy,0,-9.03277,-8.23,-2.27,-6.767963627877636
CCC(C)(C)NC(=O)[C@@H](c1cccc(OC)c1)N(C(=O)CNC(=O)c1cccs1)c1cc(C)cc(C)c1,C12488462_decoy,TRY1,Decoy,0,-9.19251,-6.41,-4.03,-7.847593542618294
O=C(NC[C@@H]1CCCO1)[C@@H](c1ccc(F)cc1)N(Cc1cccs1)C(=O)c1ccc(-c2ccccc2)[nH]1,C00885776_decoy,TRY1,Decoy,0,-7.79323,-6.82,-1.96,-7.393102003996249
Cc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)CCCC(=O)Nc2ccccn2)c2cccc(C)c2)cc1,C13027405_decoy,TRY1,Decoy,0,-8.93654,-8.11,-2.09,-7.296750204332713
O=C(CCC(=O)Nc1nc(-c2cc3cc(Br)ccc3oc2=O)cs1)NCc1ccccn1,C02956338_decoy,TRY1,Decoy,0,-9.95699,-8.82,-3.33,-7.075282278332718
CCOc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccccc3C(F)(F)F)C2=O)ccc1O,C15039624_decoy,TRY1,Decoy,0,-8.71649,-7.13,-5.44,-7.025169750537423
COCCCNC(=O)c1ccccc1N1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccccc3C)N2C1=O,C15959968_decoy,TRY1,Decoy,0,-7.59721,-7.1,-2.11,-5.60538338365167
CCOc1cc([C@H]2C(C(=O)OCCOC)=C(C)NC3=C2C(=O)C[C@@H](c2ccc(Cl)cc2)C3)ccc1O,C08425428_decoy,TRY1,Decoy,0,-8.50874,-7.37,-2.12,-7.910680536712566
Cc1ccc(NC(=O)C[S@@+]([O-])CC(=O)N(CC(=O)NC2CCCCC2)c2ccc(F)c(Cl)c2)cc1,C20097813_decoy,TRY1,Decoy,0,-9.0568,-8.84,-3.12,-7.815119364135439
COc1cc(CNCCc2ccccc2F)cc(Br)c1OC[C@H](O)c1ccc2c(c1)OCO2,C20877046_decoy,TRY1,Decoy,0,-9.14738,-8.16,-2.79,-7.816718287315589
COc1ccc([C@@H]2Nc3ccccc3NC3=C2C(=O)C[C@H](c2cc(OC)c(OC)c(OC)c2)C3)c(OC)c1,C21238462_decoy,TRY1,Decoy,0,-8.63374,-5.63,-3.52,-5.515078117531234
COc1ccc(CCNC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCN(c3ccc(F)cc3)CC2)cc1,C22418849_decoy,TRY1,Decoy,0,-10.5559,-6.41,-2.86,-6.483347432612928
COc1cc([C@@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCC[NH+](C)C)cc(Br)c1O,C26532756_decoy,TRY1,Decoy,0,-9.14293,-6.24,-1.75,-6.84121318270009
Cc1c(CN(C)C[C@H](O)c2cccnn2)sc2c(=O)c(C(=O)NCc3ccc(Cl)cc3)cn(C)c12,C28822544_decoy,TRY1,Decoy,0,-9.5872,-7.95,-3.29,-6.742327542627905
O=C(CN1C(C(=O)c2ccccc2)=C(NCCO)c2ccccc2S1(=O)=O)c1ccc(Br)cc1,C01836432_decoy,TRY1,Decoy,0,-7.98197,-7.15,-1.19,-7.1976458270873005
CCOc1c(Br)cc(/C=N\NC(=O)[C@@H](NC(=O)c2ccccc2Cl)C(C)C)cc1OC,C30961986_decoy,TRY1,Decoy,0,-8.94488,-7.46,-3.32,-7.999280544005001
O=S(=O)(c1ccc(NC(=S)N/N=C2\C[C@H](c3ccccc3)Oc3ccccc32)cc1)N1CCOCC1,C32666542_decoy,TRY1,Decoy,0,-7.70917,-6.69,-1.56,-5.29794405580081
C=CCN1C(=O)N[C@@H](c2ccccc2C(F)(F)F)C2=C1CN([C@@H](C(=O)NC(C)(C)C)c1ccccc1)C2=O,C34791503_decoy,TRY1,Decoy,0,-8.28606,-7.38,-3.69,-7.720572190753648
C#CCNC(=O)[C@H](Cc1ccccc1)N1CC2=C(C1=O)[C@@H](c1ccccc1C(F)(F)F)NC(=O)N2CC=C,C34791933_decoy,TRY1,Decoy,0,-7.29744,-7.63,-1.86,-6.836761446457253
Cc1ccccc1CN1C(=O)O[C@H](c2ccc(NC(=O)c3cccs3)cc2)[C@@H]1C(=O)NCc1ccco1,C36150453_decoy,TRY1,Decoy,0,-9.50216,-5.49,-2.91,-5.778594174958674
Cc1ccc(CN2C(=O)O[C@H](c3ccc(NC(=O)c4ccco4)cc3)[C@H]2C(=O)Nc2ccc(F)cc2)cc1,C36216561_decoy,TRY1,Decoy,0,-7.88315,-9.28,-1.85,-7.860981319449513
COc1cc([C@@H](C(=O)NC(C)(C)C)N(Cc2ccco2)C(=O)Cc2cccc(Cl)c2Cl)ccc1O,C36501071_decoy,TRY1,Decoy,0,-8.51245,-6.2,-1.6,-6.199342738409859
CCCCNC(=O)[C@@H](c1ccc(C)cc1C)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502210_decoy,TRY1,Decoy,0,-7.49021,-5.95,-3.08,-5.779569085632042
Cc1ccccc1[C@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502217_decoy,TRY1,Decoy,0,-6.61444,-6.73,-3.57,-8.520545442177117
CCCCNC(=O)[C@@H](c1ccco1)N(C(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1Cl,C36546461_decoy,TRY1,Decoy,0,-7.5853,-5.99,-2.73,-5.926507110917276
CCCC(=O)N(c1ccccc1Cl)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(O)cc1,C36547011_decoy,TRY1,Decoy,0,-7.65287,-8.25,-2.44,-6.837448326139686
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc(O)cc2)N(C(=O)CCl)c2ccccc2Cl)cc1,C36547300_decoy,TRY1,Decoy,0,-9.03579,-8.84,-4.55,-9.641904447156431
CN(C)c1ccc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(C(=O)[C@@H]2CCC(=O)N2)c2ccccc2Cl)cc1,C36548546_decoy,TRY1,Decoy,0,-8.69219,-7.27,-4.79,-7.75612103304096
Cc1ccc(CN(C(=O)C(c2ccccc2)c2ccccc2)[C@@H](C(=O)NC(C)(C)C)c2ccc(O)cc2)o1,C36600193_decoy,TRY1,Decoy,0,-7.46247,-5.9,-1.22,-5.708372794939774
CCN(CC)[P@](=O)(Nc1ccccc1Br)c1ccc(N(C)C)cc1NC(=O)c1ccco1,C03190505_decoy,TRY1,Decoy,0,-7.18778,-6.01,-3.29,-7.131077147571885
O=C(NC[C@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2F)CC1)C(=O)Nc1ccccc1Cl,C38621146_decoy,TRY1,Decoy,0,-10.2432,-7.06,-1.1,-6.727507929109502
CN1C(SCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccc(F)cc2)=NN[C@@H]1c1cccc(Br)c1,C38999049_decoy,TRY1,Decoy,0,-9.90276,-5.4,-2.03,-6.489962210548833
CN(C)c1ccc([C@H]2Nc3ccccc3C(=O)N2NC(=O)CCCOc2ccc(Cl)cc2Cl)cc1,C39920103_decoy,TRY1,Decoy,0,-9.58384,-7.5,-2.33,-8.170649454806425
N#C/C(=C\c1ccc(-c2ccc(F)cc2)o1)C(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2,C39992795_decoy,TRY1,Decoy,0,-9.93835,-9.04,-1.97,-8.393091961103796
COc1cc([C@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2Cc2ccc(C)cc2)cc(OC)c1OC,C39912363_decoy,TRY1,Decoy,0,-7.67079,-6.1,-1.94,-5.977232661301478
COc1cc([C@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2Cc2ccc(F)cc2)cc(OC)c1OC,C39912492_decoy,TRY1,Decoy,0,-8.29456,-6.76,-1.24,-6.552146193093882
COc1cccc(/C=N/NC(=O)CSc2nc3sc4c(c3c(=O)n2-c2ccc(C)cc2)CCCC4)c1O,C01898724_decoy,TRY1,Decoy,0,-8.64442,-9.38,-2.99,-7.42494965692167
C=CCn1c(CNc2ccc(I)cc2)nnc1S[C@@H](C)C(=O)N/N=C/C(C)C,C59261425_decoy,TRY1,Decoy,0,-8.98423,-5.31,-3.05,-5.998189792536646
CC(C)c1ccc(O[C@H](C)C(=O)NNC(=O)COc2ccc(Br)cc2Br)cc1,C14040252_decoy,TRY1,Decoy,0,-8.66859,-7.91,-2.29,-6.559872053965286
CCOc1cccc([C@@H]2CC(c3cccc(OC)c3)=N[C@@H](c3ccc(OC)c(Br)c3)N2)c1O,C53364193_decoy,TRY1,Decoy,0,-11.306,-6.86,-2.18,-8.997447813717477
Cc1c(CC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c(=O)oc2c(C)c3occ(C(C)(C)C)c3cc12,C63362691_decoy,TRY1,Decoy,0,-7.79873,-9.43,-2.21,-6.391030138470338
CCOc1cc([C@@H]2[C@H]3C(=NN=C3c3cc(Cl)c(C)cc3O)C(=O)N2Cc2ccc(OC)cc2)ccc1O,C08845177_decoy,TRY1,Decoy,0,-8.31508,-6.31,-1.49,-6.0931610177058
COc1ccc(CCN2C(=O)C3=NN=C(c4cc(Cl)c(C)cc4O)[C@H]3[C@@H]2c2ccc(O)c(OC)c2)cc1,C09124009_decoy,TRY1,Decoy,0,-8.70579,-6.26,-3.7,-6.227222289853827
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C04349400_decoy,TRY1,Decoy,0,-9.82704,-6.64,-2.0,-6.324939578763814
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C04349406_decoy,TRY1,Decoy,0,-9.11279,-7.22,-4.97,-5.938701242393357
O=C(OC[C@H]1O[C@@H](O)[C@@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O)c1cc(O)c(O)c(O)c1,C04887562_decoy,TRY1,Decoy,0,-8.61274,-8.69,-2.63,-8.92756876599898
Cc1cc(N[C@@H]2O[C@H]([C@@H](O)CO)[C@H](O)[C@H]2O)c(N[C@H]2O[C@@H]([C@@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C12654617_decoy,TRY1,Decoy,0,-7.1143,-6.03,-2.03,-6.639492213693032
O=C(OC[C@@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1,C13458830_decoy,TRY1,Decoy,0,-9.15222,-9.9,-2.58,-8.39115756137799
O=C(OC[C@@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1,C13458835_decoy,TRY1,Decoy,0,-10.4598,-9.16,-3.11,-9.24169822348386
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1O,C14854899_decoy,TRY1,Decoy,0,-8.40432,-8.51,-3.69,-7.407025061954992
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1,C15043210_decoy,TRY1,Decoy,0,-9.32725,-9.97,-4.0,-8.075191124523258
Cc1cc(N[C@@H]2O[C@@H]([C@@H](O)CO)[C@@H](O)[C@@H]2O)c(N[C@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)cc1C,C15885478_decoy,TRY1,Decoy,0,-7.2275,-8.59,-2.71,-8.117534331098506
O=C(OC[C@H]1O[C@@H](O)[C@@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1O)c1cc(O)c(O)c(O)c1,C04887566_decoy,TRY1,Decoy,0,-8.76517,-10.19,-3.26,-7.643134038043942
O=C(N/N=C/[C@H](O)[C@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33722733_decoy,TRY1,Decoy,0,-8.22269,-7.74,-2.59,-7.54597836135428
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@H]1O,C35454588_decoy,TRY1,Decoy,0,-8.08084,-8.28,-2.52,-6.650565235737713
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35454599_decoy,TRY1,Decoy,0,-8.01584,-7.77,-3.86,-6.237282609318027
O=C(N/N=C/[C@@H](O)[C@@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33957488_decoy,TRY1,Decoy,0,-7.49107,-7.47,-2.82,-8.993216913572766
Nc1ccc(C(=O)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C37262699_decoy,TRY1,Decoy,0,-5.99253,-7.9,-3.76,-6.460931639927352
Nc1ccc(C(=O)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C37262704_decoy,TRY1,Decoy,0,-7.52993,-8.83,-2.97,-9.034694994745296
N[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)NCCCCCCNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1[NH3+],C37530468_decoy,TRY1,Decoy,0,-9.41177,-7.08,-3.12,-9.154351333294493
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1,C04096316_decoy,TRY1,Decoy,0,-9.09863,-9.72,-3.9,-9.142960678718556
OC[C@@H]1O[C@H](OC[C@@H]2O[C@@H]([NH2+]CCc3ccc(O)cc3)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C36378613_decoy,TRY1,Decoy,0,-6.70062,-8.17,-0.83,-6.471703627982744
Cc1cc(N[C@@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)c(N[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C08740336_decoy,TRY1,Decoy,0,-6.80575,-8.45,-3.75,-7.844336594098632
[NH3+][C@@H](Cc1ccc(O)c[nH+]1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C48999383_decoy,TRY1,Decoy,0,-5.24495,-8.71,-3.59,-5.790069861021799
[NH3+][C@@H](Cc1ccc(O)c[nH+]1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C48999385_decoy,TRY1,Decoy,0,-7.91834,-7.77,-1.87,-7.096139513190417
O=C(OC[C@@H]1O[C@@H](O)[C@@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1O)c1cc(O)c(O)c(O)c1,C04887568_decoy,TRY1,Decoy,0,-9.64539,-9.92,-2.9,-7.705559850146468
OC[C@@H]1O[C@@H](Nc2ccc(-c3ccc(N[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)cc3)cc2)[C@@H](O)[C@H](O)[C@@H]1O,C13477277_decoy,TRY1,Decoy,0,-6.4131,-8.47,-3.06,-5.145334743699148
CSCC[C@@H](N)/C(O)=N/S(=O)(=O)OC[C@H]1O[C@@H](N2C=[NH+]C3=C(N)NC=[NH+][C@@H]32)[C@@H](O)[C@H]1O,C38664792_decoy,TRY1,Decoy,0,-12.0878,-7.24,-2.31,-8.89310545609853
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C04349397_decoy,TRY1,Decoy,0,-7.89476,-9.52,-1.79,-8.340871405491205
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C04349402_decoy,TRY1,Decoy,0,-8.61268,-10.49,-4.1,-9.204771241814466
Nc1ccc(C(=O)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C12296280_decoy,TRY1,Decoy,0,-6.58983,-8.11,-4.51,-7.810510036960287
Cc1cc(N[C@@H]2O[C@H]([C@@H](O)CO)[C@H](O)[C@H]2O)c(N[C@@H]2O[C@@H]([C@@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C12654614_decoy,TRY1,Decoy,0,-7.36628,-6.45,-2.29,-7.47892966772252
Cc1cc(N[C@@H]2O[C@H]([C@@H](O)CO)[C@H](O)[C@H]2O)c(N[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C12654625_decoy,TRY1,Decoy,0,-5.85734,-6.42,-2.89,-6.475691002267242
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1,C13458828_decoy,TRY1,Decoy,0,-8.42743,-10.15,-4.36,-7.996146832972674
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1,C13458833_decoy,TRY1,Decoy,0,-8.93607,-9.86,-4.3,-8.088614690744532
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1,C13525080_decoy,TRY1,Decoy,0,-8.05522,-9.7,-3.9,-8.419688657091339
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1O,C14854896_decoy,TRY1,Decoy,0,-9.96553,-8.08,-1.94,-8.674078865800231
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@@H](O)[C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1O,C14854905_decoy,TRY1,Decoy,0,-9.55332,-7.07,-2.93,-8.546109276989045
O=C(OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1,C15043216_decoy,TRY1,Decoy,0,-7.94297,-10.02,-3.71,-7.95027153954917
O=C(OC[C@@H]1O[C@H](O)[C@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O)c1cc(O)c(O)c(O)c1,C15657785_decoy,TRY1,Decoy,0,-8.65994,-9.21,-2.55,-7.791568655545871
Cc1cc(N[C@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)c(N[C@H]2O[C@@H]([C@@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C35360982_decoy,TRY1,Decoy,0,-5.64509,-8.45,-3.89,-6.807832846732504
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35454596_decoy,TRY1,Decoy,0,-9.18326,-7.3,-4.06,-8.831919439061236
O=C(N/N=C/[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33957487_decoy,TRY1,Decoy,0,-6.95377,-7.39,-2.72,-9.060509603933928
Nc1ccc(C(=O)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C37262702_decoy,TRY1,Decoy,0,-6.88775,-8.1,-2.66,-8.16817445506144
N[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NCCCCCCNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1[NH3+],C37530466_decoy,TRY1,Decoy,0,-10.1207,-5.32,-3.46,-7.423541784891419
OC[C@@H]1O[C@H](OC[C@@H]2O[C@H]([NH2+]CCc3ccc(O)cc3)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C36378614_decoy,TRY1,Decoy,0,-6.74341,-8.18,-2.61,-6.051112930848475
CC(C)C[C@@H](NC(=O)NCC(=O)N[C@@](CCC(N)=O)(C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1)C(=O)[O-],C38655106_decoy,TRY1,Decoy,0,-11.0667,-7.3,-3.32,-9.43029020711274
OC[C@@H]1O[C@@H](Nc2ccc(-c3ccc(N[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3)cc2)[C@H](O)[C@H](O)[C@@H]1O,C04005691_decoy,TRY1,Decoy,0,-7.1287,-8.27,-3.02,-6.1996618667222805
Nc1ccc(SC[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)nc1,C48999956_decoy,TRY1,Decoy,0,-7.63544,-6.92,-2.78,-7.042921856818015
Cc1cc(N[C@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)c(N[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C08740335_decoy,TRY1,Decoy,0,-6.18363,-7.86,-1.09,-7.896656886004223
O=C(OC[C@@H]1O[C@@H](O)[C@@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O)c1cc(O)c(O)c(O)c1,C04887564_decoy,TRY1,Decoy,0,-9.15552,-9.96,-4.93,-8.55814316507506
CC[NH2+][C@@H]1C[C@H]([NH3+])[C@@H](O[C@H]2OC(C[NH3+])=CC[C@H]2N)[C@H](O)[C@H]1O[C@H]1OC[C@](C)(O)[C@H]([NH2+]C)[C@H]1O,C52981502_decoy,TRY1,Decoy,0,-7.99259,-7.19,-3.02,-8.074601528792329
CSCC[C@H](N)/C(O)=N/S(=O)(=O)OC[C@H]1O[C@@H](N2C=[NH+]C3=C(N)NC=[NH+][C@@H]32)[C@@H](O)[C@H]1O,C38664791_decoy,TRY1,Decoy,0,-9.93348,-7.34,-1.95,-10.30427447313455
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@@H](O)[C@@H]1O,C04098728_decoy,TRY1,Decoy,0,-10.0325,-8.85,-2.49,-8.062483719919957
CSc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)cc1,C02446790_decoy,TRY1,Decoy,0,-10.2896,-7.81,-1.33,-7.652495704554934
CCn1c(=O)c(Sc2c(N)n(CC[NH+](C)C)c(=O)n(CC)c2=O)c(N)n(CC[NH+](C)C)c1=O,C01696382_decoy,TRY1,Decoy,0,-8.17356,-4.64,-2.71,-6.594764260227779
CN(C)NP1(NN(C)C)=NP(NN(C)C)(NN(C)C)=NP(NN(C)C)(NN(C)C)=N1,C04783445_decoy,TRY1,Decoy,0,-4.65216,-3.73,-2.17,-3.725819020709836
O=C(/C=C\c1ccc(O)c(O)c1)OC1[C@H](O)CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H]1O,C04918969_decoy,TRY1,Decoy,0,-8.99773,-9.63,-1.97,-7.330102437177798
OC[C@@H](O)CNc1nc(N2CCCCC2)nc2c(NC[C@H](O)CO)nc(N3CCCCC3)nc12,C05605987_decoy,TRY1,Decoy,0,-8.67803,-6.4,-1.37,-7.17943732865447
OC[C@H](O)CNc1nc(N2CCCCC2)nc2c(NC[C@@H](O)CO)nc(N3CCCCC3)nc12,C05605997_decoy,TRY1,Decoy,0,-7.89924,-7.57,-3.21,-7.436231092451271
NC(=O)COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2)cc1,C02202452_decoy,TRY1,Decoy,0,-9.62485,-8.78,-1.74,-10.357813577815955
CC(=O)N(C[C@H]1O[C@@H](CC(=O)NC(C)C)[C@H](O)[C@@H]1O)C[C@H]1O[C@@H](CC(=O)NC(C)C)[C@H](O)[C@@H]1O,C08643765_decoy,TRY1,Decoy,0,-6.63539,-5.7,-3.86,-5.764576873641998
CCOc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)cc1,C02447423_decoy,TRY1,Decoy,0,-9.34781,-8.1,-3.5,-7.863153503145891
COc1ccccc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1CNc1ccccc1C(N)=O,C09108614_decoy,TRY1,Decoy,0,-8.90387,-7.87,-3.55,-8.07384217290801
COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)cc1,C09307872_decoy,TRY1,Decoy,0,-9.28265,-7.83,-3.31,-7.260584314061178
[NH3+]CCCCCCO[P@](=O)([O-])O[P@](=O)([O-])OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@@H]1O,C12502471_decoy,TRY1,Decoy,0,-7.15363,-6.95,-3.57,-6.488294873255976
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H](O)[C@@H]1O,C13451121_decoy,TRY1,Decoy,0,-9.00005,-9.96,-2.6,-7.522153943203403
O=C(/C=C/c1ccc(O)c(O)c1)OC1[C@@H](O)CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@@H]1O,C13597260_decoy,TRY1,Decoy,0,-10.0158,-8.97,-2.39,-7.930224774633431
O=C(CN(CC(=O)NCCO)C(=O)CCC(=O)N(CC(=O)NCCO)CC(=O)NCCO)NCCO,C13756556_decoy,TRY1,Decoy,0,-7.71421,-6.86,-3.5,-7.794169211749415
CC(/C=N/NC(=O)c1nnn(-c2nonc2N)c1CNc1ccccc1C(N)=O)=C\c1ccco1,C13788351_decoy,TRY1,Decoy,0,-8.8823,-7.62,-3.44,-7.157140539134172
COc1cc(C[C@@H]2CO[C@H](c3ccc(O)c(OC)c3)[C@@H]2CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O,C14642094_decoy,TRY1,Decoy,0,-9.25547,-6.93,-3.19,-6.553349012881814
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1OCC(=O)N/N=C/c1c(O)[nH]c(=O)[nH]c1=O,C16682512_decoy,TRY1,Decoy,0,-8.60916,-7.29,-2.04,-6.905381500154224
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccccc1OCC(=O)N/N=C/c1c(O)[nH]c(=O)[nH]c1=O,C16682513_decoy,TRY1,Decoy,0,-8.89963,-8.69,-1.91,-8.36097891810951
Nc1nc2[nH]c(SCC(=O)NCCCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc2c(=O)[nH]1,C20435728_decoy,TRY1,Decoy,0,-7.82395,-8.08,-2.14,-6.587435754797206
CC(C)(CO)[C@H](O)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)CO,C03874606_decoy,TRY1,Decoy,0,-10.8537,-5.92,-3.23,-7.311328446591008
CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C31164431_decoy,TRY1,Decoy,0,-7.67933,-7.54,-3.5,-8.719197218640288
CC(=C\C(=O)[O-])/C=C(\C)C[C@H](C)CCCC[C@@H](O)[C@@H](CO)C(=O)OC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O,C31166280_decoy,TRY1,Decoy,0,-7.71298,-6.45,-4.23,-6.305648013208871
OC[C@@H](O)CNc1nc(N2CCCCC2)nc2c(NC[C@@H](O)CO)nc(N3CCCCC3)nc12,C17173236_decoy,TRY1,Decoy,0,-8.86563,-6.2,-1.46,-7.387434667751124
O=C(OC[C@H]1O[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C34798817_decoy,TRY1,Decoy,0,-6.33603,-7.17,-3.13,-6.30411214286097
COc1cc(C[C@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C35464812_decoy,TRY1,Decoy,0,-9.13914,-7.58,-3.67,-8.413533147278068
O=C(OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C36367369_decoy,TRY1,Decoy,0,-7.3303,-7.37,-2.03,-5.955156432359274
OCCN(CCO)c1nc(N2CCC[C@H](O)C2)c2nc(N(CCO)CCO)nc(N3CCC[C@@H](O)C3)c2n1,C13583303_decoy,TRY1,Decoy,0,-11.775,-5.34,-1.53,-7.95744727374882
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)C[C@](O)(C(=O)[O-])C[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1,C13556374_decoy,TRY1,Decoy,0,-11.543,-8.57,-3.89,-8.364242086188728
O=C(/C=C/c1ccc(O)c(O)c1)OC1[C@H](O)CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H]1O,C13597248_decoy,TRY1,Decoy,0,-9.57176,-9.9,-3.95,-7.732416844397845
COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C31155075_decoy,TRY1,Decoy,0,-6.24185,-6.95,-1.99,-6.061220793866558
CC(=C\C(=O)[O-])/C=C(\C)C[C@H](C)CCCC[C@H](O)[C@@H](CO)C(=O)OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1O,C35464019_decoy,TRY1,Decoy,0,-6.66628,-6.82,-4.34,-5.71376182199815
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@H](O)C[C@@](O)(C(=O)[O-])C[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1,C04098735_decoy,TRY1,Decoy,0,-10.9914,-10.07,-4.1,-10.380186412819318
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1N,C12474123_decoy,TRY1,Decoy,0,-8.55709,-6.93,-2.43,-7.9798672668868225
O=C(/C=C/c1ccc(O)c(O)c1)OC1[C@H](O)CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@@H]1O,C18256410_decoy,TRY1,Decoy,0,-12.597,-9.86,-2.47,-9.626463500881906
Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2CO[P@](=O)([O-])O[C@H]2[C@H]1OC(=O)NCCCCCC[NH3+],C38580941_decoy,TRY1,Decoy,0,-7.02507,-7.88,-1.78,-6.945475919824721
CC(C)C[C@H](NC(=O)N[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1)C(=O)[O-],C13507123_decoy,TRY1,Decoy,0,-11.0816,-6.31,-0.76,-12.215813169744466
CC(C)C[C@H](NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@H]1CC[NH+]=C(N)N1)C(=O)[O-],C34778526_decoy,TRY1,Decoy,0,-10.4602,-7.26,-1.72,-9.15576535586374
O=c1[nH]c(N/N=C/C(=N\Nc2nc(=O)c3ccccc3[nH]2)[C@H](O)[C@H](O)[C@H](O)CO)nc2ccccc12,C16958980_decoy,TRY1,Decoy,0,-8.30188,-8.52,-2.48,-8.638086047036273
CC(C)C[C@@H](NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1)C(=O)[O-],C15149858_decoy,TRY1,Decoy,0,-10.7544,-6.61,-2.77,-8.492033556332874
CC(C)C[C@@H](NC(=O)N[C@@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1)C(=O)[O-],C13507122_decoy,TRY1,Decoy,0,-9.38267,-6.86,-2.62,-8.375296995075544
Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1OC(=O)NCCCCCC[NH3+],C42854029_decoy,TRY1,Decoy,0,-8.05364,-7.88,-2.75,-7.562972873997168
CNC(=O)CCSCCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C44171687_decoy,TRY1,Decoy,0,-6.21467,-4.82,-3.36,-4.588104990137093
O=C(NC[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O)[C@H](O)[C@@H](O)C(=O)OCc1ccc([O-])cn1,C29415771_decoy,TRY1,Decoy,0,-6.81422,-8.41,-3.43,-6.273250480343008
[NH3+][C@@H](CCSC[C@H]1O[C@@H](n2cnc3c(NCc4ccncc4)ncnc32)[C@H](O)[C@@H]1O)C(=O)[O-],C52565891_decoy,TRY1,Decoy,0,-6.25195,-7.16,-1.31,-5.850448828269688
[NH3+][C@H](CCSC[C@H]1O[C@@H](n2cnc3c(NCc4ccncc4)ncnc32)[C@H](O)[C@@H]1O)C(=O)[O-],C52565893_decoy,TRY1,Decoy,0,-8.48974,-7.1,-3.95,-6.495296367568442
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1,C59888353_decoy,TRY1,Decoy,0,-11.4373,-7.93,-2.11,-9.731192130416495
CC[NH+](CC)CCNC(=O)c1cc(Cl)c(N[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)cc1OC,C65747771_decoy,TRY1,Decoy,0,-6.54289,-6.35,-2.06,-5.278668470705815
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@H]1O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O,C03871260_decoy,TRY1,Decoy,0,-8.15967,-7.06,-1.62,-8.05640636295736
O=C(OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O)c1ccc(O)cc1,C03918303_decoy,TRY1,Decoy,0,-6.33612,-5.99,-3.32,-4.321870310027977
O=C(/C=C/c1ccc(O)cc1)OC[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@@H]1O,C04349727_decoy,TRY1,Decoy,0,-10.0412,-9.71,-4.48,-9.169339208877934
CCOc1cc([C@H](O)[C@@H](O)c2cc(C[NH+]3CCOCC3)c(O)c(OCC)c2)cc(C[NH+]2CCOCC2)c1O,C04723015_decoy,TRY1,Decoy,0,-11.2288,-7.67,-3.82,-8.730970278467552
CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06074978_decoy,TRY1,Decoy,0,-7.33306,-4.83,-1.26,-5.555914610551564
CCC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06462044_decoy,TRY1,Decoy,0,-7.3731,-7.88,-4.19,-8.00999550061095
CCOC(=O)CNC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06546733_decoy,TRY1,Decoy,0,-7.66598,-5.92,-2.49,-6.066360382912876
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccccc2C(=O)[O-])nnn1-c1nonc1N,C01872460_decoy,TRY1,Decoy,0,-7.82787,-6.41,-2.55,-6.441513938923132
COc1ccc(OC/C(C)=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C09975239_decoy,TRY1,Decoy,0,-7.12376,-7.79,-2.9,-7.036093283954784
CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1OC,C10004101_decoy,TRY1,Decoy,0,-7.77263,-7.37,-1.28,-6.723024416448908
COc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc(OC)c1OC,C09975281_decoy,TRY1,Decoy,0,-8.06043,-7.44,-2.04,-7.732356652984484
CCCOc1ccccc1/C=N/Nc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C19119319_decoy,TRY1,Decoy,0,-7.51904,-8.75,-1.74,-9.479436648784434
CCCOc1ccccc1/C=N/Nc1nc2c(=O)[nH]c(N)nc2n1[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C19119331_decoy,TRY1,Decoy,0,-7.31546,-8.5,-2.49,-7.428800948166188
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3O)n2)s1,C20832493_decoy,TRY1,Decoy,0,-9.94437,-8.12,-2.04,-7.774398928402676
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12,C21981339_decoy,TRY1,Decoy,0,-6.36535,-6.69,-2.52,-5.199060003857643
[N-]=[N+]=Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22049671_decoy,TRY1,Decoy,0,-7.30775,-7.72,-2.7,-6.175411781721309
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]2O)c2ccccc12,C22061112_decoy,TRY1,Decoy,0,-5.72221,-5.91,-3.86,-4.337192905643206
CC(=C\C(=O)[O-])/C=C(\C)C[C@@H](C)CCCC[C@H](O)[C@@H](CO)C(=O)OC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O,C31166284_decoy,TRY1,Decoy,0,-7.18637,-6.78,-1.71,-7.238926234115209
C[C@@H](O)C[C@@H](O)[C@@H](SC[C@@H](O)C(=O)[O-])[C@@H](O)/C=C/Cc1cc2c(Cl)c(O)cc(O)c2c(=O)o1,C31167448_decoy,TRY1,Decoy,0,-9.86447,-5.83,-3.78,-6.5517864436405775
C[C@H](O)C[C@H](O)[C@@H](SC[C@@H](O)C(=O)[O-])[C@@H](O)/C=C/Cc1cc2c(Cl)c(O)cc(O)c2c(=O)o1,C31167460_decoy,TRY1,Decoy,0,-10.8083,-6.0,-2.46,-6.451712786788242
CCCCC[C@H]1O[C@@H](O)C[C@H]1SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-],C33914464_decoy,TRY1,Decoy,0,-6.74648,-5.53,-2.93,-5.165573456587397
[NH3+]CCCCCCO[P@](=O)([O-])O[P@](=O)([O-])OC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C35340837_decoy,TRY1,Decoy,0,-7.21238,-8.05,-3.85,-7.362369166349837
C[C@@H]([C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@H]1O)[C@H](O)c1ccc([O-])cn1,C35395218_decoy,TRY1,Decoy,0,-6.35532,-7.31,-2.65,-5.40761005341917
C[C@@H]([C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@H]1O)[C@@H](O)c1ccc([O-])cn1,C35395226_decoy,TRY1,Decoy,0,-5.53899,-7.41,-3.93,-5.508774937149029
C[C@H](O)C[C@@H](O)[C@H](SC[C@H](O)C(=O)[O-])[C@H](O)/C=C/Cc1cc2c(Cl)c(O)cc(O)c2c(=O)o1,C35464468_decoy,TRY1,Decoy,0,-11.0448,-6.23,-2.96,-7.518461163321884
[N-]=[N+]=Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C35636391_decoy,TRY1,Decoy,0,-7.34315,-7.54,-4.04,-7.501973515104007
[N-]=[N+]=Nc1ccc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35636397_decoy,TRY1,Decoy,0,-8.31861,-7.35,-2.97,-7.079480365718226
C[C@H]([C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O)[C@@H](O)c1ccc([O-])cn1,C25759517_decoy,TRY1,Decoy,0,-6.85674,-7.15,-1.65,-5.602538145337381
OC[C@@H]1O[C@H](OCCCOCCCO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C37246741_decoy,TRY1,Decoy,0,-4.20735,-4.54,-2.6,-3.8245004221534895
OC[C@H]1CCCOCCCCC[C@@H](O[C@@H]([C@H](O)CO)[C@@H](O)c2cnn(-c3ccccc3)n2)[C@@H](O)[C@@H](O)[C@H]1O,C37263633_decoy,TRY1,Decoy,0,-9.0571,-6.11,-2.71,-5.961323582516817
COc1cc(OC)c(O[C@@H]2O[C@H](COC(=O)c3cc(O)c(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1,C35457158_decoy,TRY1,Decoy,0,-8.37495,-8.28,-2.79,-7.811858034758685
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1CC(O)(C(=O)[O-])C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O,C03919243_decoy,TRY1,Decoy,0,-10.0421,-9.75,-3.93,-9.316516863488651
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCCCNC(=O)/C(C#N)=C\c1ccc(O)c(O)c1,C17259415_decoy,TRY1,Decoy,0,-7.94149,-6.76,-5.51,-6.5417894662592895
CO[C@@H]1[C@@H]2O[P@@](=O)([O-])OC[C@H]2O[C@H]1n1c(NCCCCCC[NH3+])nc2c(N)ncnc21,C38580947_decoy,TRY1,Decoy,0,-7.85768,-6.76,-2.09,-7.435095369213313
[O-][C@H](C(/C=N/NC(=S)Nc1ccccc1)=N/NC(=S)Nc1ccccc1)[C@H](O)[C@H](O)CO,C39949479_decoy1,TRY1,Decoy,0,-9.61999,-6.46,,-7.03815984750166
[O-][C@H](C(/C=N\NC(=S)Nc1ccccc1)=N/NC(=S)Nc1ccccc1)[C@@H](O)[C@H](O)CO,C43224434_decoy,TRY1,Decoy,0,-10.2131,-7.31,-2.94,-7.658247591165495
O=C1CS[C@@H]([C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)N1c1ccc(S(=O)(=O)Nc2ccccn2)cc1,C45321640_decoy,TRY1,Decoy,0,-8.55712,-6.21,-1.52,-5.378962284745275
O=C1CS[C@H]([C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)N1c1ccc(S(=O)(=O)Nc2ccccn2)cc1,C45321643_decoy,TRY1,Decoy,0,-7.52118,-5.72,-2.04,-5.358705584380848
C[C@]12C[C@@H](O)[C@@H]3[C@@H](CCC4=CC(NOCC(=O)N[C@H](Cc5c[nH]c6ccc(O)cc56)C(=O)[O-])=CC[C@]43C)[C@@H]1CC[C@@]2(C)O,C01869223_decoy,TRY1,Decoy,0,-11.4585,-7.54,-1.41,-8.723488208609153
OC[C@H]1O[C@@](CO)(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O,C08214938_decoy,TRY1,Decoy,0,-5.53986,-4.96,-2.61,-4.465834808918998
CCC[NH+](CCC)C[C@H]1[C@@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)NNN1c1nonc1N,C63426950_decoy,TRY1,Decoy,0,-8.72676,-6.51,-1.95,-6.863342919578522
C(=C/c1ccc(-c2cn3cc(/C=C/C=N/NC4=[NH+]CCN4)ccc3n2)cc1)\C=N\[NH+]=C1NCCN1,C27431159_decoy,TRY1,Decoy,0,-10.5745,-7.15,-2.98,-6.009735867370543
CCCCC[C@H](O)[C@@H](CC=O)SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-],C64857675_decoy,TRY1,Decoy,0,-8.86446,-5.45,-5.83,-7.147056508034745
CCCCC[C@H](O)[C@H](CC=O)SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-],C64857680_decoy,TRY1,Decoy,0,-9.41662,-5.44,-2.68,-7.247886268717082
CO[S@@](=O)(=S)CCNC(=O)[C@@H]([NH3+])CCCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21,C33696508_decoy2,TRY1,Decoy,0,-11.6794,-4.61,,-6.385157993537922
OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N(CCO)CCO)c2n1,C65740634_decoy,TRY1,Decoy,0,-10.3679,-5.13,-2.79,-8.507867073524608
C[C@@]1(C(=O)NN)CC=CC=C1C(=S)O/C([O-])=C/C(=O)OC(=S)C1=CC=CC[C@]1(C)C(=O)NN,C66331738_decoy,TRY1,Decoy,0,-10.0924,-6.97,-3.55,-8.686422924473142
C[C@]1(C(=O)NN)CC=CC=C1C(=S)OC(=O)/C=C(\[O-])OC(=S)C1=CC=CC[C@]1(C)C(=O)NN,C66331743_decoy,TRY1,Decoy,0,-10.041,-6.16,-3.46,-7.081661090916402
[O-][C@H](/C(C=NNC(=S)Nc1ccccc1)=N/NC(=S)Nc1ccccc1)[C@H](O)[C@H](O)CO,C39949479_decoy2,TRY1,Decoy,0,-7.79189,-6.46,,-6.517380372462609
COC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1NC(C)=O,C04537010_decoy,TRY1,Decoy,0,-6.74802,-4.01,-3.37,-4.768130921498814
COC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1NC(C)=O,C04537016_decoy,TRY1,Decoy,0,-7.29528,-5.07,-3.55,-5.878289395983279
COC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O,C04537020_decoy,TRY1,Decoy,0,-7.01402,-5.1,-3.42,-5.408320705849921
COC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H]1NC(C)=O,C04537028_decoy,TRY1,Decoy,0,-6.34664,-5.5,-3.34,-5.446768551798271
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1,C06004475_decoy,TRY1,Decoy,0,-8.80436,-8.27,-4.8,-7.92349378046303
C/C(COc1ccccc1C(N)=O)=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975261_decoy,TRY1,Decoy,0,-8.65841,-8.0,-2.97,-7.854481517596322
C/C(COc1ccccc1C(N)=O)=N/Nc1nc2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975263_decoy,TRY1,Decoy,0,-8.14316,-7.83,-2.74,-8.222848134349395
O=C(OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C12652822_decoy,TRY1,Decoy,0,-5.61461,-7.62,-3.15,-5.425896932748759
O=C(OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C12652837_decoy,TRY1,Decoy,0,-5.81368,-7.88,-3.67,-6.203113071704903
O=C(OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)c1ccc(Cl)cc1Cl,C12661064_decoy,TRY1,Decoy,0,-9.47679,-7.67,-3.35,-8.30228148979533
COc1cc(C[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](CO)Cc2ccc(O)c(OC)c2)ccc1O,C14694401_decoy,TRY1,Decoy,0,-8.1321,-7.14,-2.92,-7.2945401399917635
COc1cc([C@H](CO)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2ccc(O)c(OC)c2)ccc1O,C14860159_decoy,TRY1,Decoy,0,-8.03982,-7.05,-3.63,-6.016664735792595
COc1cc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc(OC)c1OC,C16512203_decoy,TRY1,Decoy,0,-7.42161,-9.3,-2.7,-8.297661717572442
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1[N+](=O)[O-],C16678658_decoy,TRY1,Decoy,0,-8.08032,-7.98,-2.78,-8.260876396381613
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1[N+](=O)[O-],C16678660_decoy,TRY1,Decoy,0,-6.87533,-7.88,-2.97,-7.8865420667541715
CO[C@@H]1C[C@@H](O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c2c(cc3cc(C)oc(=O)c3c2O)OC1=O,C31156215_decoy,TRY1,Decoy,0,-9.19317,-6.27,-2.11,-7.177289185271
CO[C@H]1C[C@@H](O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c2c(cc3cc(C)oc(=O)c3c2O)OC1=O,C31156220_decoy,TRY1,Decoy,0,-10.0197,-8.46,-1.22,-9.06180865646806
CO[C@H]1C[C@H](O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c2c(cc3cc(C)oc(=O)c3c2O)OC1=O,C31156228_decoy,TRY1,Decoy,0,-8.97216,-7.48,-3.44,-6.896424691134466
CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C[C@@H](O)[C@@](O)(CO)[C@@H]12,C31158060_decoy,TRY1,Decoy,0,-8.74541,-6.39,-2.53,-5.853132556379661
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C31163225_decoy,TRY1,Decoy,0,-8.52433,-9.09,-3.12,-7.242360570937792
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33745447_decoy,TRY1,Decoy,0,-7.50678,-5.96,-3.88,-5.260777773605003
O=C(OC[C@@H]1O[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])cc1,C34798818_decoy,TRY1,Decoy,0,-4.74661,-6.29,-2.73,-4.517343463734033
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C35169074_decoy,TRY1,Decoy,0,-7.20967,-5.63,-3.12,-6.366573076808191
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1[N+](=O)[O-],C35183224_decoy,TRY1,Decoy,0,-7.75669,-8.0,-2.28,-8.041189013571959
COc1cc([C@@H](CO)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2ccc(O)c(OC)c2)ccc1O,C35271359_decoy,TRY1,Decoy,0,-7.85279,-6.67,-2.6,-6.967264742976667
C[NH+](CCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)CCCNc1ccc(NN[NH-])cc1[N+](=O)[O-],C35395325_decoy,TRY1,Decoy,0,-8.93232,-7.9,-3.15,-7.462968470471882
CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C[C@H](O)[C@](O)(CO)[C@H]12,C35455784_decoy,TRY1,Decoy,0,-7.46828,-7.36,-1.35,-7.0320842294344486
O=C(/C=C/c1ccc(O)cc1)OC[C@@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C35458220_decoy,TRY1,Decoy,0,-9.1551,-10.15,-3.08,-8.952925509501444
C[C@H]([C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O)[C@H](O)c1ccc([O-])cn1,C33973645_decoy,TRY1,Decoy,0,-6.20789,-7.22,-1.41,-5.495384265057192
N[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NCCCCCCNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1[NH3+],C37530472_decoy,TRY1,Decoy,0,-9.89903,-6.69,-2.03,-6.324236575189793
CO[C@H]1C[C@H](O[C@H](O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c2c(cc3cc(C)oc(=O)c3c2O)OC1=O,C35455036_decoy,TRY1,Decoy,0,-8.05223,-5.72,-1.21,-5.408586565185833
N#C[C@H](CC(=O)/C=N/NC(N)=O)SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-],C38534766_decoy,TRY1,Decoy,0,-8.34191,-7.0,-3.84,-8.16358083999639
N#C[C@@H](CC(=O)/C=N/NC(N)=O)SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-],C38534767_decoy,TRY1,Decoy,0,-7.97745,-6.17,-4.01,-6.814717557312269
Nc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2OC(=O)NCCCCCC[NH3+])c(=O)[nH]1,C38580942_decoy,TRY1,Decoy,0,-7.76829,-7.69,-2.92,-8.524063868138965
[NH3+][C@@H](C[C@@H](O)c1ccc([O-])cn1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@H]1O,C40662631_decoy,TRY1,Decoy,0,-7.13838,-6.19,-2.36,-5.390028733097513
[NH3+][C@@H](C[C@H](O)c1ccc([O-])cn1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@H]1O,C40662634_decoy,TRY1,Decoy,0,-4.84291,-8.4,-2.18,-5.705575323785999
[NH3+][C@H](C[C@@H](O)c1ccc([O-])cn1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@H]1O,C40662637_decoy,TRY1,Decoy,0,-5.17219,-7.52,-2.94,-5.127154156973794
[NH3+][C@H](C[C@H](O)c1ccc([O-])cn1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2cc(CO)c(=O)[nH]c2=O)[C@@H](O)[C@H]1O,C40662640_decoy,TRY1,Decoy,0,-5.60493,-8.56,-2.63,-6.035423183711857
Nc1ncnc2c1nc(NCCOCCOCC[NH3+])n2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1O,C42854017_decoy,TRY1,Decoy,0,-8.11178,-7.62,-2.87,-8.197135444842127
Nc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@@](=O)([O-])O[C@H]3[C@H]2OC(=O)NCCCCCC[NH3+])c(=O)[nH]1,C42854033_decoy,TRY1,Decoy,0,-8.30971,-7.69,-3.53,-8.780898214399661
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C43729969_decoy,TRY1,Decoy,0,-8.13367,-8.04,-0.62,-8.730968257207245
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C43729970_decoy,TRY1,Decoy,0,-8.50004,-8.12,-1.45,-7.298076093670299
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C43729971_decoy,TRY1,Decoy,0,-8.31782,-8.77,-3.19,-9.196302124539224
CCN(CC)c1ccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C43729972_decoy,TRY1,Decoy,0,-8.52629,-8.43,-0.68,-9.796918898612942
CNC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C44171682_decoy,TRY1,Decoy,0,-6.78732,-4.99,-4.08,-4.520757195274801
CNC(=O)CCSCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C44171692_decoy,TRY1,Decoy,0,-6.53214,-4.71,-3.89,-4.359609907613672
CCCC[C@H]([NH3+])C(=O)N[C@H](CC(C)C)[C@H](O)CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)[C@H](O)CC(=O)[O-],C44559519_decoy,TRY1,Decoy,0,-7.85548,-6.88,-2.2,-7.330385483929671
COc1cccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CNc2ccccc2C(N)=O)c1O,C02447316_decoy,TRY1,Decoy,0,-9.34588,-6.54,-3.27,-6.870777790693415
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@H]1O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H]1O,C03871262_decoy,TRY1,Decoy,0,-6.99358,-7.62,-1.88,-9.005440996624309
CCOc1ccccc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1CNc1ccccc1C(N)=O,C02446531_decoy,TRY1,Decoy,0,-9.04725,-5.92,-1.45,-6.931809695232236
CCOc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1OC,C08964839_decoy,TRY1,Decoy,0,-8.20866,-7.97,-1.66,-8.952942203131403
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccc(F)cc2)nnn1-c1nonc1N,C09307927_decoy,TRY1,Decoy,0,-8.5023,-8.62,-2.2,-7.673781180522624
COc1ccc(OC/C(C)=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C09975237_decoy,TRY1,Decoy,0,-6.92601,-8.02,-1.32,-6.937697760553872
COc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc(OC)c1OC,C09975283_decoy,TRY1,Decoy,0,-7.76918,-7.76,-1.58,-6.784938671130017
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H](O)[C@@H]1O,C13451112_decoy,TRY1,Decoy,0,-11.3682,-9.95,-4.15,-11.378875698571258
COc1cc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc(OC)c1OC,C16512208_decoy,TRY1,Decoy,0,-9.05042,-7.95,-2.83,-8.199829402698422
CO[C@H]1O[C@@H](CO)[C@H](O)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1,C16958726_decoy,TRY1,Decoy,0,-10.1414,-9.02,-4.44,-9.465748367358753
CCCOc1ccccc1/C=N/Nc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C19119327_decoy,TRY1,Decoy,0,-7.57218,-8.37,-3.1,-9.845618611800052
CC(C)n1cc(/C=N/Nc2nnc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n2N)cn1,C20921778_decoy,TRY1,Decoy,0,-10.4433,-7.57,-3.75,-8.253825805821322
NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c(NCc2ccco2)cc1Cl,C22059746_decoy,TRY1,Decoy,0,-8.39595,-6.39,-3.87,-6.175505327045446
O=C(CCc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C22065231_decoy,TRY1,Decoy,0,-6.60743,-8.16,-2.64,-7.569248189742169
O=C(CCc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C22065234_decoy,TRY1,Decoy,0,-6.49412,-8.14,-4.22,-8.943237340357642
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@@H](NC(C)=O)[C@@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C26892739_decoy,TRY1,Decoy,0,-5.45491,-5.7,-3.62,-4.690996394055336
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@H](NC(C)=O)[C@@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C26892744_decoy,TRY1,Decoy,0,-4.49656,-6.68,-3.58,-5.546414888212365
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@@H](NC(C)=O)[C@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C26892748_decoy,TRY1,Decoy,0,-5.09392,-6.39,-4.04,-5.1089237582454325
CC(=O)c1c(NNC(=O)CNNCC(=O)NNc2oc(C)cc(=O)c2C(C)=O)oc(C)cc1=O,C27525950_decoy,TRY1,Decoy,0,-8.11819,-7.72,-2.49,-9.30849119051887
COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159887_decoy,TRY1,Decoy,0,-8.84006,-6.16,-1.8,-5.455599087976497
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C31163232_decoy,TRY1,Decoy,0,-9.44466,-9.87,-2.77,-8.193167629556392
OC[C@@H](O)CNc1nc(N2CCOCC2)nc2c(NC[C@@H](O)CO)nc(N3CCOCC3)nc12,C17164891_decoy,TRY1,Decoy,0,-9.28261,-6.18,-1.09,-9.048574385930984
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33650602_decoy,TRY1,Decoy,0,-7.35585,-4.72,-2.61,-4.516812901124849
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33650603_decoy,TRY1,Decoy,0,-6.00849,-5.22,-1.28,-4.595522743177222
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C33745453_decoy,TRY1,Decoy,0,-6.8903,-5.44,-3.81,-4.8296704693236
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)[O-])C[C@H](O)[C@H]1O,C34177836_decoy,TRY1,Decoy,0,-11.7814,-9.0,-4.53,-10.119474270283002
CCCOc1ccccc1/C=N/Nc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C35183221_decoy,TRY1,Decoy,0,-7.76131,-8.51,-2.91,-9.794210880751267
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2F)c([N+](=O)[O-])c1,C35269624_decoy,TRY1,Decoy,0,-5.30169,-5.29,-4.41,-4.335993249664824
COc1cc([C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c2ccc(O)c(OC)c2)ccc1O,C35271367_decoy,TRY1,Decoy,0,-7.53809,-7.02,-3.4,-7.2781067282486624
[NH3+]CCCCCCO[P@](=O)([O-])O[P@](=O)([O-])OC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@@H]1O,C35340842_decoy,TRY1,Decoy,0,-5.88319,-7.39,-2.96,-5.503375709319534
COc1cc(C[C@@H](CO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](CO)Cc2ccc(O)c(OC)c2)ccc1O,C35455231_decoy,TRY1,Decoy,0,-8.41357,-7.55,-3.33,-8.471509013367768
CC(=C\C(=O)[O-])/C=C(\C)C[C@@H](C)CCCC[C@@H](O)[C@@H](CO)C(=O)OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1O,C35464022_decoy,TRY1,Decoy,0,-7.8562,-5.7,-4.13,-6.338145644267024
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35464218_decoy,TRY1,Decoy,0,-5.44799,-7.81,-2.27,-4.815283270810169
O=C(CCc1ccc([N+](=O)[O-])cc1)c1c(O)cc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35645820_decoy,TRY1,Decoy,0,-6.87087,-7.29,-2.69,-5.564794077183633
OC[C@@H]1O[C@H](OCCCOCCCO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C37246748_decoy,TRY1,Decoy,0,-4.13712,-7.24,-3.65,-5.12586022376735
CO[C@H]1C[C@@H](O[C@H](O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c2c(cc3cc(C)oc(=O)c3c2O)OC1=O,C35455032_decoy,TRY1,Decoy,0,-8.5311,-6.79,-2.99,-6.327971803269081
C[C@@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)[C@@]1(O)COC(=O)C1,C31167114_decoy,TRY1,Decoy,0,-7.70287,-9.65,-2.87,-6.92220212510569
CC(C)(CO)[C@H](O)C(=O)O[P@@](=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C38664945_decoy,TRY1,Decoy,0,-7.1251,-9.07,-2.55,-10.641870362989906
CC(C)[C@@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C)O,C31164875_decoy,TRY1,Decoy,0,-6.47926,-7.21,-3.22,-6.699484969155589
CC(C)[C@@](O)(CCO[C@@H]1O[C@H](CO[C@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H](C)O,C31164883_decoy,TRY1,Decoy,0,-7.87804,-6.26,-3.51,-6.248219386826175
O=C(NCCCCCCNC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1O)N[C@H]1CS(=O)(=O)C[C@@H]1O,C12174771_decoy,TRY1,Decoy,0,-8.48502,-6.22,-2.75,-6.94083837447979
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1CC(O)(C(=O)[O-])C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O,C13451209_decoy,TRY1,Decoy,0,-10.0921,-9.0,-3.91,-9.261006812982192
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](OCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193620_decoy,TRY1,Decoy,0,-5.50807,-5.96,-2.72,-4.8988697453430845
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](OCCCCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193647_decoy,TRY1,Decoy,0,-7.80002,-6.2,-2.71,-5.853207725536578
CC(=O)C[C@H]1O[C@@H](O[C@@H]2[C@H](NC(C)=O)[C@H](O)O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C44134947_decoy,TRY1,Decoy,0,-4.53956,-5.89,-3.06,-4.694440390019742
CC(=O)C[C@H]1O[C@@H](O[C@@H]2[C@H](NC(C)=O)[C@H](O)O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C44134951_decoy,TRY1,Decoy,0,-3.72449,-5.94,-4.12,-4.966956785847219
NS(=O)(=O)c1cc(C(=O)O[C@@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)c(NCc2ccco2)cc1Cl,C44168779_decoy,TRY1,Decoy,0,-5.92568,-7.97,-3.7,-7.1314176904704505
NS(=O)(=O)c1cc(C(=O)O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c(NCc2ccco2)cc1Cl,C65742727_decoy,TRY1,Decoy,0,-8.75258,-7.55,-2.95,-7.630689383069692
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@@H](NC(C)=O)[C@@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C66055318_decoy,TRY1,Decoy,0,-4.73926,-4.43,-3.29,-4.244521090636427
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@@H](NC(C)=O)[C@@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C66055320_decoy,TRY1,Decoy,0,-4.35712,-5.73,-4.27,-4.571432838438592
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](Oc3ccc(N=C=S)cc3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C04556697_decoy,TRY1,Decoy,0,-8.52761,-4.93,-2.19,-5.377638713769978
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](Oc3ccc(N=C=S)cc3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C04556700_decoy,TRY1,Decoy,0,-7.48884,-4.42,-1.98,-4.746888012582928
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C05260509_decoy,TRY1,Decoy,0,-5.79438,-7.67,-2.85,-6.461153886880631
N#C[C@@H](O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1,C06858611_decoy,TRY1,Decoy,0,-5.66304,-8.05,-4.03,-6.9644191336065004
CO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2NC(C)=O)[C@@H](O)[C@H]1NC(C)=O,C13348018_decoy,TRY1,Decoy,0,-4.55578,-5.16,-4.08,-4.290477895277376
CO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2NC(C)=O)[C@@H](O)[C@H]1NC(C)=O,C13348023_decoy,TRY1,Decoy,0,-4.87641,-5.97,-3.4,-4.580292755885102
CO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H](O)[C@H]1NC(C)=O,C13348027_decoy,TRY1,Decoy,0,-4.91769,-4.31,-4.33,-4.259367334621609
CO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2NC(C)=O)[C@@H](O)[C@H]1NC(C)=O,C13348031_decoy,TRY1,Decoy,0,-3.99929,-5.36,-3.1,-4.12514758463832
Nc1ccn([C@H]2O[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])OCC[NH3+])[C@@H](O)[C@H]2O)c(=O)n1,C13431050_decoy,TRY1,Decoy,0,-6.299,-5.18,-1.54,-5.759161955280997
Nc1ccn([C@@H]2O[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])OCC[NH3+])[C@@H](O)[C@H]2O)c(=O)n1,C13431052_decoy,TRY1,Decoy,0,-5.85665,-6.61,-3.0,-5.984749846381822
Nc1ccn([C@H]2O[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])OCC[NH3+])[C@@H](O)[C@@H]2O)c(=O)n1,C13431053_decoy,TRY1,Decoy,0,-5.46853,-6.44,-2.2,-6.36636330603271
Nc1ccn([C@@H]2O[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])OCC[NH3+])[C@@H](O)[C@@H]2O)c(=O)n1,C13431055_decoy,TRY1,Decoy,0,-6.20865,-8.25,-2.49,-7.316083264894766
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C14586552_decoy,TRY1,Decoy,0,-5.9012,-8.64,-2.22,-6.245001202050029
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205662_decoy,TRY1,Decoy,0,-5.01298,-7.31,-3.56,-4.418121187076766
O=C(/C=C/c1ccccc1)O[C@H]1C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12,C15449158_decoy,TRY1,Decoy,0,-8.00922,-7.32,-1.76,-6.330626761225584
CCOc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1O,C19203751_decoy,TRY1,Decoy,0,-8.10899,-8.74,-1.8,-7.25389945565957
O=C(C[C@H]1SC(N[C@H](c2ccc(O)c(O)c2)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccccc1F,C20559690_decoy,TRY1,Decoy,0,-8.92737,-8.85,-3.08,-6.989128590087705
O=C(C[C@H]1SC(N[C@@H](c2ccc(O)c(O)c2)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccccc1F,C20559692_decoy,TRY1,Decoy,0,-8.68647,-7.65,-2.15,-9.2708881902657
O=C(C[C@@H]1SC(N[C@H](c2ccc(O)c(O)c2)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccccc1F,C20559694_decoy,TRY1,Decoy,0,-10.5207,-9.61,-2.25,-9.384998147219465
O=C(C[C@@H]1SC(N[C@@H](c2ccc(O)c(O)c2)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccccc1F,C20559696_decoy,TRY1,Decoy,0,-9.79967,-9.76,-4.94,-8.529464889898323
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)c1O,C20832711_decoy,TRY1,Decoy,0,-10.6337,-7.46,-3.19,-9.152389064495535
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22064981_decoy,TRY1,Decoy,0,-5.15431,-5.94,-4.21,-4.606188827410297
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)cc1,C22064993_decoy,TRY1,Decoy,0,-5.22894,-7.22,-3.24,-5.1504599544794125
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C22065072_decoy,TRY1,Decoy,0,-5.1411,-6.17,-3.86,-4.322431009950463
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22065089_decoy,TRY1,Decoy,0,-4.07962,-7.89,-4.07,-5.226859648251998
COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159891_decoy,TRY1,Decoy,0,-7.81834,-6.56,-2.84,-5.742345646869227
O=C1CCC=C[C@]1(O)C(=O)OCc1cccc(O)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31160899_decoy,TRY1,Decoy,0,-7.44152,-7.08,-1.51,-6.494608056471637
O=C1CCC=C[C@]1(O)C(=O)OCc1cccc(O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31160903_decoy,TRY1,Decoy,0,-6.71132,-7.95,-1.53,-6.95057221364767
O=C1CCC=C[C@]1(O)C(=O)OCc1cccc(O)c1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31160907_decoy,TRY1,Decoy,0,-7.74929,-7.65,-1.36,-9.55768684526998
COc1cc(OC)c(-c2coc3cc(O[C@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c(OC)c(O)c3c2=O)cc1O,C31161533_decoy,TRY1,Decoy,0,-8.92101,-7.08,-2.86,-7.153601000165273
COc1cc(C[C@@H](CO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(/C=C/CO)cc(OC)c2O)ccc1O,C31167913_decoy,TRY1,Decoy,0,-8.88157,-7.89,-3.6,-7.888328577326538
COc1cc2oc(=O)ccc2cc1[C@@H](O)[C@@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31167988_decoy,TRY1,Decoy,0,-7.48155,-5.69,-1.41,-4.709369425454432
CCOc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1O,C35188417_decoy,TRY1,Decoy,0,-8.10925,-7.73,-1.65,-6.6986426615650325
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C35645695_decoy,TRY1,Decoy,0,-6.48771,-7.35,-4.9,-5.522454695324719
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645712_decoy,TRY1,Decoy,0,-6.12267,-5.74,-2.7,-4.81809749657268
O=c1nc(SSc2ccn([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c(=O)n2)ccn1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C05538739_decoy,TRY1,Decoy,0,-5.55769,-7.15,-3.32,-5.21697006847152
O=C1CCC=C[C@@]1(O)C(=O)OCc1cccc(O)c1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35457130_decoy,TRY1,Decoy,0,-6.67892,-7.59,-4.02,-8.681887348367987
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C39937350_decoy,TRY1,Decoy,0,-4.98361,-6.38,-3.73,-4.213367366387262
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C39937361_decoy,TRY1,Decoy,0,-5.1234,-6.36,-3.84,-4.996201287237221
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C39937362_decoy,TRY1,Decoy,0,-5.50018,-8.35,-2.33,-6.226714568374581
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@@H](OCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193641_decoy,TRY1,Decoy,0,-8.53343,-5.21,-4.02,-4.864599227916804
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)c(Cl)c1,C43193665_decoy,TRY1,Decoy,0,-6.00452,-5.5,-2.91,-4.399684148058342
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)c(Cl)c1,C43193669_decoy,TRY1,Decoy,0,-6.11963,-4.98,-3.91,-4.242936491037181
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1,C44021718_decoy,TRY1,Decoy,0,-5.19792,-6.65,-2.25,-4.405330870967227
CC(C)CC(CC(C)C)O[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,C44168296_decoy,TRY1,Decoy,0,-7.69511,-6.68,-3.32,-5.908177875187762
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,C44963948_decoy,TRY1,Decoy,0,-4.46537,-7.67,-3.91,-5.115441516285592
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)cc1,C44963964_decoy,TRY1,Decoy,0,-5.3886,-7.74,-1.48,-4.75652020235817
O=C(CO)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C34914647_decoy,TRY1,Decoy,0,-5.1839,-4.87,-0.89,-4.233645886016113
O=C(CO)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@H]1O,C34914649_decoy,TRY1,Decoy,0,-5.87795,-7.69,-3.33,-6.936497011096427
NC(=O)CCNC(=O)C1=C[C@@H](NC(=O)c2ccccc2Br)[C@@H](O)[C@H](O)C1,C03839697_decoy,TRY1,Decoy,0,-8.85573,-5.61,-1.83,-6.475171919622537
OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)[C@H]1SC(c2ccccc2)=NN1c1ccccc1,C04174623_decoy,TRY1,Decoy,0,-9.51799,-7.16,-0.94,-7.890992090638282
CC(C)(C)NC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C04188524_decoy,TRY1,Decoy,0,-7.99751,-7.85,0.02,-8.980668208571233
O=C(N/N=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1ccncc1,C04198918_decoy,TRY1,Decoy,0,-6.82062,-5.15,-3.08,-4.452028362584536
COCCNC(=O)C[C@@H]1c2nc(N)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03842076_decoy,TRY1,Decoy,0,-8.0352,-4.85,-1.92,-5.260010141191084
CCc1cc2c(cc1C)nc1c(=O)[nH]c(=O)nc-1n2C[C@H](O)[C@H](O)[C@H](O)CO,C04707705_decoy,TRY1,Decoy,0,-7.23166,-6.97,-4.73,-5.664470565962895
Cc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)CNC(=O)NCc1ccco1,C01754266_decoy,TRY1,Decoy,0,-5.39774,-7.3,-1.46,-4.990636891660085
Nc1nc2c(ncn2[C@@H]2O[C@H](COC(=O)Oc3ccccc3)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C05371082_decoy,TRY1,Decoy,0,-6.89983,-7.68,-2.07,-7.601260766729073
CSc1nc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(C(=O)CCl)c(=O)n1C,C05766321_decoy,TRY1,Decoy,0,-7.80184,-6.15,-2.04,-5.70486902141258
O=C(Cc1cscn1)c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1O,C08048269_decoy,TRY1,Decoy,0,-8.47741,-6.15,-3.71,-5.768750671548481
Nc1ccc(NC(Nc2ccc(N)cc2)=C(/C=C(\Cl)[N+](=O)[O-])[N+](=O)[O-])cc1,C03059364_decoy,TRY1,Decoy,0,-6.40295,-7.46,-0.91,-7.545763814998329
Nc1ncnc(NNC(=O)CNC(=O)c2cc(Cl)ccc2Cl)c1[N+](=O)[O-],C08795820_decoy,TRY1,Decoy,0,-7.56703,-8.29,-1.78,-7.31577833673257
Nc1ncnc(NNC(=O)CNC(=O)C23CC4CC(CC(C4)C2)C3)c1[N+](=O)[O-],C09391666_decoy,TRY1,Decoy,0,-7.42512,-8.15,-1.74,-7.087529627420873
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3sccc3C(N)=O)sc2n1,C10645005_decoy,TRY1,Decoy,0,-8.77986,-7.58,-1.94,-6.036143237974567
NC(=O)C(NC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)C(N)=O,C12791358_decoy,TRY1,Decoy,0,-7.9397,-7.42,-2.03,-6.232355543254775
NC(=O)c1cc(-c2csc(NC(=O)CCNC(=O)c3ccsc3)n2)c[nH]1,C12889821_decoy,TRY1,Decoy,0,-9.32139,-8.49,-1.31,-7.934051422904989
O[C@@H]1[C@H](O)[C@H](OCc2ccccc2)O[C@@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C13660141_decoy,TRY1,Decoy,0,-4.18175,-6.52,-1.49,-4.823066491391916
O[C@@H]1[C@H](O)[C@H](OCc2ccccc2)O[C@@H](CO[C@@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C13660143_decoy,TRY1,Decoy,0,-4.89134,-8.05,-2.19,-6.567129853245392
O[C@@H]1[C@H](O)[C@H](OCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1O,C13660146_decoy,TRY1,Decoy,0,-4.59442,-7.73,-2.94,-5.368207468649457
COc1cc(/C=N/NC(N)=O)cc(I)c1OCC(N)=O,C13747747_decoy,TRY1,Decoy,0,-8.27661,-5.04,-1.18,-5.274215387346136
O=c1[nH]c2ccccc2nc1/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@H](O)[C@@H](O)CO,C15774862_decoy,TRY1,Decoy,0,-8.23504,-7.33,-1.13,-6.893686341763222
Cc1ccc(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1F,C18918848_decoy,TRY1,Decoy,0,-8.26025,-7.62,-1.87,-5.910442603299658
C[C@@H](Sc1nnc(COc2ccc(C(C)(C)C)cc2)n1N)C(=O)NC(N)=O,C26123588_decoy,TRY1,Decoy,0,-8.33135,-7.95,-1.98,-6.591582108550119
C[C@H](Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1)C(=O)NC(=O)NC1CC1,C29718908_decoy,TRY1,Decoy,0,-7.842,-7.09,-1.85,-5.622981228669656
C[C@@H](Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1)C(=O)NC(=O)NC1CC1,C29718910_decoy,TRY1,Decoy,0,-7.05846,-7.24,-2.49,-6.3109065178957655
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](CO)CC[C@H]12,C31158055_decoy,TRY1,Decoy,0,-6.83718,-6.25,-0.89,-5.0238937647379895
CCNC1=C(C)C(=O)c2c(c(COC(N)=O)c3n2C[C@@H](NC(C)=O)[C@H]3O)C1=O,C04972677_decoy,TRY1,Decoy,0,-7.04751,-5.92,-0.22,-5.148030494838776
CCNC1=C(C)C(=O)c2c(c(COC(N)=O)c3n2C[C@@H](NC(C)=O)[C@@H]3O)C1=O,C04972675_decoy,TRY1,Decoy,0,-6.86795,-6.06,0.18,-4.963209537947085
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CO,C36503736_decoy,TRY1,Decoy,0,-7.00006,-5.18,-0.43,-5.472798714891852
O[C@H]1[C@H](O)[C@H](OCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C13376361_decoy,TRY1,Decoy,0,-5.00295,-6.2,-2.06,-4.191762919120943
O=C(O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c1c(O)cc(O)cc1/C=C/c1ccccc1,C35455209_decoy,TRY1,Decoy,0,-8.37904,-8.43,-1.0,-10.809165000962404
COc1cc(/C=C/c2cc(O)cc(O)c2)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31158565_decoy,TRY1,Decoy,0,-8.51172,-6.32,-2.83,-5.413181112104503
O[C@H]1[C@H](O)[C@@H](OCc2ccccc2)O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C13376360_decoy,TRY1,Decoy,0,-4.11408,-6.73,-0.97,-4.274973115116717
NN1[C@@H](SCC(=O)Nc2nccs2)NN[C@@H]1[C@@H]1C=C(c2ccccc2)N=N1,C38999551_decoy,TRY1,Decoy,0,-9.35869,-8.17,-2.02,-6.878833849011178
NC(=O)c1cc(NC(=O)C(=O)NC[C@H](O)c2ccc(F)c(F)c2)ccc1Cl,C41740377_decoy,TRY1,Decoy,0,-9.51719,-8.14,-2.5,-7.013740876498638
C[C@@H](Nc1ccc(NC(=O)NC2CC2)cc1)C(=O)NC(=O)NC[C@H]1CCCO1,C43672879_decoy,TRY1,Decoy,0,-9.08635,-7.34,-2.46,-7.255807033378427
O=C(NC/C=C/c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O)C(F)(F)F,C43771812_decoy,TRY1,Decoy,0,-6.55985,-7.06,-3.99,-5.990267714551436
C=C1CCO[C@@]2([C@@H](O)[C@@](C)(O)COC(=O)c3ccccc3)NC(=O)[C@]1(O)NC2=O,C44123620_decoy,TRY1,Decoy,0,-6.89055,-7.77,-1.33,-7.02402219258299
CC(C)NC(=O)Nc1ccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1,C46997317_decoy,TRY1,Decoy,0,-6.94186,-7.16,-3.37,-5.212119908735932
Nc1ccc(C(=O)Cc2nc3nnc(N)n3nc2CC(=O)c2ccc(N)cc2)cc1,C48553642_decoy,TRY1,Decoy,0,-7.05209,-6.51,-0.92,-5.680933830743949
NS(=O)(=O)c1cc(C(=O)NNC(=S)NC2CC2)sc1Br,C49458032_decoy,TRY1,Decoy,0,-9.30056,-5.51,-2.71,-5.48832656793489
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1nncs1,C58994254_decoy,TRY1,Decoy,0,-8.90417,-9.04,-3.63,-7.891976452298967
Cc1c(NCN(C)[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=O)n(-c2ccccc2)n1C,C59378912_decoy,TRY1,Decoy,0,-5.97847,-7.4,-1.37,-5.875903917584636
Cc1c(NCN(C)[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=O)n(-c2ccccc2)n1C,C59378914_decoy,TRY1,Decoy,0,-5.34303,-6.28,-2.01,-4.061099843812391
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1SC(c2ccccc2)=NN1c1ccccc1,C59607031_decoy,TRY1,Decoy,0,-9.02454,-5.35,-1.39,-6.351743892791446
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1SC(c2ccccc2)=NN1c1ccccc1,C39180288_decoy,TRY1,Decoy,0,-7.86556,-7.21,-2.61,-8.837710257670302
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H]1SC(c2ccccc2)=NN1c1ccccc1,C59607036_decoy,TRY1,Decoy,0,-8.37805,-6.63,-0.77,-7.142033449464556
CC(C)N1NCc2c(C(=O)NCCCc3[nH]nc(N)c3C#N)cc(C3CC3)nc21,C39940144_decoy,TRY1,Decoy,0,-8.93355,-7.44,-0.72,-8.233995976866101
CC(C)(C)OC(=O)NC(C)(C)C(=O)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C67145140_decoy,TRY1,Decoy,0,-8.07927,-8.3,-1.39,-11.898491312726334
NC(=O)c1cc(NC(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)ccc1F,C67591512_decoy,TRY1,Decoy,0,-8.19387,-7.79,-2.85,-6.688398451199096
N#C[C@@]12CC([N+](=O)[O-])=C([NH3+])[C@@]1(C#N)CC([N+](=O)[O-])=C2[NH3+],C03672273_decoy,TRY1,Decoy,0,-7.81668,-4.74,-1.26,-4.649214944905543
[NH2+]=C1NNC(=[NH2+])C1=NNc1cccc(Cl)c1Cl,C04477412_decoy,TRY1,Decoy,0,-9.30203,-8.67,-0.5,-11.507827878426204
N#C[C@]12CC([N+](=O)[O-])=C([NH3+])[C@@]1(C#N)CC([N+](=O)[O-])=C2[NH3+],C03672274_decoy,TRY1,Decoy,0,-6.40447,-5.22,-1.7,-4.489818103788281
[NH3+]CCCC1OCC2(CO1)COC(CCC[NH3+])OC2,C04977046_decoy,TRY1,Decoy,0,-9.44223,-4.62,-1.4,-7.359631097984107
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1ccc(Cl)c(Cl)c1,C08579851_decoy,TRY1,Decoy,0,-9.33288,-6.84,-0.96,-9.284024146379355
CCSc1ccc(N2C(=[NH2+])NC(=[NH2+])NC2(C)C)cc1,C08581551_decoy,TRY1,Decoy,0,-9.92926,-6.76,-0.8,-11.12382103358478
CC[C@H]1NC(=[NH2+])NC(=[NH2+])N1c1ccc(Cl)c(Cl)c1,C08581357_decoy,TRY1,Decoy,0,-9.28764,-6.82,-0.92,-5.620935324117986
Cc1n[nH]c(C)c1S(=O)(=O)NC1(C[NH3+])CC[NH+](C)CC1,C20431613_decoy,TRY1,Decoy,0,-6.35275,-6.55,-1.71,-8.084856776644717
Nc1nc(O)c2c(n1)NC[NH+](CCC[NH+]1CCOCC1)C2,C08618892_decoy,TRY1,Decoy,0,-7.85698,-8.0,-0.51,-10.80544870771675
C[C@@H](C[NH3+])C[NH+]1CCN(c2ccnc(C(N)=O)c2)CC1,C35673117_decoy,TRY1,Decoy,0,-8.74798,-5.67,-0.9,-6.528917596219333
CNC(=O)C[NH+]1CCC(NC(=O)[C@H]2C[C@@H](O)C[NH2+]2)CC1,C37020417_decoy,TRY1,Decoy,0,-7.6596,-5.01,-2.41,-5.507451847347821
CC[C@@H](CC[NH3+])[NH+]1CCN([C@H](C)C(=O)NC(N)=O)CC1,C37049563_decoy,TRY1,Decoy,0,-8.83277,-4.64,-0.55,-5.351983227290144
CNC(=O)C[NH+]1CCC(NC(=O)[C@@](C)([NH3+])C2CC2)CC1,C37615106_decoy,TRY1,Decoy,0,-8.18184,-4.34,-1.09,-4.845398472856902
CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)CNC(=O)C[NH3+],C37626592_decoy,TRY1,Decoy,0,-7.92388,-5.68,-1.03,-8.430441872662414
C[C@@H](C[NH3+])C[NH+]1CCCN(c2n[nH]c(=O)[nH]c2=O)CC1,C37674242_decoy,TRY1,Decoy,0,-7.72148,-6.95,-1.58,-7.322587834562421
C[C@H](C[NH3+])C[NH+]1CCCN(c2n[nH]c(=O)[nH]c2=O)CC1,C37674243_decoy,TRY1,Decoy,0,-6.78237,-4.35,-2.29,-3.783522632605122
CC[C@@H](CC[NH3+])[NH+]1CCN(c2n[nH]c(=O)[nH]c2=O)CC1,C37674288_decoy,TRY1,Decoy,0,-7.08902,-5.06,-3.12,-4.985092571836242
CC[C@@H](CC[NH3+])[NH+]1CCCN(c2n[nH]c(=O)[nH]c2=O)CC1,C37674306_decoy,TRY1,Decoy,0,-8.28811,-4.35,-2.9,-4.826436165070049
Cc1[nH]ncc1S(=O)(=O)NC1(C[NH3+])CC[NH+](C)CC1,C37730228_decoy,TRY1,Decoy,0,-6.85835,-6.86,-0.26,-7.244154595912936
[NH3+][C@@H]1N=N[C@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)N1,C39345468_decoy,TRY1,Decoy,0,-7.86211,-6.3,-0.32,-4.817139352132768
[NH3+][C@H]1N=N[C@@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)N1,C39345471_decoy,TRY1,Decoy,0,-7.76089,-5.94,0.14,-5.017311682158617
C[C@@H]1CCC[C@](CNC(=O)CNC(=O)C[NH3+])([NH+](C)C)C1,C40670437_decoy,TRY1,Decoy,0,-7.63634,-4.42,-1.43,-5.040657760416956
C[C@H]1CC[C@H](C(N)=O)C[NH+]1CCC(=O)N(C)CCC[NH3+],C42428207_decoy,TRY1,Decoy,0,-8.64131,-5.87,-2.68,-7.207446369575638
CC[C@@H]([NH3+])[C@@H](c1ccccc1F)[NH+](CC(N)=O)C(C)C,C43045405_decoy,TRY1,Decoy,0,-8.29326,-4.77,-2.3,-5.562768713575786
CC[C@@H]([NH3+])[C@@H](c1ccc(C)s1)[NH+](CC(N)=O)C(C)C,C43242826_decoy,TRY1,Decoy,0,-8.2081,-4.43,-2.1,-5.483478171816489
Cc1ccc([C@@H]([C@H](C)[NH3+])[NH+]2C[C@H](C(N)=O)CC[C@@H]2C)o1,C43365070_decoy,TRY1,Decoy,0,-7.50936,-4.39,-0.96,-4.571570859516067
CC(C)([NH3+])c1noc(C[NH+]2CCC(CC(N)=O)CC2)n1,C43402257_decoy,TRY1,Decoy,0,-9.29767,-5.81,-1.02,-5.630671773514481
[NH3+][C@H](CO)Cc1cccc2cccc([C@@H](O)[C@H]([NH3+])CO)c12,C44466595_decoy,TRY1,Decoy,0,-5.97821,-4.56,-2.39,-4.601400718357471
[NH3+][C@@H](CO)CC(C[C@@H]([NH3+])CO)c1nc2ccccc2o1,C44466643_decoy,TRY1,Decoy,0,-9.13637,-4.62,-0.86,-4.632384340682231
[NH3+]C[C@H]1CCC[NH+](CC(=O)NC(=O)NC2CCCC2)C1,C44529367_decoy,TRY1,Decoy,0,-9.93794,-5.09,-2.59,-6.171297541029701
[NH3+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCC[C@@H]1CO,C48860082_decoy,TRY1,Decoy,0,-7.7166,-5.5,-4.0,-5.162306544309832
OCC[NH2+]CC[NH2+]Cc1ccc2[nH]c3ccccc3c2c1,C20506602_decoy,TRY1,Decoy,0,-6.99732,-5.21,-1.07,-4.450991682859309
C[C@H]([NH3+])[C@H](c1ccc(Cl)s1)[NH+](CCO)CCO,C43253120_decoy,TRY1,Decoy,0,-8.20699,-4.38,-2.3,-5.172393641604389
[NH3+]C[C@H]1CC[NH+](CC(=O)NC(=O)NCc2ccco2)C1,C50248372_decoy,TRY1,Decoy,0,-8.15614,-5.53,-0.81,-7.164429651806034
[NH3+]CC[NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl,C50523376_decoy,TRY1,Decoy,0,-8.78726,-5.04,-1.83,-5.936276529914015
[NH3+]CC[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl,C50523403_decoy,TRY1,Decoy,0,-8.19675,-5.31,-0.84,-9.53008182416089
CS(=O)(=O)c1ccc([C@@H](O)C[NH2+]CCC[NH3+])cc1,C51356206_decoy,TRY1,Decoy,0,-7.96671,-4.57,-2.91,-5.09182213711363
C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc2[nH]c(=O)[nH]c2c1,C51692688_decoy,TRY1,Decoy,0,-8.79847,-7.38,-0.14,-7.620287676539155
Cc1ccc(-c2n[nH]cc2C[NH2+]C2CCC([NH3+])CC2)o1,C51694353_decoy,TRY1,Decoy,0,-5.90486,-5.19,-1.2,-4.306288741489055
[NH3+]C1CCC([NH2+]Cc2c[nH]nc2-c2cccnc2)CC1,C51694356_decoy,TRY1,Decoy,0,-8.3835,-7.12,-1.59,-9.912000920119551
c1ccc(CCC2CNCC[NH2+]CCC[NH2+]CCNC2)nc1,C40641533_decoy,TRY1,Decoy,0,-7.89122,-5.02,-0.38,-4.247483384260447
COCC[C@H]([NH3+])C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C52809714_decoy,TRY1,Decoy,0,-8.12645,-4.43,-1.25,-5.028431323885638
NC(=O)C[NH+]1CCC(NC(=O)C[C@H]2CCC[NH2+]C2)CC1,C54307355_decoy,TRY1,Decoy,0,-7.48688,-5.99,-2.35,-5.586290622344583
[NH3+]CCCCN1C(=O)NC2(CC[NH+](CCCO)CC2)C1=O,C57841694_decoy,TRY1,Decoy,0,-9.00002,-6.86,-1.23,-8.004067772318086
C[NH+](C)CCN1CCN(C(=O)[C@@H]([NH3+])CC(N)=O)CC1,C61645272_decoy,TRY1,Decoy,0,-9.21642,-5.17,-1.86,-8.84222585784151
C[NH+](C)CCN1CC[NH+](CC[C@](C)(N)C(N)=O)CC1,C61653152_decoy,TRY1,Decoy,0,-8.11621,-4.24,-0.7,-4.8768243505254665
CC[C@]1(C(=O)NC2CC[NH+](CC(N)=O)CC2)CC[NH2+]C1,C62893385_decoy,TRY1,Decoy,0,-7.63692,-4.07,-2.45,-4.725616458769054
CCOC(=O)NC(=O)C[NH+]1CCC[C@H](C(=O)NCC[NH3+])C1,C63180487_decoy,TRY1,Decoy,0,-7.63285,-6.27,-3.37,-8.405274435785188
CS[C@@H]1NN[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63804886_decoy,TRY1,Decoy,0,-7.77391,-4.89,-1.64,-4.618642028880752
NC1=N[C@H](N2CCC(n3cc(C[NH3+])nn3)CC2)C2=CN=NC2=[NH+]1,C63847005_decoy,TRY1,Decoy,0,-9.46017,-5.71,-1.37,-5.335800088207186
c1cc2cc(-c3ccc4oc(C5=[NH+]CCN5)cc4c3)[nH]c2cc1C1=[NH+]CCN1,C01587183_decoy,TRY1,Decoy,0,-8.74321,-6.91,-1.04,-4.764424769275619
COc1cc(C[NH+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](O)C2)cc(Cl)c1O,C20233185_decoy,TRY1,Decoy,0,-9.16092,-6.65,-0.79,-5.130723044033539
Cn1ncc(C[NH+]2CCC(Cn3cc(C[NH3+])nn3)CC2)c1-c1ccccc1,C23541400_decoy,TRY1,Decoy,0,-9.25122,-6.16,-3.21,-6.211243699875978
COc1ccc(F)c(F)c1C[NH+]1CCC(n2cc(C(C)(C)[NH3+])nn2)CC1,C23541626_decoy,TRY1,Decoy,0,-8.44559,-6.66,-1.95,-5.523048552153928
C=CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC[NH+](Cc2ccc(C#N)cc2)CC1,C24825413_decoy,TRY1,Decoy,0,-7.16345,-6.27,-2.24,-5.204501627168789
Cc1nnc(N2CC[NH+](Cc3nc(N)c4ccccc4[nH+]3)CC2)c(C#N)c1C,C29442851_decoy,TRY1,Decoy,0,-6.59817,-7.13,-2.24,-4.955832828961944
Cc1cc(N2CC[NH+]([C@H](C)C(=O)NC(=O)NC(C)C)CC2)nc(C(C)C)[nH+]1,C35286829_decoy,TRY1,Decoy,0,-7.05136,-6.85,-3.17,-5.052271180289381
O=C(NCCCn1cc[nH+]c1)C1=CC2=[NH+][C@@H](c3ccco3)C[C@H](C(F)(F)F)N2N1,C05027680_decoy,TRY1,Decoy,0,-7.00385,-7.98,-1.59,-7.329551426549337
COC(=O)[C@@H]1[NH+]=c2ccc(Cl)cc2=C1NC(=O)C[NH+]1CCN(CCO)CC1,C38597142_decoy,TRY1,Decoy,0,-8.22789,-6.81,-3.84,-8.341480346193112
COC(=O)[C@@H]1[NH+]=c2cccc(Cl)c2=C1NC(=O)C[NH+]1CCN(CCO)CC1,C38664396_decoy,TRY1,Decoy,0,-7.88581,-5.45,-1.06,-5.228285204779715
Cc1ccc2c(c1)=[NH+][C@H](C1=C(N)N(c3ccc(Cl)c(C(F)(F)F)c3)CC1=O)[NH+]=2,C38819068_decoy,TRY1,Decoy,0,-7.77908,-8.13,-1.93,-7.087767117687068
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1c1ccc(Cl)c([N+](=O)[O-])c1,C38819141_decoy,TRY1,Decoy,0,-6.01108,-7.88,-1.63,-6.709916220179937
CCOc1cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)ccc1OCC(N)=O,C39352839_decoy,TRY1,Decoy,0,-6.78964,-7.54,-1.73,-6.536058822818466
COc1cc(/C=N/[NH+]=C2/N=NC3=c4ccccc4=[NH+][C@@H]3N2)cc(Br)c1O,C39373015_decoy,TRY1,Decoy,0,-8.21683,-6.92,-0.66,-5.18347143760459
CN(C)[C@H]1CCC[NH+](Cc2ccccc2-c2nc3c(c(=O)[nH]2)C[NH2+]CC3)C1,C23581550_decoy,TRY1,Decoy,0,-8.15513,-6.97,-1.52,-6.162348240867076
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)C(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39703017_decoy,TRY1,Decoy,0,-7.48939,-8.59,-2.45,-9.661361517485004
CCc1ccc2c(c1)=C1N=NC(N/N=C/c3ccc(O)c(OC)c3)=[NH+][C@@H]1[NH+]=2,C39769458_decoy,TRY1,Decoy,0,-7.74245,-7.06,,99.0
COc1ccc(/C=N/[NH+]=C2/N=NC3=c4cc(Br)ccc4=[NH+][C@H]3N2)c(O)c1,C39774218_decoy,TRY1,Decoy,0,-7.71059,-6.31,-1.44,-4.557131771239524
O=C(CCC(=O)N/N=C/C1=c2ccccc2=[NH+]C1)N/N=C/C1=c2ccccc2=[NH+]C1,C39988295_decoy,TRY1,Decoy,0,-8.91433,-7.84,-1.9,-7.01715098015715
Nc1c(N2CCN(c3cccc[nH+]3)CC2)nc[nH+]c1N1CCCc2ccccc21,C40780321_decoy,TRY1,Decoy,0,-6.61146,-5.72,-0.77,-4.325203406531951
COc1ccc(-c2cc([C@H]3C[NH+]4CC[C@H]3C[C@@H]4C[NH3+])nc(C)n2)cc1OC,C35415850_decoy,TRY1,Decoy,0,-8.24756,-5.61,-1.67,-5.194593951383325
C[C@H](Cn1cc[nH+]c1)NC(=O)Nc1ccc(N2CCC[NH+](C)CC2)c(F)c1,C47028193_decoy,TRY1,Decoy,0,-7.0018,-7.65,-1.53,-8.50066318611523
C[NH+]1CCN(C(C)(C)C[NH2+]Cc2c[nH]nc2-c2cc3ccccc3o2)CC1,C58363404_decoy,TRY1,Decoy,0,-6.91743,-5.91,-2.71,-4.849726186199072
O=C(NCC1([NH+]2CCCCC2)CCCCC1)NC1CC[NH+](C2CC2)CC1,C47751499_decoy,TRY1,Decoy,0,-10.0075,-4.93,-3.32,-5.622202780252011
COCCC[NH+](C)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C62029794_decoy,TRY1,Decoy,0,-8.1377,-3.57,-0.85,-4.774102800496724
CCOc1cc(/C=N/NC2=N[C@H]3[NH+]=c4ccc(C)cc4=C3N=[NH+]2)ccc1O,C39443767_decoy,TRY1,Decoy,0,-8.37698,-7.67,-0.88,-5.713412528100101
O=C(CNC(=O)C[C@H]1[NH+]=NC(=O)c2ccccc21)NCCC1=c2ccccc2=[NH+]C1,C63271110_decoy,TRY1,Decoy,0,-7.71467,-8.02,-1.21,-6.435967757396953
C[NH+](C)CCCNC(=O)CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2C1,C63271637_decoy,TRY1,Decoy,0,-7.51932,-6.82,-2.38,-5.620646639754471
CCn1nc(C)c(CNC(=O)[C@H]2[NH+]=C(CC3=c4ccccc4=[NH+]C3)NO2)c1C,C63302948_decoy,TRY1,Decoy,0,-8.0463,-7.9,-2.85,-10.176679607609744
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N[C@H]1NC(=O)c2ccccc2S1,C63446048_decoy,TRY1,Decoy,0,-7.45425,-7.82,-2.16,-6.231831504243499
CC1=C(C(=O)Nc2ccccc2C)[C@@H](C2[NH+]=c3ccccc3=[NH+]2)n2ncnc2N1,C63520786_decoy,TRY1,Decoy,0,-5.8404,-5.74,-1.09,-4.81090836983138
Cc1ccccc1CS[C@@H]1N=N[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63804922_decoy,TRY1,Decoy,0,-7.57404,-8.35,-1.8,-7.339010540363828
CC1(C)CC(NC(=O)C(=O)N2CCN(C(=O)[C@@H]3C=c4ccccc4=[NH+]3)CC2)CC(C)(C)[NH2+]1,C63818916_decoy,TRY1,Decoy,0,-7.16567,-7.39,-1.91,-6.234105340633835
CC1(C)CC(NC(=O)C(=O)N2CCN(C(=O)[C@H]3C=c4ccccc4=[NH+]3)CC2)CC(C)(C)[NH2+]1,C63818917_decoy,TRY1,Decoy,0,-7.45231,-5.72,-1.25,-4.98841517145011
C=C(C)CN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@H]1c1ccncc1,C63818926_decoy,TRY1,Decoy,0,-8.35759,-6.79,-2.57,-7.212859693018239
C=C(C)CN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccncc1,C63818927_decoy,TRY1,Decoy,0,-8.36274,-6.13,-1.4,-5.55715299402814
CC(C)[C@H](NC(=O)c1ccco1)C(=O)N[C@@H](C)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C64120243_decoy,TRY1,Decoy,0,-8.97903,-6.38,-1.94,-5.723159227830892
CC(C)[C@H](NC(=O)c1ccco1)C(=O)N[C@H](C)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C64120245_decoy,TRY1,Decoy,0,-8.62933,-7.43,-1.64,-6.768363780804956
CC(C)[C@@H](NC(=O)c1ccco1)C(=O)N[C@H](C)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C64120246_decoy,TRY1,Decoy,0,-8.86052,-7.46,-2.04,-8.55052966732222
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)/N=C1\N[C@H](O)c2ccccc2S1,C64198599_decoy,TRY1,Decoy,0,-7.98553,-8.15,-1.52,-10.15993096529334
CCCNC(=O)C[NH+]1CCC(NC(=O)N2CCC[NH+](C3CC3)CC2)CC1,C61904589_decoy,TRY1,Decoy,0,-7.80001,-5.47,-1.96,-5.3723618844518
CCn1cc([C@@H]2CC(=O)N[C@@H]3C2=C(C)NN3C2[NH+]=c3ccccc3=[NH+]2)c(C)n1,C64450385_decoy,TRY1,Decoy,0,-6.45801,-7.07,-1.55,-4.9540941456766365
CCn1cc([C@@H]2CC(=O)N[C@H]3C2=C(C)NN3C2[NH+]=c3ccccc3=[NH+]2)cn1,C64450391_decoy,TRY1,Decoy,0,-7.02257,-6.42,-1.57,-5.240710314260752
CCn1ncc([C@H]2CC(=O)N[C@@H]3C2=C(C)NN3C2[NH+]=c3ccccc3=[NH+]2)c1C,C64450394_decoy,TRY1,Decoy,0,-6.42916,-5.74,-0.87,-5.387640234575373
Cc1nc(-c2c(-c3ccccc3)[nH+]cn2C2CC(C)(C)[NH2+]C(C)(C)C2)c[nH]1,C65432264_decoy,TRY1,Decoy,0,-6.21717,-6.3,-0.94,-4.354867851487895
CC(C)C[C@@]1(CO)N[C@H](c2c[nH+]cn2C)[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]21,C65497469_decoy,TRY1,Decoy,0,-7.57187,-5.09,-2.11,-4.771099811695189
CCCNC(=O)C[NH+]1CCC(NC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)CC1,C66179389_decoy,TRY1,Decoy,0,-8.71739,-5.05,-2.09,-5.616496249194324
Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)o1,C66876842_decoy,TRY1,Decoy,0,-7.44583,-6.97,-1.33,-6.711616032371796
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1,C67122313_decoy,TRY1,Decoy,0,-6.83366,-7.13,-1.62,-5.848910748674158
Cc1ccc2[nH+]c(CNc3nc(-c4ccccc4)nc4c3CC[NH2+]C4)cn2c1,C67446972_decoy,TRY1,Decoy,0,-9.32429,-6.72,-0.34,-6.759626732905652
Cn1c(=O)c(C(=O)C[C@H]([NH2+]Cc2ccncc2)c2ccccc2O)c(O)c2ccccc21,C03846551_decoy,TRY1,Decoy,0,-8.04418,-7.57,-1.74,-6.192844191572579
O=C(N[C@H]1CCN2C(=O)c3cc(-c4ccc5c(c4)OCO5)ccc3NC(=O)[C@@H]2C1)[C@@H]1CSC[NH2+]1,C04222247_decoy,TRY1,Decoy,0,-7.27419,-6.62,-0.83,-4.75797325640543
O=C(N[C@H]1CCN2C(=O)c3cc(-c4ccccc4F)ccc3NC(=O)[C@@H]2C1)[C@@H]1CSC[NH2+]1,C04222250_decoy,TRY1,Decoy,0,-6.84761,-7.03,-0.69,-5.815328821224727
[NH2+]=C1Cc2ncnn2C(N2N=C(c3ccc(Br)cc3)C[C@@]2(O)C(F)(F)F)=NN1,C08694874_decoy,TRY1,Decoy,0,-9.15129,-6.4,-2.11,-5.971618058155942
Cc1cccc2c1NC(=O)[C@]21[NH2+][C@@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08790088_decoy,TRY1,Decoy,0,-7.74667,-7.06,-1.43,-5.413690219507217
CC(C)(C)N1C(=O)[C@@H]2[C@@H]([C@H](O)c3ccc(Cl)cc3)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@H]2C1=O,C09044948_decoy,TRY1,Decoy,0,-8.48599,-8.95,-1.82,-7.866619147991918
CC(C)(C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccc(F)cc21,C09303061_decoy,TRY1,Decoy,0,-9.30323,-8.85,-0.97,-8.424483688503878
Cc1nn(C)c(C)c1[C@H](C)[NH+](C)Cc1ccc(C(=O)NCC2(O)CCCCC2)c(=O)[nH]1,C12244920_decoy,TRY1,Decoy,0,-8.29828,-7.28,-3.22,-5.750583319840617
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12883152_decoy,TRY1,Decoy,0,-7.32115,-5.82,-1.22,-4.914282674833058
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@H]([C@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12885236_decoy,TRY1,Decoy,0,-8.59087,-6.53,-2.07,-5.249373021445885
C[C@H](NC(=O)c1ccc(Br)o1)C(=O)N1CCC2(CC1)[NH2+]CCc1[nH]cnc12,C08791940_decoy,TRY1,Decoy,0,-8.48371,-6.46,-3.43,-6.173693605450649
COc1cccc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)[NH2+]CCc2nc[nH]c23)c1OC,C08996500_decoy,TRY1,Decoy,0,-7.14823,-6.78,-1.9,-5.022276234091796
COc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(F)ccc2O3)cc1NC(C)=O,C19022145_decoy,TRY1,Decoy,0,-9.13321,-7.35,-3.2,-5.966507077833306
Oc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@H](O)c3ccc4c(c3)OCCCO4)CC1)O2,C19345593_decoy,TRY1,Decoy,0,-9.51397,-5.69,-1.26,-5.075774987632757
Oc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@@H](O)c3ccc4c(c3)OCCCO4)CC1)O2,C19345599_decoy,TRY1,Decoy,0,-8.43405,-6.32,-1.2,-4.780262656562285
C[C@H](NC(=O)c1ccc(Br)o1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C13550860_decoy,TRY1,Decoy,0,-10.0826,-6.54,-0.95,-6.113950194368863
C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCN(Cc2ccc(Cl)s2)CC1,C23334538_decoy,TRY1,Decoy,0,-11.1412,-6.65,-1.53,-6.222263182097902
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)C[NH+]1CCC2=C(CCS2)[C@@H]1c1ccccc1,C38797076_decoy,TRY1,Decoy,0,-7.41148,-8.25,-1.28,-7.439165675679994
COC1=C[C@H]2C[NH+]3N[P@@](=O)(c4ccccc4O)OC[C@@H]3C[C@@H]2C=C1c1ccccc1O,C39467101_decoy,TRY1,Decoy,0,-7.96604,-6.06,-1.75,-4.985014945644698
COC1=C[C@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467152_decoy,TRY1,Decoy,0,-7.25135,-6.38,-1.35,-5.9959232364818265
COC1=C[C@H]2C[C@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467155_decoy,TRY1,Decoy,0,-7.95041,-6.62,-0.94,-4.506671435919493
CCN1C(=O)[C@H](C2=NNC(=O)/C2=C\[C@H]2C(=O)[NH+]=c3c(C)cccc3=C2O)[C@@H](O)c2ccccc21,C39939869_decoy,TRY1,Decoy,0,-9.23019,-8.13,-2.41,-6.070923439524477
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C44713601_decoy,TRY1,Decoy,0,-8.23318,-5.34,-1.87,-5.565425353800053
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C44713603_decoy,TRY1,Decoy,0,-7.97999,-7.31,-1.22,-5.987577630660638
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713730_decoy,TRY1,Decoy,0,-8.45113,-5.46,-1.15,-5.219600685082379
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1F,C44713849_decoy,TRY1,Decoy,0,-8.15463,-6.08,-2.61,-5.326821657127958
Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1F,C44713892_decoy,TRY1,Decoy,0,-8.44071,-5.53,-0.83,-5.853140424108669
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(F)c1F,C44713917_decoy,TRY1,Decoy,0,-8.58531,-8.07,-0.94,-6.759793933299796
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1C,C44714048_decoy,TRY1,Decoy,0,-7.53958,-5.48,-2.07,-5.102948907313283
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)[C@H](Oc2ccccc2)C(C)C)CC12CC[NH2+]CC2,C44714248_decoy,TRY1,Decoy,0,-8.07053,-5.39,-2.52,-5.870849753102565
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)C(C)C)CC12CC[NH2+]CC2,C44714390_decoy,TRY1,Decoy,0,-8.70374,-8.02,-2.72,-5.985385142050779
O=C(NCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1ccc(Br)cc1,C20573324_decoy,TRY1,Decoy,0,-8.67972,-8.41,-2.16,-10.72838280027784
COc1cc([C@@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc(Cl)c1OC,C12506769_decoy,TRY1,Decoy,0,-10.2706,-6.08,-2.6,-5.311688710439496
CS(=O)(=O)N[C@H]1Nc2ccc(C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)cc2S1,C63281127_decoy,TRY1,Decoy,0,-7.66431,-7.9,-3.27,-5.983901800072348
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)NC(=S)N(Cc4ccccc4)[C@H]3O)[C@H]1[NH+]=2,C63375705_decoy,TRY1,Decoy,0,-8.24918,-6.24,-2.88,-6.256631313316014
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)NC(=S)N(Cc4ccccc4)[C@H]3O)[C@H]1[NH+]=2,C63375707_decoy,TRY1,Decoy,0,-6.63155,-7.59,-3.05,-5.77536799846979
CC(C)c1ccc(N2N[NH2+]N[C@H]2SCC(=O)C2=CN=C(C(=O)N3CCCC3)C2)cc1,C63731319_decoy,TRY1,Decoy,0,-9.0537,-6.6,-1.0,-7.036827639980716
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63933351_decoy,TRY1,Decoy,0,-7.65634,-6.29,-1.67,-5.280739051945103
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccc(C)c(Cl)c4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63933355_decoy,TRY1,Decoy,0,-8.85324,-7.7,-2.14,-5.713566560350611
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccc(C)c(C)c4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63985249_decoy,TRY1,Decoy,0,-8.20049,-7.9,-2.6,-6.587769743287279
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc(C)c4C)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64019215_decoy,TRY1,Decoy,0,-9.25979,-9.31,-1.86,-6.127205724964979
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4cc(C)cc(C)c4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64062062_decoy,TRY1,Decoy,0,-7.10479,-8.29,-2.83,-5.556694331519887
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4ccc(C)cc4C)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64097964_decoy,TRY1,Decoy,0,-6.51675,-8.58,-1.17,-5.173192202047797
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccc(C)cc4C)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64097966_decoy,TRY1,Decoy,0,-8.25266,-9.3,-1.6,-5.929674298656062
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cc(C)ccc4C)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64097970_decoy,TRY1,Decoy,0,-8.40876,-8.8,-2.57,-7.338999089796366
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4cccc(Cl)c4)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64097975_decoy,TRY1,Decoy,0,-8.21998,-8.59,-2.65,-7.155560887275764
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc(Cl)c4)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64097977_decoy,TRY1,Decoy,0,-8.84729,-7.46,-1.53,-6.096704650749025
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cc(Cl)ccc4C)[C@H](O)N=C3O)[C@H]1[NH+]=2,C64097984_decoy,TRY1,Decoy,0,-8.27396,-7.23,-3.73,-5.7577157127052905
O=C1[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@H]32)C(O)=N[C@H](O)N1c1cccc(C(F)(F)F)c1,C64098016_decoy,TRY1,Decoy,0,-7.92013,-7.57,-1.44,-5.975835837695867
C[C@@H](NC(=O)c1ccc(Br)o1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C13550857_decoy,TRY1,Decoy,0,-8.92462,-7.99,-1.46,-7.45629246474901
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4[NH+](C)C3)(C(C)C)C(=O)N12,C04245686_decoy,TRY1,Decoy,0,-8.89389,-7.53,-3.47,-6.508103728736759
Cc1[nH]c2ccc(OC(F)(F)F)cc2c1CCN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@]1(C)O,C00718619_decoy,TRY1,Decoy,0,-7.05156,-6.89,-2.61,-4.751078130418144
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@@H](Cc2ccc(O)cc2)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08790260_decoy,TRY1,Decoy,0,-8.16198,-8.23,-1.46,-6.299649427655873
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@@H](Cc3ccc(O)cc3)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08790266_decoy,TRY1,Decoy,0,-9.03809,-9.33,-1.44,-8.251549234888948
O=C1[C@H]2[C@@H](C(=O)N1CCc1ccccc1)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccccc21,C08791169_decoy,TRY1,Decoy,0,-9.03523,-7.34,-0.54,-8.324126578862789
CCCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C08791419_decoy,TRY1,Decoy,0,-7.47105,-8.13,-0.64,-5.927657226958512
C[C@@]12CC[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/CCc3ccc(F)cc3)[C@]1(O)CC[C@H]2C1=CC(=O)OC1,C09041370_decoy,TRY1,Decoy,0,-8.40937,-7.16,-1.66,-6.537655510102034
Cc1[nH]c2ccc(OC(F)(F)F)cc2c1CCN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@@]1(C)O,C12372311_decoy,TRY1,Decoy,0,-7.38492,-6.94,-1.99,-5.063315618041736
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C12878857_decoy,TRY1,Decoy,0,-9.26156,-8.7,-1.4,-8.050967002674923
COc1cc([C@H](Nc2cccc[nH+]2)c2cc(Cl)c3cccnc3c2O)cc(Br)c1O,C06395595_decoy,TRY1,Decoy,0,-9.24753,-7.63,-1.43,-8.582997343445737
CCCn1c(Cl)c([C@@H]2[NH2+]CCc3cc(O)c(O)cc32)s/c1=N\S(=O)(=O)c1cccs1,C19691546_decoy,TRY1,Decoy,0,-9.36594,-5.08,-3.41,-5.484428204054754
CCCn1c(Cl)c([C@H]2[NH2+]CCc3cc(O)c(O)cc32)s/c1=N\S(=O)(=O)c1cccs1,C19691548_decoy,TRY1,Decoy,0,-9.26783,-6.77,-2.91,-5.416680885437063
Cc1cc(-n2c(SCC(=O)Nc3ccc(C)c(Cl)c3)nc3n[nH]c(C)c3c2=[NH2+])ccc1Cl,C03021780_decoy,TRY1,Decoy,0,-8.94192,-8.12,-2.18,-7.92088532868095
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1,C15030664_decoy,TRY1,Decoy,0,-8.18796,-7.99,-1.5,-6.098863632651379
NC(=O)c1c(NC(=O)C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)sc2c1CCCC2,C15523995_decoy,TRY1,Decoy,0,-10.398,-8.45,-3.22,-7.349594262704818
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1[C@@H]2CC[C@H]1CC(NC(=O)NC13CC4CC(CC(C4)C1)C3)C2,C12644020_decoy,TRY1,Decoy,0,-8.50892,-8.97,-3.58,-6.395348084909919
CC[NH+](CC)CCNC(=O)[C@]1(O)c2cc(Br)ccc2NC(=O)N1c1c(F)cccc1F,C02496296_decoy,TRY1,Decoy,0,-8.81581,-5.59,-1.7,-6.466859845367733
O=C(NCCc1c[nH]c2ccccc12)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39597840_decoy,TRY1,Decoy,0,-8.61386,-7.08,-3.4,-5.587698031079338
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)[C@H]2CSc3ccccc32)CC12CC[NH2+]CC2,C39597876_decoy,TRY1,Decoy,0,-8.88371,-7.25,-1.19,-5.691151099180015
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cc(F)cc(F)c4)CC34CC[NH2+]CC4)c2c1,C39655874_decoy,TRY1,Decoy,0,-9.23332,-8.64,-2.68,-8.054854791175886
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4c(F)ccc(C)c4F)CC34CC[NH2+]CC4)c2c1,C39655984_decoy,TRY1,Decoy,0,-9.44958,-7.55,-2.28,-7.473474878439961
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4ccc(C)c(F)c4F)CC34CC[NH2+]CC4)c2c1,C39656004_decoy,TRY1,Decoy,0,-9.5223,-7.92,-2.07,-7.18458056694075
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C39673919_decoy,TRY1,Decoy,0,-9.36034,-7.61,-1.54,-6.77593687042631
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39673947_decoy,TRY1,Decoy,0,-8.74135,-7.37,-2.07,-6.276777544184187
O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39676399_decoy,TRY1,Decoy,0,-9.21083,-5.81,-2.47,-6.83444840994156
Cc1ccsc1C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676522_decoy,TRY1,Decoy,0,-8.94854,-7.94,-1.32,-6.75303686681741
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)c1F,C39684145_decoy,TRY1,Decoy,0,-8.78427,-8.86,-2.5,-7.320512151506366
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)[C@H]4CSc5ccccc54)CC34CC[NH2+]CC4)c[nH]c12,C39684214_decoy,TRY1,Decoy,0,-9.8826,-8.89,-1.49,-8.082770607457062
CC1(C)CC(=O)C2=C(C1)N[C@H]1N[C@H](SC(c3ccccc3)c3ccccc3)NN1[C@H]2C1=CC=[NH+]C1,C39916085_decoy,TRY1,Decoy,0,-8.94397,-5.83,-1.91,-6.210690995746674
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C44713590_decoy,TRY1,Decoy,0,-9.61766,-7.5,-1.87,-6.6116825789788605
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C44713680_decoy,TRY1,Decoy,0,-7.06381,-6.48,-1.66,-5.35307059225377
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2c(-c3ccccc3Cl)noc2C)CC12CC[NH2+]CC2,C44713819_decoy,TRY1,Decoy,0,-8.92089,-5.15,-3.5,-6.4071844124504
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(-c3ccccc3Cl)noc2C)CC12CC[NH2+]CC2,C44713823_decoy,TRY1,Decoy,0,-9.18051,-8.13,-2.2,-6.6016878921874405
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1Cl,C44714201_decoy,TRY1,Decoy,0,-9.99438,-6.83,-2.35,-6.520047228320142
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C44714366_decoy,TRY1,Decoy,0,-8.98799,-8.39,-1.75,-7.645025928262358
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C44714453_decoy,TRY1,Decoy,0,-8.45348,-8.62,-2.57,-7.4925278918025855
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccccc4C(F)(F)F)CC34CC[NH2+]CC4)[nH]c2c1,C39695715_decoy,TRY1,Decoy,0,-7.99852,-8.91,-3.0,-7.168429612267219
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(C)oc4C(F)(F)F)CC34CC[NH2+]CC4)[nH]c2c1,C44737477_decoy,TRY1,Decoy,0,-8.87741,-5.85,-2.3,-5.651261446264171
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3ccc([N+](=O)[O-])cc3cc2C(=O)Nc2ccc(Cl)cc2)cc1,C59170532_decoy,TRY1,Decoy,0,-8.90753,-7.72,-2.21,-6.769659279445966
Cc1ccc(S(=O)(=O)N/[NH+]=c2/oc3cc(O)ccc3cc2C(=O)Nc2ccccc2Cl)cc1,C59170577_decoy,TRY1,Decoy,0,-9.40518,-9.77,-1.41,-8.30766471361775
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3ccc([N+](=O)[O-])cc3cc2C(=O)Nc2ccc(F)cc2)cc1,C59170677_decoy,TRY1,Decoy,0,-9.4708,-5.84,-1.87,-6.133761542994084
CC(=O)Nc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@@H]2Nc2ccc(C(=O)O)cc2)cc1,C39984371_decoy,TRY1,Decoy,0,-9.3033,-6.77,-2.73,-6.586963527959195
O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(F)cc1)[C@@](CC1=c3ccccc3=[NH+]C1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C63465134_decoy,TRY1,Decoy,0,-7.84382,-8.81,-1.49,-6.893824837718417
O=C1[C@@H]2[C@@H](c3ccccc3O)[NH2+][C@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]2C(=O)N1c1ccc(Cl)cc1,C63472898_decoy1,TRY1,Decoy,0,-6.38984,-5.66,,-4.948301165009354
O=C1[C@H]2[C@@H](c3ccccc3O)[NH2+][C@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]2C(=O)N1c1ccc(Cl)cc1,C63472898_decoy2,TRY1,Decoy,0,-5.1531,-8.2,,-5.122871460715656
O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1)[C@](CC1=c3ccccc3=[NH+]C1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C63473071_decoy1,TRY1,Decoy,0,-6.30026,-7.91,,-5.581392051379355
O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)[C@](CC1=c3ccccc3=[NH+]C1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C63473071_decoy2,TRY1,Decoy,0,-6.16662,-6.8,,-5.265676193601627
O=C1[C@@H]2[C@@H](c3ccccc3O)[NH2+][C@@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]2C(=O)N1c1ccccc1,C63473072_decoy,TRY1,Decoy,0,-7.36812,-7.0,-1.8,-5.112001748305032
Cc1cccc(N2C(=O)[C@@H]3[C@@H](c4ccccc4O)[NH2+][C@@](CC4=c5ccccc5=[NH+]C4)(C(=O)[O-])[C@@H]3C2=O)c1,C63478220_decoy,TRY1,Decoy,0,-8.11742,-6.56,-1.07,-6.370489796966872
CO[C@]12CC[C@@]3(C[C@@H]1[C@@](C)(O)C(C)(C)C)[C@H]1[C@H](O)c4ccc(O)c5c4[C@@]3(CC[NH+]1CC1CC1)[C@H]2O5,C65742811_decoy,TRY1,Decoy,0,-7.37457,-5.42,-2.13,-4.934008980543345
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C04349022_decoy,TRY1,Decoy,0,-8.14315,-8.12,-2.09,-6.118682464593347
C[C@@H]1C[C@@H](O)[C@H](O)[C@H](Nc2ccccc2N[C@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]2O)O1,C04357686_decoy,TRY1,Decoy,0,-5.08571,-6.73,-1.53,-5.550453233963274
Nc1cc(=O)[nH]c(SCc2ccccc2CSc2nc(N)cc(=O)[nH]2)n1,C04422820_decoy,TRY1,Decoy,0,-8.91127,-7.26,-3.19,-7.620721707671661
O=C(O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1,C04544252_decoy,TRY1,Decoy,0,-10.5281,-8.08,-2.39,-7.832412785875923
NNC(=O)C(=O)N/N=C(/C[C@@]1(O)C(=O)Nc2ccccc21)c1ccc([N+](=O)[O-])cc1,C05808909_decoy,TRY1,Decoy,0,-7.65003,-9.01,-1.33,-8.753975373638221
OC[C@@H]1O[C@H](Oc2cc(O)cc(/C=C\c3ccc(O)cc3)c2)[C@H](O)[C@H](O)[C@@H]1O,C05923201_decoy,TRY1,Decoy,0,-7.63539,-7.29,-2.09,-7.457833974381383
C=CC[C@]1(COS(N)(=O)=O)O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O,C05459728_decoy,TRY1,Decoy,0,-7.4752,-7.43,-2.26,-7.994719535552721
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636778_decoy,TRY1,Decoy,0,-8.04324,-6.73,-0.71,-6.7062480934817135
Nc1ncnc2c1[nH]/c(=N\N=C\c1ccncc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C08837121_decoy,TRY1,Decoy,0,-7.56601,-8.34,-1.39,-8.033118671277364
Nc1ncnc2c1nc(N/N=C/c1ccccc1F)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975217_decoy,TRY1,Decoy,0,-7.46073,-7.43,0.01,-7.745683581559194
Nc1ncnc2c1nc(N/N=C/c1ccccn1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975233_decoy,TRY1,Decoy,0,-6.92128,-7.47,-1.54,-7.558865290796128
Nc1ncnc2c1nc(N/N=C/c1cccs1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740472_decoy,TRY1,Decoy,0,-7.36578,-7.56,-1.38,-8.035028848622442
Nc1ncnc2c1nc(N/N=C/c1ccc(O)cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004102_decoy,TRY1,Decoy,0,-7.23875,-8.29,-1.08,-8.171034125186004
Nc1nc(N/N=C/c2ccncc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C12405499_decoy,TRY1,Decoy,0,-7.4113,-7.51,-0.97,-6.635676745652814
Nc1ncnc2c1nc(N/N=C/c1cccs1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12320703_decoy,TRY1,Decoy,0,-6.67912,-8.09,-1.0,-8.173269644737426
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12660346_decoy,TRY1,Decoy,0,-7.69212,-8.12,-1.14,-8.322652225261686
Nc1ncnc2c1nc(N/N=C/c1ccccc1O)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12661545_decoy,TRY1,Decoy,0,-8.16884,-8.62,-1.39,-8.71967472485835
Nc1ncnc2c1[nH]/c(=N\N=C\c1cccnc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C09316563_decoy,TRY1,Decoy,0,-8.03904,-8.33,-1.33,-9.601121267333948
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)[C@@H]1/C=[NH+]/[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O,C13174111_decoy,TRY1,Decoy,0,-7.11365,-6.18,-3.91,-4.53449948771005
Nc1ncnc2c1nc(N/N=C/c1ccncc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740486_decoy,TRY1,Decoy,0,-7.46283,-7.74,-1.63,-7.976121966157385
Nc1ncnc2c1nc(N/N=C/c1ccc(O)cc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740506_decoy,TRY1,Decoy,0,-8.07239,-8.37,-2.83,-8.358248404427703
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c21,C14806658_decoy,TRY1,Decoy,0,-7.9407,-7.21,-1.73,-6.492106145106191
O=c1[nH]cnc2c1nc(N/N=C/c1ccccc1O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C16449061_decoy,TRY1,Decoy,0,-7.72413,-8.75,-2.81,-7.882207346723375
NNC(=S)N/N=C(/C(=O)Nc1cccc(O)c1)C1C(=O)NC(=S)NC1=O,C16958163_decoy,TRY1,Decoy,0,-8.02194,-7.52,-0.82,-7.533313239846923
NNC(=O)C(=O)N/N=C(\C[C@@]1(O)C(=O)Nc2ccccc21)c1ccc([N+](=O)[O-])cc1,C17176546_decoy,TRY1,Decoy,0,-7.55613,-8.29,-0.56,-8.09831150034455
NNC(=O)C(=O)N/N=C(\C[C@]1(O)C(=O)Nc2ccccc21)c1ccc([N+](=O)[O-])cc1,C17176547_decoy,TRY1,Decoy,0,-7.68994,-6.9,-1.29,-7.931766746711857
C[NH+]1CCN(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C19703293_decoy,TRY1,Decoy,0,-6.97224,-7.07,-1.7,-7.594650831327873
OC[C@H]1O[C@@H](OCc2ccccc2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C31169037_decoy,TRY1,Decoy,0,-3.87981,-6.58,-1.29,-4.4616807934260985
C[NH+]1CCN(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C34687845_decoy,TRY1,Decoy,0,-6.36535,-6.62,-1.84,-6.272577554021486
O=C(c1ccc(O)cc1)c1c(O)cc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O,C06092746_decoy,TRY1,Decoy,0,-8.48167,-8.35,-3.59,-7.286085335105237
O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,C03983877_decoy,TRY1,Decoy,0,-8.33862,-8.13,-2.19,-7.38613204534371
Nc1ncnc2c1nc(NNC=C1C=CC(=O)C=C1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01745740_decoy,TRY1,Decoy,0,-7.46681,-8.12,-2.71,-7.305845945923592
Nc1nc(SCC(=O)N2CCN(C(=O)CSc3n[nH]c(N)n3)CC2)n[nH]1,C10715882_decoy,TRY1,Decoy,0,-8.76986,-7.83,-1.63,-7.957953829504729
C/C(=N\N[C@@H]1Nc2c(N)ncnc2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O)[C@@H]1C=CC=N1,C39939235_decoy,TRY1,Decoy,0,-7.28255,-7.9,-0.89,-7.095323385964589
O=C1[NH+]=c2ccc(Cl)cc2=[NH+][C@H]1/C(=N\Nc1ccccc1)[C@H](O)[C@H](O)CO,C40151184_decoy,TRY1,Decoy,0,-8.63378,-7.27,-0.93,-6.619134240059093
CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41301884_decoy,TRY1,Decoy,0,-8.36499,-7.33,-2.53,-8.513145626253731
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C43465409_decoy,TRY1,Decoy,0,-7.19981,-7.8,-3.13,-5.201939165231852
OC[C@H]1O[C@@H](Oc2cc(O)cc(/C=C\c3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@H]1O,C44171077_decoy,TRY1,Decoy,0,-6.84558,-7.77,-1.07,-6.616353108761988
[H]/N=C1\O[C@@H](c2ccc(Cl)cc2Cl)C(=N/NC(N)=S)/C1=N/NC(N)=S,C25584872_decoy,TRY1,Decoy,0,-7.85345,-6.95,-1.99,-7.174801645765322
Nc1nc(N/N=C/c2ccncc2)nc2c1ncn2[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C49020551_decoy,TRY1,Decoy,0,-6.44374,-7.63,-1.35,-5.950724352905872
CC(C)=C[C@]1(O)C(=O)C(C)(C)[C@@H](O)C(C)(C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C49180888_decoy,TRY1,Decoy,0,-6.32409,-5.36,-4.12,-4.248389104611523
NC1=C(n2n[nH+]c(-c3n[nH]c(-c4ccncc4)n3)c2C[NH+]2CCCC2)NON1,C52604169_decoy,TRY1,Decoy,0,-7.16189,-8.77,-1.09,-7.210621665052428
OC[C@]1(/C=C/c2ccc(O)cc2)O[C@H](Oc2ccccc2)[C@@H](O)C(O)(O)[C@@H]1O,C12153623_decoy,TRY1,Decoy,0,-6.44077,-7.06,-1.05,-5.2812324615013
C[C@@H]1O[C@H](Nc2cccc(N[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@@H]3O)c2)[C@H](O)[C@H](O)[C@@H]1O,C05005318_decoy,TRY1,Decoy,0,-6.34188,-5.86,-2.45,-4.323682320596332
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c2cc1C,C04353344_decoy,TRY1,Decoy,0,-7.89984,-7.23,-1.96,-6.189720705170366
CC1=C(C(=O)N/N=C/c2ccccc2O)[C@@H](c2ccc(O)cc2O)NC(=S)N1,C59384986_decoy,TRY1,Decoy,0,-9.47526,-6.56,-0.47,-5.709193907060663
COc1ccc([C@H]2NN/C(=[NH+]\CCC3=c4cc(C)ccc4=[NH+]C3)N(N)C2=O)cc1,C63952582_decoy,TRY1,Decoy,0,-7.96926,-7.76,-1.26,-5.325302805304845
OC[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3ccccc3)O[C@@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C65748176_decoy,TRY1,Decoy,0,-5.07075,-7.05,-1.22,-5.765931035932428
OC[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3ccccc3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C65748179_decoy,TRY1,Decoy,0,-4.91159,-6.21,-2.94,-4.290093656881455
OC[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3ccccc3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C65748182_decoy,TRY1,Decoy,0,-5.77664,-6.82,-3.4,-5.141843243336487
NC(=O)CNC(=O)C1=C[C@@H](NC(=O)CC[NH3+])[C@@H](O)[C@H](O)C1,C03838817_decoy,TRY1,Decoy,0,-11.166,-6.58,-2.32,-9.91385064221489
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H]([NH3+])[C@H]1O,C04367070_decoy,TRY1,Decoy,0,-7.43939,-6.86,-0.44,-6.458215175763236
[NH2+]=C1NNC(=[NH2+])C1=NNc1cccc(C(F)(F)F)c1,C04477389_decoy,TRY1,Decoy,0,-9.34636,-8.37,-0.63,-10.980990661938202
[NH3+]CCCCCC(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C04523473_decoy,TRY1,Decoy,0,-6.57934,-5.08,-2.05,-5.3488485928455125
[NH3+]CCNc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C01733348_decoy,TRY1,Decoy,0,-7.43335,-6.32,-1.7,-6.890997343480564
[NH3+]CCNc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05217886_decoy,TRY1,Decoy,0,-8.91477,-6.18,-1.76,-7.958747435347993
CSCC[C@H]([NH3+])C(=O)NNC(=O)[C@@H]([NH3+])CC(C)C,C01606821_decoy,TRY1,Decoy,0,-8.89281,-5.93,-2.35,-8.203272711518276
CCCCN1C(=O)NC(=O)/C(=C(/C)NNC(N)=[NH2+])C1=O,C06398680_decoy,TRY1,Decoy,0,-8.85159,-6.98,-0.63,-12.122113597671897
NC(=O)OC[C@@H]1NC(=[NH2+])N2CCC(O)(O)[C@@]23NC(=[NH2+])N[C@@H]13,C08552277_decoy,TRY1,Decoy,0,-8.7985,-4.82,-3.07,-5.302278365463551
C[NH2+][C@@H]1[C@@H](O)[C@@H]([NH2+]C)[C@@H]2O[C@]3(O)C(=O)C[C@H](C)O[C@H]3O[C@@H]2[C@@H]1O,C11592792_decoy,TRY1,Decoy,0,-8.76879,-4.48,-1.67,-5.022282714250607
C[NH2+][C@@H]1[C@@H](O)[C@H]2O[C@@H]3O[C@@H](C)CC(=O)[C@@]3(O)O[C@H]2[C@H]([NH2+]C)[C@H]1O,C11592795_decoy,TRY1,Decoy,0,-8.40425,-7.25,-1.83,-8.123394137158845
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1[NH3+],C04822756_decoy,TRY1,Decoy,0,-6.28201,-7.37,0.14,-7.958239951644866
Nc1ncnc2c1ncn2[C@H]1O[C@@H](C[NH3+])[C@@H](O)[C@@H]1O,C04773850_decoy,TRY1,Decoy,0,-7.28276,-7.65,-1.58,-6.659248447236664
NC(=[NH2+])c1cn([C@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12,C17027516_decoy,TRY1,Decoy,0,-8.14966,-6.25,-1.23,-7.855013171018772
Nc1nc2c(ncn2[C@H]2C[C@H]([NH3+])[C@@H](CO)O2)c(=O)[nH]1,C06585348_decoy,TRY1,Decoy,0,-8.78638,-5.67,-0.72,-4.747518513942017
NC(=O)OC[C@H]1[NH+]=C(N)N2CCC(O)(O)[C@]23NC(N)=[NH+][C@H]13,C25723630_decoy,TRY1,Decoy,0,-8.06369,-4.35,-2.65,-4.045024018235898
OC[C@]1(O)C[C@H]([NH2+]Cc2cccnc2)[C@@H](O)[C@H](O)[C@@H]1O,C25993860_decoy,TRY1,Decoy,0,-7.74292,-6.74,-1.47,-6.913962167855373
CC1=C(N)C(=O)c2c(COC(N)=O)c3n(c2C1=O)C[C@H]([NH3+])C3,C26574764_decoy,TRY1,Decoy,0,-8.04038,-5.57,-0.16,-4.883020634161161
NC(=O)OC[C@H]1[NH+]=C(N)N2CCC(O)(O)[C@]23NC(N)=[NH+][C@@H]13,C28631733_decoy,TRY1,Decoy,0,-8.60516,-4.83,-0.73,-5.215284325436159
COC(=O)[C@]1(OC)C[C@H](O)[C@H]([NH3+])[C@H]([C@H](O)[C@H](O)CO)O1,C33881350_decoy,TRY1,Decoy,0,-6.2792,-4.8,-1.93,-4.624274511874549
C[C@H](C[NH3+])CN1CCC[NH+]([C@@H](C)C(=O)NC(N)=O)CC1,C37049249_decoy,TRY1,Decoy,0,-8.63277,-4.47,-1.41,-5.421510407244324
NC(=O)CN(Cc1nc(N)nc(N)n1)C1CC[NH2+]CC1,C37543076_decoy,TRY1,Decoy,0,-7.56541,-7.17,-2.01,-6.764860538626015
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[NH3+])[C@@H](O)[C@H]1O,C03814316_decoy,TRY1,Decoy,0,-6.3264,-5.14,-0.42,-3.6352898165017393
C[NH+]1CCN(CCCNC(=O)[C@H]([NH3+])CC(N)=O)CC1,C40808898_decoy,TRY1,Decoy,0,-8.53409,-5.6,-0.41,-7.742497849826711
NC(=O)c1c(N)sc2c1CC[NH+](C[C@@H](O)CO)C2,C41583078_decoy,TRY1,Decoy,0,-7.24201,-4.68,0.18,-4.6319959855560455
[NH3+][C@@H](CO)Cc1cccc2cccc([C@H](O)[C@H]([NH3+])CO)c12,C44466593_decoy,TRY1,Decoy,0,-10.336,-5.0,-1.87,-6.333785588786122
[NH3+][C@H](CO)CC(C[C@@H]([NH3+])CO)c1ccc2ccccc2n1,C44466710_decoy,TRY1,Decoy,0,-9.72986,-6.12,-0.67,-13.009754575709524
C[NH+](C)CC1CC[NH+](CCCC[C@@](C)([NH3+])C(N)=O)CC1,C45422119_decoy,TRY1,Decoy,0,-7.29101,-5.05,-1.12,-4.79795628668912
C[NH+](C)CC1CC[NH+](CCC[C@](C)([NH3+])C(N)=O)CC1,C45422132_decoy,TRY1,Decoy,0,-7.3752,-4.85,-3.21,-5.283865839745014
NC(=O)NC(=O)C[NH+](CC(=O)NC(N)=O)CC1CC1,C47614256_decoy,TRY1,Decoy,0,-6.7931,-5.81,-0.76,-6.107478093386591
C[C@@H](Cn1cc[nH+]c1)NC(=O)NC(C(N)=O)C(N)=O,C48449119_decoy,TRY1,Decoy,0,-6.58204,-6.29,-2.93,-6.770141445984441
CSCC[C@H]([NH3+])C(=O)NCCCC[C@@H]([NH3+])C(=O)[O-],C50027921_decoy,TRY1,Decoy,0,-8.18074,-4.37,-1.79,-5.08522408401426
CSCC[C@@H]([NH3+])C(=O)NCCCC[C@H]([NH3+])C(=O)[O-],C50028018_decoy,TRY1,Decoy,0,-7.79639,-4.63,-1.96,-5.251322193621535
NC(=O)CC[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094739_decoy,TRY1,Decoy,0,-8.84396,-5.29,-0.74,-4.621596902969577
CCc1[nH+]c(N)nc(N)c1-c1ccc(NCC[NH3+])c(N)c1,C13212469_decoy,TRY1,Decoy,0,-8.77238,-7.13,-1.19,-8.0108426426884
Cn1c(=O)c2c(nc(NC(N)=[NH2+])n2C[C@@H](O)CO)n(C)c1=O,C09090240_decoy,TRY1,Decoy,0,-7.7888,-5.39,-0.13,-5.888971224572576
Cc1cc(C)c(C[NH3+])c(N(CC(N)=O)CC(N)=O)[nH+]1,C61804239_decoy,TRY1,Decoy,0,-7.08123,-3.95,-1.74,-4.015101248931716
CC[C@H]([NH3+])[C@H](c1cnn(C)c1)N(CC(N)=O)CC(N)=O,C61804837_decoy,TRY1,Decoy,0,-6.41236,-3.94,-2.29,-4.68771089337065
CC[C@@H]([NH3+])[C@H](N(CC(N)=O)CC(N)=O)C(F)(F)F,C61805674_decoy,TRY1,Decoy,0,-7.65235,-3.91,-2.21,-5.100728750151642
CC[C@H]1CC[C@@H](C[NH3+])[C@H](N(CC(N)=O)CC(N)=O)C1,C61806158_decoy,TRY1,Decoy,0,-8.27302,-3.53,-1.2,-4.69132720851012
CC(C)([NH3+])c1noc(C[NH+](CC(N)=O)CC(N)=O)n1,C61807351_decoy,TRY1,Decoy,0,-7.1987,-4.64,-1.73,-4.718069218067565
NC(=O)CN(CC(N)=O)c1nc2sccn2c1C[NH3+],C61808350_decoy,TRY1,Decoy,0,-8.48152,-3.89,-1.74,-5.154719365342893
C[C@@H]1CC[C@H](C(=O)N(CC(N)=O)CC(N)=O)C[C@@H]1[NH3+],C61809752_decoy,TRY1,Decoy,0,-7.70706,-3.62,-1.44,-4.6064338160159926
C[C@@H]1CC[C@H]([NH3+])C[C@@H]1C(=O)N(CC(N)=O)CC(N)=O,C61809798_decoy,TRY1,Decoy,0,-7.77238,-5.27,-2.33,-5.483403617690807
C[C@H]1CC[C@@H]([NH3+])C[C@@H]1C(=O)N(CC(N)=O)CC(N)=O,C61809805_decoy,TRY1,Decoy,0,-8.47967,-3.95,-2.22,-4.765410691068933
C[C@H]1C[C@H]([NH3+])CC[C@@H]1C(=O)N(CC(N)=O)CC(N)=O,C61809829_decoy,TRY1,Decoy,0,-7.7162,-4.5,-2.4,-4.745677142393995
C[C@@H]1C[C@@H]([NH3+])CC[C@@H]1C(=O)N(CC(N)=O)CC(N)=O,C61809831_decoy,TRY1,Decoy,0,-8.28395,-4.71,-3.8,-5.693955939649016
C[C@H](CC(N)=O)C[C@H]([NH3+])c1ccc2[nH]c(=O)c(=O)[nH]c2c1,C61829459_decoy,TRY1,Decoy,0,-7.59534,-6.09,-2.84,-5.333387897955222
Nc1ncc(C[NH2+]CCNC(=O)c2nonc2N)cn1,C62717413_decoy,TRY1,Decoy,0,-6.86762,-7.38,-1.74,-8.1585297803252
CC[NH+](CC)[C@H]1CC[NH+](CCCC[C@](C)([NH3+])C(N)=O)C1,C62969088_decoy,TRY1,Decoy,0,-9.25971,-3.75,-1.63,-5.329107657739968
Nc1ncnc2c1[nH]/c(=N/N=C/c1ccc(O)cc1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01745747_decoy,TRY1,Decoy,0,-8.5772,-8.5,-0.98,-10.04939403048131
Nc1ncnc2c1[nH]/c(=N/N=C/c1cccc(O)c1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01825553_decoy,TRY1,Decoy,0,-8.29654,-8.56,-1.14,-8.030204632466491
Nc1[nH]c(=S)[nH]c(=O)c1C(c1ccccc1Cl)c1c(N)[nH]c(=S)[nH]c1=O,C04334667_decoy,TRY1,Decoy,0,-6.78054,-5.39,-1.04,-4.990445810525284
C[C@@H]1O[C@H](Nc2ccccc2N[C@@H]2O[C@@H](C)C[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C04357691_decoy,TRY1,Decoy,0,-5.64435,-6.65,-1.65,-5.003806933861936
O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C06041522_decoy,TRY1,Decoy,0,-7.64245,-8.67,-0.7,-6.839368032257508
Cc1cc2c(C(C)C)c(O)c(O)c3c2c(c1-c1c(C)cc2c(C(C)C)c(O)c(O)c4c2c1O[C@@H]4[NH3+])O[C@H]3[NH3+],C08782770_decoy,TRY1,Decoy,0,-8.65615,-7.21,-3.13,-6.636514837495878
Nc1ncnc2c1[nH]/c(=N\N=C\c1ccccc1O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C08818327_decoy,TRY1,Decoy,0,-7.80449,-8.15,-2.64,-6.8755040890633055
Nc1ncnc2c1nc(N/N=C/c1ccccc1O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08964844_decoy,TRY1,Decoy,0,-7.24352,-8.21,-1.38,-7.98786498206522
C[C@@H]1O[C@@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@@H]2c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C12153143_decoy,TRY1,Decoy,0,-7.75863,-9.11,-3.61,-7.950605215712323
Cc1cc2c(C(C)C)c(O)c(O)c3c2c(c1-c1c(C)cc2c(C(C)C)c(O)c(O)c4c2c1O[C@@H]4[NH3+])O[C@@H]3[NH3+],C12446858_decoy,TRY1,Decoy,0,-8.32805,-7.5,-1.71,-7.578283891981679
Cc1cc2c(C(C)C)c(O)c(O)c3c2c(c1-c1c(C)cc2c(C(C)C)c(O)c(O)c4c2c1O[C@H]4[NH3+])O[C@H]3[NH3+],C12446860_decoy,TRY1,Decoy,0,-8.14778,-7.04,-4.25,-6.345559633825027
Nc1ncnc2c1nc(N/N=C/c1ccccc1O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12661544_decoy,TRY1,Decoy,0,-8.18239,-8.27,-1.95,-8.371435538311895
CSc1nc(N)c2c3c(N)ncnc3n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05390124_decoy,TRY1,Decoy,0,-5.93104,-5.43,-0.43,-4.916604479511798
CSc1nc(N)c2c3c(N)ncnc3n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05390125_decoy,TRY1,Decoy,0,-6.497,-5.49,-2.58,-4.119617685907595
O=c1c(O[C@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C14684627_decoy,TRY1,Decoy,0,-7.8709,-8.81,-1.33,-7.417820357669053
Nc1[nH]c(=S)[nH]c(=O)c1C(c1cccs1)c1c(N)[nH]c(=S)[nH]c1=O,C17173014_decoy,TRY1,Decoy,0,-8.43391,-5.29,-0.18,-4.541503232659696
C[C@@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C14952515_decoy,TRY1,Decoy,0,-7.54237,-9.55,-1.55,-7.525465774007359
Oc1ccc([C@H]2Oc3cc(O[C@@H]4OC[C@H](O)[C@@H](O)[C@@H]4O)cc(O)c3C[C@@H]2O)cc1O,C26745309_decoy,TRY1,Decoy,0,-8.48212,-9.46,-4.84,-7.489004533943619
Nc1nc2c(nc(N/N=C/c3ccccc3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C33634387_decoy,TRY1,Decoy,0,-6.43966,-9.27,-2.65,-8.382186715386624
Nc1c(Br)cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1Br,C15083030_decoy,TRY1,Decoy,0,-7.95072,-5.14,-2.02,-4.9297320268099485
O=c1c(O[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C14684626_decoy,TRY1,Decoy,0,-7.6429,-9.04,-2.37,-8.240644255534875
O=C1c2c(O)cccc2[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21,C03977786_decoy,TRY1,Decoy,0,-7.74796,-5.62,-2.92,-6.072298380426711
O=C1c2c(O)cccc2[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21,C03977787_decoy,TRY1,Decoy,0,-6.8364,-9.06,-1.22,-8.962523611308514
O=C1c2c(O)cccc2[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C08674071_decoy,TRY1,Decoy,0,-7.09908,-2.21,-1.93,-3.3260758727093256
Cc1cccc(C)c1N1N[NH2+]N[C@H]1C1([NH2+]CCc2c(C)[nH]c3ccccc23)CCCCC1,C39211530_decoy,TRY1,Decoy,0,-6.86181,-6.58,-1.37,-5.100673958641975
Cc1cccc(C)c1N1N[NH2+]N[C@@H]1C1([NH2+]CCc2c(C)[nH]c3ccccc23)CCCCC1,C39211531_decoy,TRY1,Decoy,0,-7.89296,-6.32,-2.05,-5.5706989001770495
C[NH+]1CCN(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)CC1,C40756851_decoy,TRY1,Decoy,0,-8.23806,-4.8,-2.0,-5.331508671844499
CC1(C)CC(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)CC(C)(C)[NH2+]1,C40760706_decoy,TRY1,Decoy,0,-7.90649,-5.96,-1.57,-5.506818703014364
Cc1ccc2c(Nc3ncnc(NC4CC(C)(C)[NH2+]C(C)(C)C4)c3N)cccc2[nH+]1,C40760961_decoy,TRY1,Decoy,0,-8.33886,-7.48,-0.04,-10.531979606826646
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(O)c12,C43465424_decoy,TRY1,Decoy,0,-7.95508,-7.3,-2.28,-2.022488848912212
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(O)c12,C43465426_decoy,TRY1,Decoy,0,-7.49142,-7.72,-2.42,-1.997631305606928
CCO[C@@H](c1ccc(-n2c(C)cc(C[C@H]([NH3+])CO)c2C)cc1)[C@H]([NH3+])CO,C44464005_decoy,TRY1,Decoy,0,-8.85573,-6.48,-2.26,-6.255278996846399
CCO[C@H](c1ccc(-n2c(C)cc(C[C@H]([NH3+])CO)c2C)cc1)[C@H]([NH3+])CO,C44464006_decoy,TRY1,Decoy,0,-9.59774,-6.4,-1.43,-7.915594367870757
Nc1nc(N)nc(CCCCCCCCCCc2nc(N)nc(N)n2)n1,C34320365_decoy,TRY1,Decoy,0,-8.3991,-7.34,-2.92,-6.677848344175012
Nc1cc2cc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)ccc2c[nH+]1,C52627882_decoy,TRY1,Decoy,0,-11.2283,-8.06,-1.6,-7.748823709186229
Nc1[nH+]ccc2cc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)ccc12,C52627891_decoy,TRY1,Decoy,0,-10.7239,-9.34,-2.09,-8.761080590447886
COc1ccc([C@@H]2CC(=O)[NH+]=C3SC(N)=c4c(N)c(C#N)c(N)nc4=C32)cc1OC,C13122002_decoy1,TRY1,Decoy,0,-8.19024,-6.17,,-4.990059159132717
C/C(=N/NC1=N[C@H]2[NH+]=c3ccccc3=C2N=[NH+]1)[C@@H]1N[NH2+]N(c2nonc2N)[C@@H]1C,C39210763_decoy,TRY1,Decoy,0,-7.4559,-6.3,-1.76,-4.837924350776279
C/C(=N/NC1=N[C@H]2[NH+]=c3ccccc3=C2N=[NH+]1)[C@@H]1N[NH2+]N(c2nonc2N)[C@H]1C,C39210765_decoy,TRY1,Decoy,0,-6.94187,-9.44,-1.42,-6.921940190874907
C/C(=N/NC1=N[C@H]2[NH+]=c3ccccc3=C2N=[NH+]1)[C@H]1N[NH2+]N(c2nonc2N)[C@@H]1C,C39210767_decoy,TRY1,Decoy,0,-7.65455,-8.01,-1.49,-5.375929563097074
C/C(=N/NC1=N[C@H]2[NH+]=c3ccccc3=C2N=[NH+]1)[C@H]1N[NH2+]N(c2nonc2N)[C@H]1C,C39210768_decoy,TRY1,Decoy,0,-7.5421,-7.2,-2.02,-5.119888182176396
Cc1cccc(C)c1N1N[NH2+]N[C@@H]1C1([NH2+]CCC2=c3ccccc3=[NH+][C@@H]2C)CCCCC1,C63513938_decoy,TRY1,Decoy,0,-9.33682,-6.75,-1.98,-6.37503304632023
CN(CC[C@@H]1[NH+]=c2ccc(F)cc2=[NH+]1)C(=O)CN1N[NH2+]N[C@H]1C[NH+]1CCCC1,C64061341_decoy,TRY1,Decoy,0,-8.84193,-7.87,-3.02,-8.162635897676573
CN(CC[C@H]1[NH+]=c2ccc(F)cc2=[NH+]1)C(=O)CN1N[NH2+]N[C@H]1C[NH+]1CCCC1,C64061342_decoy,TRY1,Decoy,0,-7.828,-7.49,-2.58,-6.0439457565096095
Cc1cc2c(cc1C)=[NH+]C(CN(C)C(=O)CN1N[NH2+]N[C@H]1C[NH+]1CCCC1)[NH+]=2,C64622224_decoy,TRY1,Decoy,0,-7.62815,-6.7,-1.49,-6.243100405208839
Cc1cc2c(cc1C)=[NH+]C(CN(C)C(=O)CN1N[NH2+]N[C@@H]1C[NH+]1CCCC1)[NH+]=2,C64622225_decoy,TRY1,Decoy,0,-8.59796,-7.78,-0.56,-6.535176159313177
CN(CCC1[NH+]=c2ccccc2=[NH+]1)C(=O)CN1N[NH2+]N[C@H]1C[NH+]1CCCC1,C64626221_decoy,TRY1,Decoy,0,-8.26895,-7.54,-0.98,-6.371357335294656
CN(CCC1[NH+]=c2ccccc2=[NH+]1)C(=O)CN1N[NH2+]N[C@@H]1C[NH+]1CCCC1,C64626224_decoy,TRY1,Decoy,0,-8.30494,-7.26,-2.73,-6.772121928336425
CC(C)[NH+](C)C[C@@H]1N[NH2+]NN1CC(=O)N(C)CCC1[NH+]=c2ccccc2=[NH+]1,C64651209_decoy,TRY1,Decoy,0,-6.64253,-7.88,-3.09,-5.913083521265279
CC(C)[NH+](C)C[C@H]1N[NH2+]NN1CC(=O)N(C)CCC1[NH+]=c2ccccc2=[NH+]1,C64651210_decoy,TRY1,Decoy,0,-6.84184,-7.87,-1.99,-6.517176948547242
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@@H]1O,C03869383_decoy,TRY1,Decoy,0,-7.23507,-6.95,-0.81,-7.294536788411521
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@@H]1O,C03869384_decoy,TRY1,Decoy,0,-7.6841,-7.89,-1.08,-9.877250944972904
OC[C@@H]1O[C@H](Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)[C@@H](O)[C@H](O)[C@@H]1O,C03881961_decoy,TRY1,Decoy,0,-8.65945,-7.08,-1.45,-7.023098054498699
Nc1nc(N/N=C/C2CCCCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C03932652_decoy,TRY1,Decoy,0,-7.51187,-7.45,-1.35,-6.307450217228984
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]2(O)CO,C04098339_decoy,TRY1,Decoy,0,-8.13493,-5.79,-4.64,-5.464981867608756
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C04228232_decoy,TRY1,Decoy,0,-6.87477,-7.12,-0.93,-7.853775947777495
O=C(NCCCNC(=O)Nc1c[nH]c(=O)[nH]c1=O)Nc1c[nH]c(=O)[nH]c1=O,C04887298_decoy,TRY1,Decoy,0,-6.64303,-6.39,-2.05,-6.017690467811896
Nc1ncnc2c1nc(N/N=C/c1cccs1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636784_decoy,TRY1,Decoy,0,-7.81913,-7.61,-1.16,-7.6766630550207395
CC(=O)N[C@@]1(C)[C@@](C)([C@@H](O)[C@@H](O)C[NH3+])O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C09970240_decoy,TRY1,Decoy,0,-6.11616,-4.88,-2.72,-4.900367918627891
CC(=O)N[C@@]1(C)[C@](C)([C@@H](O)[C@@H](O)C[NH3+])O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C09970241_decoy,TRY1,Decoy,0,-4.89044,-5.03,-1.98,-4.257703778219064
CC(=O)N[C@@]1(C)[C@@](C)([C@H](O)[C@@H](O)C[NH3+])O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C09970242_decoy,TRY1,Decoy,0,-5.24591,-5.2,-1.48,-4.29997914230722
CC(=O)N[C@@]1(C)[C@](C)([C@H](O)[C@@H](O)C[NH3+])O[C@@](O)(C(=O)[O-])C(C)(C)[C@@]1(C)O,C09970243_decoy,TRY1,Decoy,0,-5.61273,-4.42,-1.62,-3.708911448297593
Nc1ncnc2c1nc(N/N=C/c1ccccc1F)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975219_decoy,TRY1,Decoy,0,-7.90383,-8.28,-0.95,-8.232476795895789
Nc1ncnc2c1nc(N/N=C/c1ccccn1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975236_decoy,TRY1,Decoy,0,-7.93358,-8.22,-1.52,-9.551217236109975
O=c1[nH]nc(Sc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C11582476_decoy,TRY1,Decoy,0,-7.47529,-7.54,-1.19,-6.857010524854741
O=c1[nH]nc(Sc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C11582477_decoy,TRY1,Decoy,0,-6.85586,-8.21,-0.55,-7.318300997107721
O=C1c2cc(CO)cc(O)c2C(=O)c2c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cccc21,C12375030_decoy,TRY1,Decoy,0,-7.66083,-7.55,-1.09,-5.05083061509721
Nc1ncnc2c1[nH]/c(=N/N=C\c1cccc([N+](=O)[O-])c1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01757140_decoy,TRY1,Decoy,0,-6.1917,-8.21,-1.27,-7.004314397007118
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C13424713_decoy,TRY1,Decoy,0,-8.53031,-8.01,-1.49,-5.456993040798477
Nc1ncnc2c1nc(N/N=C/c1ccco1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08637257_decoy,TRY1,Decoy,0,-7.49022,-7.62,-0.93,-7.255807897592999
COC(=O)C1=CO[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1C=C[C@@]2(O)CO,C13660246_decoy,TRY1,Decoy,0,-6.53458,-5.53,-3.7,-4.725293030195433
CC(=O)N[C@H](C(=O)NC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O)C(C)(C)SN=O,C22059695_decoy,TRY1,Decoy,0,-6.50945,-5.38,-1.42,-5.567931436090225
CO[C@]1(C)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@H](CO)[C@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C22066585_decoy,TRY1,Decoy,0,-6.61213,-5.93,-2.14,-4.831099167071053
CO[C@]1(C)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@H](CO)[C@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C22066591_decoy,TRY1,Decoy,0,-5.12109,-5.52,-2.08,-3.9187202818585214
Cc1nnc(N/N=C/c2ccc(O)cc2O)nc1N/N=C/c1ccc(O)cc1O,C27994440_decoy,TRY1,Decoy,0,-9.10417,-9.33,-0.6,-8.161372291919895
OC[C@H]1O[C@@H](Oc2ccc(/C=C/c3cc(O)cc(O)c3)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C31159448_decoy,TRY1,Decoy,0,-8.05233,-8.73,-2.9,-5.797270206828416
CNC(=O)NCCNC(=O)[C@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)[C@@H](O)[C@@H]1O,C17121490_decoy,TRY1,Decoy,0,-6.20348,-7.83,-1.62,-7.629806538912889
CC(=O)N[C@@H](C(=O)NC[C@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C33782165_decoy,TRY1,Decoy,0,-6.01183,-6.22,-2.87,-4.978465604943485
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C33821013_decoy,TRY1,Decoy,0,-6.62448,-6.75,-3.63,-6.52463566813443
C[NH+]1CCN(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C34687846_decoy,TRY1,Decoy,0,-6.93935,-4.6,-1.04,-4.705552318586947
CO[C@]1(C)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@H](CO)[C@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C35653161_decoy,TRY1,Decoy,0,-6.28345,-5.39,-2.14,-4.777979194937002
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n([C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c2cc1C,C36056875_decoy,TRY1,Decoy,0,-7.69193,-5.99,-1.67,-6.448771763013712
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CSCC[C@@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C13509082_decoy,TRY1,Decoy,0,-6.45332,-6.92,-1.1,-7.237220742610073
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21,C04097896_decoy,TRY1,Decoy,0,-8.44231,-8.26,-3.4,-7.570299438243826
COC(=O)C1=CO[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]2[C@@H]1C=C[C@]2(O)CO,C35456923_decoy,TRY1,Decoy,0,-6.91297,-6.37,-1.34,-6.489598061593208
O=c1c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)coc2cc(O)cc(O)c12,C04136964_decoy,TRY1,Decoy,0,-7.93509,-8.94,-2.72,-5.6508154707925655
C[NH+]1CCN(N[C@@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)CC1,C38549881_decoy,TRY1,Decoy,0,-6.28255,-7.02,-1.07,-6.398684105227954
C/C(=N\NC(N)=O)c1sc(-c2nc(C)c(/C(C)=N/NC(N)=O)s2)nc1C,C16957798_decoy,TRY1,Decoy,0,-8.88578,-5.26,-2.22,-5.978826024456801
C[NH+]1CCN(Nc2[nH+]cnc(Nc3ccc(Br)cn3)c2N)CC1,C40756873_decoy,TRY1,Decoy,0,-7.80409,-5.04,-2.37,-4.610959787272302
CC(=O)O[C@@]1(C)C[C@@H](O)[C@@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]21,C43743065_decoy,TRY1,Decoy,0,-6.44652,-5.42,-4.32,-4.893396975231284
CO[C@]1(C)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C44028875_decoy,TRY1,Decoy,0,-6.18428,-6.24,-2.2,-5.174539000101827
CO[C@]1(C)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C44028878_decoy,TRY1,Decoy,0,-6.00375,-5.82,-2.42,-4.721104799326173
CC1(C)S[C@@H]2[C@H](NC(=O)[C@H]([NH3+])c3ccc(N)cc3)C(=O)N2[C@H]1c1nnn[n-]1,C44123052_decoy,TRY1,Decoy,0,-7.74369,-5.41,-1.94,-5.674542309945215
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C01532516_decoy,TRY1,Decoy,0,-7.41383,-7.25,-2.41,-7.239897922498419
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C45789230_decoy,TRY1,Decoy,0,-8.40598,-6.92,-1.4,-7.751152181546185
Nc1ncnc2c1ncn2[C@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])[C@H](O)[C@@H]1O,C45789233_decoy,TRY1,Decoy,0,-7.52529,-6.9,-1.12,-6.322587631010626
OC[C@]1(/C=C/c2ccc(O)cc2)O[C@H](Oc2ccccc2)[C@H](O)C(O)(O)[C@@H]1O,C56956023_decoy,TRY1,Decoy,0,-5.70778,-8.5,-1.7,-6.098078120838911
C/C(=N\N=C(/C)c1sc(N)c(C(N)=O)c1C)c1sc(N)c(C(N)=O)c1C,C59466274_decoy,TRY1,Decoy,0,-8.65062,-5.42,-1.95,-9.65935504591039
CO[C@]1(C)OC[C@H]2O[C@@H](O[C@@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C65748744_decoy,TRY1,Decoy,0,-5.19143,-4.53,-1.63,-4.947873628014353
CO[C@]1(C)OC[C@@H]2O[C@@H](O[C@@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O1,C65748747_decoy,TRY1,Decoy,0,-5.21091,-6.41,-1.26,-4.499777984308865
O=C(Nc1c2c(nn1-c1cccc(Cl)c1)C[S@@+]([O-])C2)c1ccc(S(=O)(=O)N2CCOCC2)cc1,C06208146_decoy,TRY1,Decoy,0,-9.53923,-6.31,-1.28,-6.137387899058087
Cc1cc(F)ccc1S(=O)(=O)NC[C@H](c1cccnc1)S(=O)(=O)c1ccc2c(c1)OCCO2,C09044036_decoy,TRY1,Decoy,0,-9.45074,-5.93,-2.9,-6.038140668003308
CN(C)c1ccc([C@H](CNC(=O)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)S(=O)(=O)c2ccc(F)cc2)cc1,C09080730_decoy,TRY1,Decoy,0,-10.5,-7.75,-2.9,-9.449897935869709
COc1ccc(N2CCN(C(=O)C[C@H](C)S(=O)(=O)c3ccc4c(c3)NC(=O)CS4)CC2)cc1,C09152720_decoy,TRY1,Decoy,0,-10.3772,-8.51,-3.51,-7.7389892233065405
Cc1c(C#N)c(NC(=O)CSc2nnc([C@@H]3CCS(=O)(=O)C3)n2C)n(C[C@H]2CCCO2)c1C,C09257833_decoy,TRY1,Decoy,0,-8.74314,-7.57,-3.17,-6.304203208232727
COC(=O)c1c(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)sc2c1CCN(C(=O)OC)C2,C09325169_decoy,TRY1,Decoy,0,-8.46387,-7.55,-1.35,-6.231390772903883
Cc1cc(/C=C(\C#N)C(=O)Nc2ccccn2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1,C09465343_decoy,TRY1,Decoy,0,-7.68541,-8.04,-2.18,-7.07662499904375
O=C(Nc1nc(CC(=O)N2CCC3(CC2)OCCO3)cs1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1,C09699314_decoy,TRY1,Decoy,0,-10.0326,-6.46,-1.13,-5.919507549713754
O=C(Cc1c(F)cccc1F)N1CCC([C@@]2(c3cccnc3)NC(=O)N(C[C@@H]3CCCO3)C2=O)CC1,C12155323_decoy,TRY1,Decoy,0,-8.40444,-8.9,-1.78,-6.500024780280672
COc1cc(=O)n2c(c1C(=O)N(C)Cc1cscn1)CCN(C(=O)c1cc(CC(C)C)n[nH]1)CC2,C12242466_decoy,TRY1,Decoy,0,-7.50642,-5.36,-1.4,-5.150650751640282
O=C(COC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)NC(=O)c1cccc([N+](=O)[O-])c1,C03378914_decoy,TRY1,Decoy,0,-7.82075,-8.16,-2.23,-6.594852715392094
Cc1nc(C)c(CCC(=O)N2CCN(S(=O)(=O)c3ccc(OC(F)(F)F)cc3)CC2)c(=O)[nH]1,C12790686_decoy,TRY1,Decoy,0,-7.69238,-7.49,-3.55,-6.751232389121684
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2cnc3c(c2)c(C)nn3C)c1,C12509003_decoy,TRY1,Decoy,0,-8.55872,-6.21,-1.81,-6.114493895979428
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O,C12978905_decoy,TRY1,Decoy,0,-8.45529,-9.12,-2.55,-8.151042158776841
Cc1nn(C)c2ncc(C(=O)Nc3cc(S(=O)(=O)N4CCCCC4)ccc3N3CCOCC3)cc12,C12558225_decoy,TRY1,Decoy,0,-9.16079,-8.24,-2.42,-6.5578713294497
COc1ccc(CNC(=O)c2nn(Cc3ccccn3)c3c2CN(C(=O)c2cncs2)CC3)cc1,C14749519_decoy,TRY1,Decoy,0,-9.24136,-8.23,-2.22,-7.355057463338904
Cn1ccc(CC(=O)N2CCc3c(c(C(=O)N4CCNC(=O)CC4)nn3CCc3ccccc3)C2)c1,C14749844_decoy,TRY1,Decoy,0,-7.79314,-7.85,-3.64,-7.276247656844442
O=C(CS(=O)(=O)c1ccc(F)cc1)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1,C15391531_decoy,TRY1,Decoy,0,-8.23992,-8.31,-2.63,-8.611423109583507
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(-c3ccco3)cc(C(=O)NCc3ccc4c(c3)OCO4)c12,C16993067_decoy,TRY1,Decoy,0,-8.21272,-8.27,-1.67,-5.845484621378118
COc1cc([C@@H]2c3cc4c(cc3[C@H](NS(C)(=O)=O)[C@@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1OC,C17192151_decoy,TRY1,Decoy,0,-8.14542,-5.33,-2.1,-5.777128535139479
O=C(NCCN1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)CC1)c1ccc2c(c1)OCO2,C20891330_decoy,TRY1,Decoy,0,-9.66253,-8.25,-2.56,-6.174345914997751
CC(=O)Nc1sc2c(c1C(=O)OCC(=O)c1cc(C)n([C@@H]3CCS(=O)(=O)C3)c1C)CCCC2,C21373247_decoy,TRY1,Decoy,0,-9.96755,-7.79,-1.05,-6.542204719470711
Cc1nn(CC(=O)N2CCCC2)c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(F)cc2)C1,C21717456_decoy,TRY1,Decoy,0,-8.39701,-8.38,-2.01,-6.382761998774378
Cc1cc(C(=O)CN2C(=O)N[C@@]3(CCSC3)C2=O)c(C)n1-c1c(C)n(C)n(-c2ccccc2)c1=O,C22612946_decoy,TRY1,Decoy,0,-8.00093,-7.81,-0.99,-5.783566778776757
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1,C22978984_decoy,TRY1,Decoy,0,-6.50117,-5.88,-3.96,-4.502582962180626
COc1cc(Cl)c(CN2CCc3nnc([C@H](NC(=O)[C@@H]4CCOC4)C(C)C)n3CC2)cc1OC,C23128769_decoy,TRY1,Decoy,0,-9.06368,-7.23,-1.2,-6.120753918961443
COc1ccccc1C[C@@]1(C)NC(=O)N(CN2CCN(S(=O)(=O)c3ccccc3C#N)CC2)C1=O,C23408568_decoy,TRY1,Decoy,0,-7.12414,-8.56,-2.5,-5.759647004836976
Cc1noc(C)c1S(=O)(=O)N1CCN(CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)CC1,C23967608_decoy,TRY1,Decoy,0,-8.37344,-8.02,-1.66,-6.6125635182270415
O=C1N[C@H](C(=O)N2CCN(S(=O)(=O)N3CCCCCC3)CC2)CS[C@H]1Cc1ccc(F)cc1,C25668019_decoy,TRY1,Decoy,0,-9.01888,-7.37,-1.92,-5.95048000736131
Cc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)CNC(=O)c3ccccc3F)CC2)c(C)c1,C32910271_decoy,TRY1,Decoy,0,-9.53714,-8.36,-3.01,-9.70152420473072
Cc1nc2scc(CC(=O)NCCN3CCOCC3)n2c(=O)c1-c1cc(C)n(-c2ccccc2)n1,C35573611_decoy,TRY1,Decoy,0,-8.32413,-5.62,-3.98,-5.004769784115341
C[C@H](C(=O)NCCN1CCOCC1)N1C(=O)COc2ccc(C(=O)COc3ccc(F)cc3)cc21,C35795776_decoy,TRY1,Decoy,0,-8.40622,-7.72,-2.36,-7.062505920321959
CC1(C)C(=O)Nc2ccccc2N1C(=O)COC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F,C03419759_decoy,TRY1,Decoy,0,-5.89586,-7.93,-2.95,-4.9248933220963895
O=C1CN(C(=O)COC(=O)/C=C/c2ccc(S(=O)(=O)N3CCOCC3)cc2)c2ccccc2N1,C02622131_decoy,TRY1,Decoy,0,-8.3317,-8.94,-1.49,-6.898798892627611
CCn1c(N2CC[NH+](CC)CC2)c(/C=C2\SC(=S)N(CCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33812505_decoy,TRY1,Decoy,0,-7.71657,-7.34,-4.55,-6.627774490663009
CCc1n[nH]c(SCC(=O)c2cc(C)n(-c3cccc(S(=O)(=O)N4CCOCC4)c3)c2C)n1,C14803117_decoy,TRY1,Decoy,0,-8.00183,-6.49,-3.36,-6.103882160585503
CC1(C)C[C@]2(C[C@](C)(C(=O)CSc3nc(-c4ccccc4Br)n[nH]3)OC2=O)C(=O)O1,C02425747_decoy,TRY1,Decoy,0,-8.98307,-5.94,-2.12,-5.748974560022867
CSc1cnc2c3c(n(S(=O)(=O)c4ccccc4)c(=O)c2c1)C(=O)C[C@@H](S(=O)(=O)C(C)C)N3,C39452382_decoy,TRY1,Decoy,0,-9.5751,-7.9,-4.51,-9.815347541779971
CS[P@]1(=O)NN2CCc3cc(S(=O)(=O)C(C)C)c(S(=O)(=O)c4ccccc4)cc3[C@@H]2CO1,C39465165_decoy,TRY1,Decoy,0,-6.02974,-6.69,-2.62,-5.310659151366773
Cc1ccc2nc(NC[C@@H]3CCCO3)c(/C=C3/SC(=S)N(C[C@H]4CCCO4)C3=O)c(=O)n2c1,C39729181_decoy,TRY1,Decoy,0,-8.09721,-7.36,-1.96,-5.890378684329235
CCOCCCNC(=O)C1CCN(S(=O)(=O)c2cc3c(cc2Br)CCN3C(=O)CC)CC1,C40450854_decoy,TRY1,Decoy,0,-8.38668,-5.87,-3.71,-5.23980089267962
[H]/N=C1C(=C/c2cn(CCOc3ccccc3)c3ccccc23)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C41083941_decoy,TRY1,Decoy,0,-8.08577,-7.56,-3.25,-6.070292466250718
COc1cc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CC[NH+]2CCCC2)cc(OC)c1OC,C41544322_decoy,TRY1,Decoy,0,-8.65352,-5.97,-3.75,-6.0505064837630655
CC[NH+](CC)c1ccc(CN(C(=O)c2nc(S(C)(=O)=O)ncc2Cl)[C@@H]2CCS(=O)(=O)C2)cc1,C54421882_decoy,TRY1,Decoy,0,-7.91916,-6.36,-4.3,-5.746404682873407
COC(=O)c1c(NC(=O)CCN2C(=O)[C@@H]3CC[C@](C)(C2=O)C3(C)C)sc2c1[C@@H](C(=O)OC)CC2,C54647556_decoy,TRY1,Decoy,0,-8.69871,-5.75,-2.6,-5.563204195177681
Cc1ccc(-c2cc(C(=O)NCCCN3CCOCC3)c3c(C)nn([C@@H]4CCS(=O)(=O)C4)c3n2)cc1,C57310768_decoy,TRY1,Decoy,0,-9.57324,-8.35,-1.56,-7.99411150025252
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(-c3ccccc3F)cc(C(=O)NCCCN3CCCC3=O)c12,C57310902_decoy,TRY1,Decoy,0,-9.06618,-8.91,-1.67,-9.384207068205871
[H]/N=C1C(=C\c2ccc(OC(=O)c3ccco3)c(Cl)c2)\C(=O)N=C2SN=C(S(=O)(=O)C(C)C)N2\1,C20207422_decoy,TRY1,Decoy,0,-7.69021,-5.02,-2.41,-3.9862146193983112
CC1=C2C(=O)N=C(CS[C@H](C)C(=O)OCC(=O)[C@H](C#N)c3nc4ccccc4[nH]3)N=C2S[C@H]1C,C63879184_decoy,TRY1,Decoy,0,-9.82014,-8.86,-3.41,-9.017966601457111
Cc1nc(-c2cc(S(=O)(=O)NCc3ccc(F)cc3)c(C)n2C)sc1C(=O)N1CCOCC1,C65036114_decoy,TRY1,Decoy,0,-10.3413,-7.84,-2.75,-6.573192396575981
COCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N([C@@H]2CCS(=O)(=O)C2)C1=O,C02825053_decoy,TRY1,Decoy,0,-7.16913,-7.12,-2.32,-5.098611710234263
COc1ccc(S(=O)(=O)N(Cc2cc3cc4c(cc3[nH]c2=O)OCCO4)C[C@H]2CCCO2)cc1,C06239910_decoy,TRY1,Decoy,0,-8.24018,-7.94,-1.2,-7.324621891405925
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(NC[C@@H]3CCCO3)nc12,C02585346_decoy,TRY1,Decoy,0,-9.4497,-7.98,-2.87,-7.536778824263426
CN(CCc1ccncc1)C(=O)C(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1,C09006389_decoy,TRY1,Decoy,0,-8.62024,-8.13,-2.47,-8.442756702581947
O=S(=O)(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(Cl)c1,C09044250_decoy,TRY1,Decoy,0,-9.11083,-8.15,-2.44,-7.862214872050598
O=C(COc1ccc(Cl)cc1)NC[C@H](c1cccnc1)S(=O)(=O)c1ccc2c(c1)OCCO2,C09044593_decoy,TRY1,Decoy,0,-8.95528,-7.47,-1.43,-7.071497117972345
CN(C)c1ccc([C@H](CNS(=O)(=O)C2=CCS(=O)(=O)C2)S(=O)(=O)c2ccc(Cl)cc2)cc1,C09080810_decoy,TRY1,Decoy,0,-10.1567,-7.2,-1.99,-6.840720606345064
O=C([O-])/C=C/c1ccc(S(=O)(=O)N2CC[NH+](CCN3C(=O)[C@@H]4[C@H](C3=O)[C@@H]3C=C[C@H]4C3)CC2)cc1,C09090654_decoy,TRY1,Decoy,0,-8.55388,-7.99,-2.37,-6.559031713705132
CCS(=O)(=O)N1CCN(S(=O)(=O)CCNC(=O)c2cc(Br)ccc2Cl)CC1,C10705927_decoy,TRY1,Decoy,0,-9.60293,-6.79,-3.65,-6.811192170366051
CS(=O)(=O)N1CCCc2ccc(NS(=O)(=O)c3ccc(N4C(=O)CCS4(=O)=O)cc3)cc21,C11904107_decoy,TRY1,Decoy,0,-8.82861,-5.87,-3.03,-5.181107705395814
C[C@@H]1CN(C(=O)CSc2nnc(NC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)s2)C[C@H](C)O1,C12224508_decoy,TRY1,Decoy,0,-10.1277,-8.47,-1.63,-6.96776783050991
O=C(CCCN1C(=O)NC2(CCCC2)C1=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1,C12688471_decoy,TRY1,Decoy,0,-9.00981,-7.41,-1.85,-7.420541536448264
Cc1c(NC(=O)[C@H](C)Sc2nnc(C[C@@H]3CCS(=O)(=O)C3)o2)c(=O)n(-c2ccccc2)n1C,C12978234_decoy,TRY1,Decoy,0,-9.27792,-7.35,-1.71,-6.613341163786174
O=C(NCc1ccco1)[C@@H](c1ccncc1)N(Cc1cccs1)C(=O)Cn1nnc2ccccc21,C01376180_decoy,TRY1,Decoy,0,-7.48501,-6.6,-2.07,-5.6929400100439045
COc1ccccc1/C=C1\SC(=O)N(CCC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)C1=O,C01298798_decoy,TRY1,Decoy,0,-8.38984,-6.37,-2.81,-6.13256197186599
O=C(COC(=O)[C@H]1CC(=O)N(NC(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccc(Br)cc1,C13856674_decoy,TRY1,Decoy,0,-8.8843,-7.93,-1.08,-6.7552438070285765
CC(C)Oc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)[C@@H]1CC(=O)N(C)c2ccccc21,C14018605_decoy,TRY1,Decoy,0,-7.89312,-7.07,-3.63,-6.059375210745698
COCCN1C(=O)N[C@](Cc2ccc(F)cc2)(C2CCN(C(=O)Cc3c(C)noc3C)CC2)C1=O,C14951963_decoy,TRY1,Decoy,0,-8.12485,-6.9,-1.85,-6.375970928158254
COC(=O)c1c(S(=O)(=O)NCc2ccccc2F)sc2c1CCN(C(=O)c1ccnn1C)C2,C14992346_decoy,TRY1,Decoy,0,-8.66977,-7.39,-1.44,-6.803390859955164
[H]/N=C1C(=C\c2ccc(OS(C)(=O)=O)c(OC)c2)/C(=O)N=C2SC([C@@H](CC)c3ccccc3)=NN2/1,C16266668_decoy,TRY1,Decoy,0,-9.09322,-5.87,-1.99,-6.116611054773139
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)CSc1nc(C(F)(F)F)nc2ccccc12,C19354841_decoy,TRY1,Decoy,0,-8.60141,-7.76,-2.41,-10.329530118936669
CCc1nnc(NC(=O)CSc2nc(-c3ccc(F)cc3)nc3c2c(=O)n(C)c(=O)n3C)s1,C20289811_decoy,TRY1,Decoy,0,-9.63873,-8.57,-1.12,-8.246851299194152
COc1ccc(N2C[C@H](C(=O)Nc3nnc([C@H]4CC(=O)N(c5ccc(F)cc5)C4)s3)CC2=O)cc1,C20584164_decoy,TRY1,Decoy,0,-9.65093,-6.63,-2.13,-6.243751189792163
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)OCC(=O)NC3(C#N)CCCC3)c12,C21441791_decoy,TRY1,Decoy,0,-9.36061,-7.37,-1.97,-6.278581971447341
COCCNC(=O)CSc1nnc(N2CCN(C(=O)c3ccc(Br)o3)CC2)s1,C23141886_decoy,TRY1,Decoy,0,-9.53054,-5.15,-2.25,-5.655673793000069
Cn1ccnc1[C@@H](NS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1F,C24584614_decoy,TRY1,Decoy,0,-8.88242,-7.69,-4.48,-6.5535335855849794
O=C1N[C@H](C(=O)N2CCN(S(=O)(=O)N3CCCCCC3)CC2)CS[C@@H]1Cc1ccc(F)cc1,C25668027_decoy,TRY1,Decoy,0,-9.18529,-7.14,-2.38,-6.300779082263424
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCN(C[C@@H](O)c2ccc(F)cc2)CC1,C32900826_decoy,TRY1,Decoy,0,-8.42563,-6.29,-4.84,-8.322760569946325
CCCN1CCN(C(=O)[C@H]2CCCN(C(=O)c3nnc(C(=O)Nc4ccc(C)cc4)s3)C2)CC1,C33263263_decoy,TRY1,Decoy,0,-8.669,-9.18,-1.15,-6.738061361675332
CCn1c(N2CCN(CCO)CC2)c(/C=C2\SC(=S)N(CC(C)C)C2=O)c(C)c(C#N)c1=O,C33468054_decoy,TRY1,Decoy,0,-7.93397,-5.94,-2.67,-6.043522445399085
COCCNC(=O)[C@@H]1COC2(CCN(C(=O)c3ccccc3F)CC2)N1C(=O)c1cccc(F)c1,C35989920_decoy,TRY1,Decoy,0,-8.39598,-7.3,-1.63,-6.12597927209465
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c1,C15316267_decoy,TRY1,Decoy,0,-9.15604,-6.61,-3.21,-7.374188637602183
CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N1CCN(S(=O)(=O)c4ccccc4[N+](=O)[O-])CC1)(C3)C2,C26940885_decoy,TRY1,Decoy,0,-7.72412,-6.92,-4.39,-5.687867359435767
CCC1(CC)NC(=O)N(CC(=O)N2CCN(c3cnn(-c4ccccc4)c(=O)c3Cl)CC2)C1=O,C36674620_decoy,TRY1,Decoy,0,-8.77946,-6.54,-2.24,-5.570108030450651
CC(C)S(=O)(=O)c1cc2c(cc1F)[C@@H]1CO[P@@](=O)(S(=O)(=O)Oc3ccccc3)NN1CC2,C39466041_decoy,TRY1,Decoy,0,-7.75805,-6.48,-3.34,-5.132557548010708
[H]/N=C1C(=C/c2ccc(OS(=O)(=O)c3ccc(C)cc3)cc2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077833_decoy,TRY1,Decoy,0,-8.31076,-7.6,-2.55,-5.585021995406193
CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1,C45561381_decoy,TRY1,Decoy,0,-7.85328,-5.82,-2.48,-5.450352232030917
COCCN1CCN(C(=O)[C@@H]2Cc3cn(Cc4nccn4C)c4cccc(c34)[C@H](CC(C)C)N2)CC1,C49171782_decoy,TRY1,Decoy,0,-9.73282,-6.25,-1.86,-7.020570856169724
COCCNC(=O)CSc1nnc(N2CCN(C(=O)c3cc(=O)c4ccccc4o3)CC2)s1,C49369940_decoy,TRY1,Decoy,0,-8.23332,-6.95,-1.38,-5.786461414763089
COc1ccc2[nH]c(=O)c(CN(Cc3cccnc3)Cc3nnnn3Cc3ccc(F)cc3)cc2c1,C01372865_decoy,TRY1,Decoy,0,-9.14626,-6.94,-1.82,-6.526883714505723
[H]/N=C1C(=C/c2c(-c3ccccc3)nc3sccn23)\C(=O)N=C2SN=C(S(=O)(=O)CC(C)C)N2\1,C06079852_decoy,TRY1,Decoy,0,-9.74115,-6.68,-1.47,-6.719381000447451
COCCNC(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1,C57308455_decoy,TRY1,Decoy,0,-9.64233,-5.95,-1.24,-5.640542591023024
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(-c3ccccc3F)cc(C(=O)NCCCN3CCCC3=O)c12,C57310900_decoy,TRY1,Decoy,0,-8.99922,-7.65,-2.05,-6.279380928040922
Cc1cccc2cc(CN(Cc3ccc4c(c3)OCO4)Cc3nnnn3C[C@@H]3CCCO3)c(=O)[nH]c12,C57607253_decoy,TRY1,Decoy,0,-9.11097,-6.21,-0.88,-6.401794109420604
[H]/N=C1C(=C\c2ccc(OCc3cc(=O)n4nc(CC)sc4n3)cc2)/C(=O)N=C2SC(CC(C)C)=NN2/1,C13574694_decoy,TRY1,Decoy,0,-10.3546,-8.21,-3.37,-8.173954664066388
CC(=O)Nc1nnc(S(=O)(=O)N2CCN(CC(=O)c3cc(C)n(C4CCCC4)c3C)CC2)s1,C62694014_decoy,TRY1,Decoy,0,-9.29167,-6.19,-4.24,-5.605226097996561
[H]/N=C1C(=C\c2ccc(OS(C)(=O)=O)c(Cl)c2)\C(=O)N=C2SN=C(S(=O)(=O)C(C)C)N2\1,C20207426_decoy,TRY1,Decoy,0,-8.70037,-6.73,-1.83,-5.33828150230105
[H]/N=C1C(=C/c2ccc(OCc3ccccc3C)c(OC)c2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C41084041_decoy,TRY1,Decoy,0,-7.13741,-6.49,-3.49,-5.931823734509548
[H]/N=C1C(=C\c2ccc(OC(=O)c3cccs3)c(OC)c2)/C(=O)N=C2SC(N3CCOCC3)=NN2/1,C20356633_decoy,TRY1,Decoy,0,-7.7676,-6.35,-2.31,-5.233982256383577
O=C1N=C(CN2CCN(C(=O)CNC(=O)[C@@H]3CC=CO3)CC2)N=C2SCC(c3cccs3)=C12,C64050330_decoy,TRY1,Decoy,0,-8.99428,-8.51,-1.97,-6.821287163985589
COc1ccc([C@H](CNS(=O)(=O)[C@H]2CCS(=O)(=O)C2)S(=O)(=O)c2cccs2)cc1,C08968550_decoy,TRY1,Decoy,0,-9.30214,-7.63,-3.47,-9.696198970763804
Cc1ccc(S(=O)(=O)[C@H](CNS(=O)(=O)C2=CCS(=O)(=O)C2)c2cccnc2)cc1C,C09007122_decoy,TRY1,Decoy,0,-9.4106,-8.09,-3.38,-9.647838897782766
O=S1(=O)CC=C(S(=O)(=O)NC[C@H](c2ccco2)S(=O)(=O)c2ccc3c(c2)OCO3)C1,C09081411_decoy,TRY1,Decoy,0,-8.75711,-8.57,-2.56,-9.825044424011343
C[C@@]1(c2ccco2)NC(=O)N(CC(=O)N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)C1=O,C09113797_decoy,TRY1,Decoy,0,-7.29986,-6.94,-1.51,-5.0584191387917325
[H]/N=C1C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)/C(=O)N=C2SC(CC(=O)N3CCCCC3)=NN2/1,C09191216_decoy,TRY1,Decoy,0,-8.82115,-7.92,-1.93,-5.738978734439202
Cc1c(NC(=O)CSc2nnc([C@@H]3COc4ccccc4O3)o2)c(=O)n(-c2ccccc2)n1C,C09218216_decoy,TRY1,Decoy,0,-8.78347,-6.6,-2.6,-5.2321904807770006
Cc1c(NC(=O)CSc2nnc([C@H]3COc4ccccc4O3)o2)c(=O)n(-c2ccccc2)n1C,C09218218_decoy,TRY1,Decoy,0,-9.00963,-8.13,-3.77,-6.401462401501362
O=C(Nc1nncs1)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1,C09417861_decoy,TRY1,Decoy,0,-7.38021,-6.69,-3.78,-5.148293116970297
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)Nc3cccc(-n4cnnn4)c3)c12,C09670169_decoy,TRY1,Decoy,0,-7.93087,-8.81,-1.28,-5.727409597360035
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)Nc3cccc(-n4cnnn4)c3)c12,C09670170_decoy,TRY1,Decoy,0,-8.7146,-8.66,-1.54,-7.696958982749483
O=C(Cc1cccs1)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2n1nnnc1Oc1ccc(-n2cncn2)cc1,C04259850_decoy,TRY1,Decoy,0,-7.76029,-6.9,-1.84,-5.964674150231121
O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1,C14072001_decoy,TRY1,Decoy,0,-8.89845,-6.74,-3.18,-6.294267623559278
Cn1c(=O)n(C)c2cc(/C=C3\SC(=O)N(CC(=O)Nc4ccc5c(c4)OCCO5)C3=O)ccc21,C15009039_decoy,TRY1,Decoy,0,-9.51312,-8.54,-1.21,-7.094932541522045
CN1C(=O)c2cc(C(=O)N3CCC4(CC3)OCCO4)nn2C[C@@]1(C)C(=O)NCc1ccc(F)cc1,C15723825_decoy,TRY1,Decoy,0,-8.70909,-8.95,-3.04,-7.329947092023661
Cc1ccc2nc(N3CC[NH+](C)CC3)c(/C=C3\SC(=S)N(CCC(=O)[O-])C3=O)c(=O)n2c1,C16734529_decoy,TRY1,Decoy,0,-8.43,-7.6,-2.97,-5.919539596346693
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2C(=O)N3C(C)C)c1C,C19468889_decoy,TRY1,Decoy,0,-6.74577,-7.26,-2.44,-5.218232180758052
C=CCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3c(C)cccn3c2=O)SC1=S,C20080652_decoy,TRY1,Decoy,0,-10.1307,-6.43,-1.11,-6.293509183588213
O=c1[nH]c2cc3c(cc2cc1[C@H](c1nnnn1Cc1ccc(F)cc1)N1CCOCC1)OCCO3,C20081202_decoy,TRY1,Decoy,0,-8.31147,-7.43,-0.68,-5.982998796042892
O=C(Nc1ccc2c(c1)OCCO2)C(=O)N1CCC2(CC1)OCCN2S(=O)(=O)c1ccccc1,C20614820_decoy,TRY1,Decoy,0,-8.16048,-5.81,-1.23,-5.665620755060743
Cc1cc(NC(=O)COC(=O)c2cc(C3CC3)nc3c2c(C)nn3[C@H]2CCS(=O)(=O)C2)no1,C21441411_decoy,TRY1,Decoy,0,-8.75538,-8.08,-2.16,-10.85088386069046
O=C(CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)N1CCN(C(=O)CN2CCOCC2)CC1,C25082485_decoy,TRY1,Decoy,0,-8.81572,-8.14,-1.23,-6.895867262875133
CC(C)OC(=O)C[C@@H](NC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1)c1ccccc1Cl,C31497197_decoy,TRY1,Decoy,0,-8.88578,-6.87,-1.38,-6.370305703001945
C[C@@H](OC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1)C(=O)Nc1ccc(OC(F)F)cc1,C32669968_decoy,TRY1,Decoy,0,-7.61116,-7.62,-1.83,-5.877357245152612
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1,C33187979_decoy,TRY1,Decoy,0,-6.76858,-6.38,-1.81,-4.990058484337727
CCCCCCN1C(=O)/C(=C/C2=C(O)Oc3c4c5c(cc3=C2C)CCC[N+]=5CCC4)C(=O)N=C1[O-],C36559514_decoy,TRY1,Decoy,0,-9.217,-6.14,-2.01,-5.040062004825247
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O,C37205234_decoy,TRY1,Decoy,0,-8.38649,-6.87,-3.01,-5.290935310827814
Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)N[C@@H]3CCS(=O)(=O)C3)c(N3C[C@@H](C)O[C@@H](C)C3)nc12,C09003973_decoy,TRY1,Decoy,0,-8.042,-7.48,-2.6,-5.475564104768315
CS(=O)(=O)c1ccc(C(=O)NCCN2C(=O)S/C(=C\c3cccnc3)C2=O)cc1[N+](=O)[O-],C37868152_decoy,TRY1,Decoy,0,-7.10858,-7.01,-2.22,-5.410222543857203
CCc1nnc(NC(=O)CN2C(=O)/C(=C/c3cc(OC)c(OC)c(OC)c3)SC2=S)s1,C01767152_decoy,TRY1,Decoy,0,-8.93209,-6.73,-2.02,-7.586470410744317
CC(=O)N1CCN(c2cc3c(cc2F)C(=O)[C@@H](C(=O)Nc2nnc(C)s2)CN3C2CC2)CC1,C38586092_decoy,TRY1,Decoy,0,-8.22444,-6.88,-1.57,-5.795678540630446
CCN1CCN(C(=O)C(=O)NC[C@@H](c2cccs2)S(=O)(=O)c2ccc3c(c2)OCO3)CC1,C38791506_decoy,TRY1,Decoy,0,-8.74227,-8.53,-1.82,-7.70578586231621
CN(C)S(=O)(=O)c1ccc(-c2nnc(NC(=O)CCS(=O)(=O)c3ccc(F)cc3)o2)cc1,C36693540_decoy,TRY1,Decoy,0,-8.92787,-8.16,-3.32,-6.694938922091378
CN1C(=O)[C@H]2[N-][C@H](SCC3=Nc4ncnn4C(=O)C3)[NH+](Cc3ccccc3F)[C@H]2N(C)C1=O,C39224754_decoy,TRY1,Decoy,0,-8.53453,-7.94,-2.1,-6.042777914949909
CCO[C@@H]1CC(=O)c2c(c3ncc(S(=O)(=O)C(C)C)cc3c(=O)n2S(=O)(=O)C(C)C)N1,C39451988_decoy,TRY1,Decoy,0,-7.45761,-4.75,-2.92,-4.661657316543758
CCOn1c2c(c3ncc(S(=O)(=O)C(C)C)cc3c1=O)N[C@H](S(=O)(=O)C(C)C)CC2=O,C39452378_decoy,TRY1,Decoy,0,-8.84796,-6.96,-1.19,-5.94382814233342
CCOc1cc2c(cc1S(=O)(=O)C(C)C)[C@H]1CO[P@](=O)(S(=O)(=O)C(C)C)NN1CC2,C39466384_decoy,TRY1,Decoy,0,-7.02061,-6.17,-3.19,-4.8428905552663934
CC(C)S(=O)(=O)C1=C[C@H]2C[C@@H]3CO[P@](=O)(S(=O)(=O)C(C)C)NN3C[C@@H]2C=C1Cl,C39470058_decoy,TRY1,Decoy,0,-7.85873,-5.52,-2.96,-4.605793920241137
O=C([C@@H]1C[C@H](Cc2ccccc2)C2=[NH+]c3ccccc3CN21)N([O-])S(=O)(=O)Oc1ccccc1,C39545734_decoy,TRY1,Decoy,0,-8.64583,-6.84,-1.3,-6.110447097797088
Cc1cc(C)c(S(=O)(=O)N2CCOC23CCN(C(=O)C(=O)NC[C@@H]2CCCO2)CC3)c(C)c1,C39703553_decoy,TRY1,Decoy,0,-7.23597,-6.13,-2.44,-5.099698788389744
C[C@@]1(c2ccc3c(c2)OCO3)NC(=O)N(CC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)C1=O,C13164748_decoy,TRY1,Decoy,0,-8.08363,-5.98,-1.81,-6.587053104459736
COCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)c1c(C)[nH]c2ccccc12,C45447647_decoy,TRY1,Decoy,0,-7.81289,-5.24,-3.45,-6.156165272497261
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CCCC(=O)NCc1ccccc1Cn1cccn1,C46910191_decoy,TRY1,Decoy,0,-7.3484,-7.58,-3.66,-5.826975879900158
COc1ccc(C2=C[C@H](c3ccco3)N(C(=O)CN3C(=O)C(=O)N(Cc4ccco4)C3=O)N2)cc1,C03408489_decoy,TRY1,Decoy,0,-8.15777,-8.76,-1.97,-10.618972596516707
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1N1CCN(C(=O)c2cc(-c3cccs3)n[nH]2)CC1,C56907930_decoy,TRY1,Decoy,0,-8.94209,-7.22,-1.59,-5.586409251585975
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)c1ccc2nccn2c1,C60376543_decoy,TRY1,Decoy,0,-8.43865,-7.58,-3.11,-6.052755604434474
[H]/N=C1C(=C\c2ccc(OC(=O)c3ccco3)c(OC)c2)\C(=O)N=C2SN=C(S(C)(=O)=O)N2\1,C15934959_decoy,TRY1,Decoy,0,-8.20973,-7.56,-1.01,-5.593316940517688
O=S1(=O)CC[C@@H](S(=O)(=O)N2CCN(Cn3nc(/C=C/c4ccccc4)[nH]c3=S)CC2)C1,C62595200_decoy,TRY1,Decoy,0,-8.51941,-7.67,-2.06,-6.448631529513039
[H]/N=C1C(=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C41077694_decoy,TRY1,Decoy,0,-8.21534,-6.7,-2.85,-4.88610077406679
[H]/N=C1C(=C\c2ccc(OS(C)(=O)=O)c(OC)c2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C20208360_decoy,TRY1,Decoy,0,-8.24412,-6.24,-2.03,-5.247584888473077
Cc1cc2c(cc1S(=O)(=O)N(C)CC(=O)N(C)C[C@H]1COc3ccccc3O1)OCC(=O)N2,C35452176_decoy,TRY1,Decoy,0,-7.72472,-8.13,-1.76,-5.833556195746438
[NH3+]C[C@@H](O)[C@H](O)[C@@H](O)c1cnn(-c2ccccc2)n1,C04207050_decoy,TRY1,Decoy,0,-8.50358,-7.63,-1.27,-8.68217481015772
CN1NC(=[NH2+])C(=NNc2ccccc2C(=O)[O-])C1=[NH2+],C04477438_decoy,TRY1,Decoy,0,-5.97884,-7.83,-0.73,-6.648492535518386
[NH3+][C@H]1[C@@H](O)[C@@H](OCc2ccccc2)O[C@@H](CO)[C@H]1O,C08381259_decoy,TRY1,Decoy,0,-6.76842,-5.52,-1.24,-5.316110657743117
C[NH2+][C@@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1CO,C14418147_decoy,TRY1,Decoy,0,-6.27996,-7.08,-0.24,-10.1844255962254
Cc1cc(=[NH2+])[nH]c(=O)n1[C@H]1O[C@@H](CO)[C@H](O)[C@H]1O,C17020824_decoy,TRY1,Decoy,0,-6.82863,-6.29,-0.9,-9.728941257011307
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](N)[C@@H]2O)CC1,C20463910_decoy,TRY1,Decoy,0,-6.05744,-6.47,-1.48,-5.306049135960444
[NH3+][C@H]1[C@@H](O)[C@@H](CO)O[C@@H](OCc2ccccc2)[C@@H]1O,C22050209_decoy,TRY1,Decoy,0,-7.00702,-4.41,-1.33,-4.443338528457127
CC(=O)NCCNc1ccc(NC(=O)CC[NH3+])cn1,C31961169_decoy,TRY1,Decoy,0,-8.08518,-5.13,-2.83,-5.58491143444677
O=C(Nc1ccc2[nH]c(=O)c(=O)[nH]c2c1)[C@H]1C[C@@H](O)C[NH2+]1,C37031798_decoy,TRY1,Decoy,0,-6.9596,-6.17,-1.04,-4.653725782910477
OC[C@@H](O)[C@@H](O)[C@H](O)/C(C[NH+]1CCCCC1)=N\O,C37263664_decoy,TRY1,Decoy,0,-7.53333,-4.7,-1.98,-4.909308918670155
C[NH+](CC(N)=O)C[C@@H](O)COc1ccccc1N,C37268039_decoy,TRY1,Decoy,0,-6.30893,-4.32,-0.63,-3.6913522704530073
CNC(=O)NC(=O)[C@H](C)[NH+](CC(N)=O)C1CCNCC1,C37543321_decoy,TRY1,Decoy,0,-7.34107,-5.64,-1.3,-5.475301530116611
[NH3+]CC#Cc1cccc(NC(=O)c2c[nH]c(=O)[nH]c2=O)n1,C37552168_decoy,TRY1,Decoy,0,-9.32846,-7.32,-0.46,-7.707325807405375
CCN(CC)C(=O)[C@H](C)NC(=O)[C@H]([NH3+])CC(N)=O,C37626784_decoy,TRY1,Decoy,0,-7.29791,-4.86,-2.78,-5.941065972798631
Cn1ncc2c1CCC[C@@H]2NC(=O)[C@H]([NH3+])CC(N)=O,C37630051_decoy,TRY1,Decoy,0,-8.66619,-5.5,-2.48,-5.244299925794562
CNC(=O)CN1CCN(C(=O)[C@H]([NH3+])CC(N)=O)CC1,C37800973_decoy,TRY1,Decoy,0,-8.155,-4.22,-1.55,-5.097901669915148
CN(CC(=O)NC(C)(C)C)C(=O)[C@H]([NH3+])CC(N)=O,C37801647_decoy,TRY1,Decoy,0,-7.19351,-4.96,-1.72,-5.323702546661557
CCCCCCN(CCO)C(=O)[C@H]([NH3+])CC(N)=O,C37821444_decoy,TRY1,Decoy,0,-7.83074,-5.65,-4.29,-7.637351662983201
CCC1(CCSC(N)=[NH2+])C(=O)NC(=O)NC1=O,C03953813_decoy,TRY1,Decoy,0,-6.72667,-5.83,-0.98,-9.36796168641192
O=C(NCC[NH2+]CCO)C(=O)Nc1cccc(O)c1,C40268898_decoy,TRY1,Decoy,0,-7.25943,-5.83,-1.48,-7.17920746340625
C[NH+]1CCC(NS(=O)(=O)c2cn[nH]c2)(/C(N)=N/O)CC1,C40377054_decoy,TRY1,Decoy,0,-6.52054,-6.96,-1.34,-7.134392866968142
[NH3+]C1(C(=O)N[C@@H](Cc2c[nH+]c[nH]2)C(=O)[O-])CCCCC1,C40487037_decoy,TRY1,Decoy,0,-7.46567,-6.62,-0.43,-11.05751562169133
CC(C)Nc1nc[nH+]c(NNc2ccccc2)c1N,C40708107_decoy,TRY1,Decoy,0,-5.86179,-5.38,-1.57,-4.133079725081418
CN(c1ncnc(NN)c1N)C1CC[NH+](C)CC1,C40783897_decoy,TRY1,Decoy,0,-7.18078,-6.61,-0.46,-8.94691056294696
NC(=O)c1ccsc1NC(=O)[C@@H]1C[C@H](O)C[NH2+]1,C40859429_decoy,TRY1,Decoy,0,-7.50033,-6.45,0.23,-7.26818182421142
CCN(CC/C(N)=N/O)c1cc[nH+]c(C(N)=O)c1,C42453295_decoy,TRY1,Decoy,0,-6.73085,-5.83,-0.85,-6.5239730120009005
Nc1nc(F)nc2c1N=C[C@H]2[C@H]1O[C@@H](CO)C[C@@H]1[NH3+],C43721086_decoy,TRY1,Decoy,0,-7.49079,-4.28,-0.16,-3.677281718114058
COc1ccc(-c2n[nH]cc2[C@@H]([NH3+])CC(N)=O)cc1,C44254817_decoy,TRY1,Decoy,0,-7.41721,-4.97,-0.44,-4.464105817537302
CCC[C@](C)([NH3+])C(=O)NCCCS(N)(=O)=O,C45088218_decoy,TRY1,Decoy,0,-8.7457,-5.28,-1.87,-5.8147074936863286
CN(CCC[NH3+])S(=O)(=O)NC(C)(C)C(N)=O,C45108383_decoy,TRY1,Decoy,0,-8.33993,-5.54,-3.85,-8.203787430486727
Cc1n[nH]c(SCCCC[C@](C)([NH3+])C(N)=O)n1,C45597296_decoy,TRY1,Decoy,0,-9.02153,-5.54,-1.51,-6.830591265463169
C[C@@H]1CCC[NH+]([C@@H](C)CNC(=O)NNC(N)=O)C1,C46367175_decoy,TRY1,Decoy,0,-7.53235,-5.5,-2.47,-5.206319888546589
C[C@@H]1CCC[NH+](CCCNC(=O)NNC(N)=O)C1,C46393321_decoy,TRY1,Decoy,0,-6.86831,-5.82,-1.5,-6.360063571700114
CC(C)c1csc(NC(=O)[C@H]([NH3+])CC(N)=O)n1,C49237229_decoy,TRY1,Decoy,0,-8.70028,-5.76,-2.75,-8.735753235710222
Cc1[nH]nc(C(=O)N2CCC[NH+](CC(N)=O)CC2)c1N,C50306271_decoy,TRY1,Decoy,0,-7.33649,-4.42,-1.27,-3.902604735802985
C[C@@]([NH3+])(CSc1ncnc2nc[nH]c12)C(N)=O,C51037451_decoy,TRY1,Decoy,0,-7.02855,-6.1,-0.74,-6.661757158660466
Cc1nn(C)c(NN)c1C[NH+](CC(N)=O)C(C)C,C51145354_decoy,TRY1,Decoy,0,-6.81472,-5.13,-1.97,-4.593165143533432
Nc1nc(N)nc(C[NH+]2CCC[C@H](CCO)C2)n1,C51916781_decoy,TRY1,Decoy,0,-7.42385,-5.71,-0.53,-7.807934490978997
COCC[C@@H]([NH3+])C(=O)NCCCS(N)(=O)=O,C52810309_decoy,TRY1,Decoy,0,-8.09148,-3.62,-0.9,-4.886407806464395
C[C@H]1CCC[C@](CO)([NH2+][C@@H](C)C(=O)NC(N)=O)C1,C53126296_decoy,TRY1,Decoy,0,-7.04901,-5.4,-1.05,-5.727447812936436
NC(=O)C[NH+]1CCC(NC(=O)c2nonc2N)CC1,C54421381_decoy,TRY1,Decoy,0,-6.89895,-7.5,-0.91,-12.174002649124969
N/C(=N/O)c1ncccc1C[NH+](CCO)CCO,C61657501_decoy,TRY1,Decoy,0,-6.56417,-4.04,-1.43,-4.338967309656318
C[C@H]1CCC[C@@H](C(=O)N(CC(N)=O)CC(N)=O)[NH2+]1,C61809085_decoy,TRY1,Decoy,0,-6.6536,-3.52,-1.51,-3.913325212202291
C[C@H]1CCC[NH2+][C@@H]1C(=O)N(CC(N)=O)CC(N)=O,C61809105_decoy,TRY1,Decoy,0,-7.22983,-4.99,-2.83,-4.9092546264603465
C[C@@H](CC(N)=O)C[C@H]([NH3+])c1ccc2[nH]c(=O)oc2c1,C61830268_decoy,TRY1,Decoy,0,-6.69393,-6.06,-1.26,-6.039110906215278
C[C@@H](CC(N)=O)C[C@@H]([NH3+])c1ccc2[nH]c(=O)oc2c1,C61830270_decoy,TRY1,Decoy,0,-8.31678,-5.32,-0.93,-5.02001234021315
CCCn1c(SCC[C@@H]([NH3+])C(N)=O)n[nH]c1=O,C62604926_decoy,TRY1,Decoy,0,-7.64203,-5.12,,99.0
CC(C)n1c(SCC[C@@H]([NH3+])C(N)=O)n[nH]c1=O,C62605052_decoy,TRY1,Decoy,0,-8.23302,-6.17,-2.04,-7.765277964033682
CC(C)(C[NH3+])Nc1ccc([N+](=O)[O-])cc1C(N)=O,C63020876_decoy,TRY1,Decoy,0,-8.07244,-4.3,-0.66,-4.647608608758181
Cc1csc(CCNC(=O)[C@H]([NH3+])CC(N)=O)n1,C63134975_decoy,TRY1,Decoy,0,-8.60174,-6.35,-2.59,-8.455732933546557
OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,C04096297_decoy,TRY1,Decoy,0,-5.07374,-4.17,-3.54,-3.940082084909464
Cn1c(=O)[nH]c(=O)c2c1nc(NN)n2C[C@H](O)CO,C04094911_decoy,TRY1,Decoy,0,-6.60109,-4.94,-1.15,-4.466347694128181
[NH3+][C@H](CCSSCC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C01712891_decoy,TRY1,Decoy,0,-8.9648,-3.51,-1.25,-4.972358046899978
[NH3+][C@H](CCSSCC[C@@H]([NH3+])C(=O)[O-])C(=O)[O-],C01712893_decoy,TRY1,Decoy,0,-7.18278,-3.31,-1.95,-4.375321475832452
C[C@H](O[C@@H]1[C@@H]([NH3+])[C@@H](O)O[C@H](CO)[C@H]1O)C(=O)[O-],C04521704_decoy,TRY1,Decoy,0,-5.65665,-4.29,-2.09,-3.85768146720344
NNc1ccn([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)n1,C04523261_decoy,TRY1,Decoy,0,-5.27083,-6.77,-0.24,-8.603708608255504
O=C([O-])[C@@H]1CS[C@H]([C@H](O)[C@H](O)[C@H](O)CO)[NH2+]1,C04530264_decoy,TRY1,Decoy,0,-7.3587,-4.91,-1.29,-4.559202992022463
CCCCNC(=O)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C04533078_decoy,TRY1,Decoy,0,-7.15348,-6.41,-0.84,-8.014449380221972
O=C[C@H](NS(=O)(=O)O)[C@@H](O)[C@H](O)[C@H](O)CO,C03644513_decoy,TRY1,Decoy,0,-7.30955,-6.58,-1.05,-7.772409426196033
[NH3+][C@@H](C(=O)[O-])C12CC3CC(C1)CC([C@@H]([NH3+])C(=O)[O-])(C3)C2,C04747299_decoy,TRY1,Decoy,0,-7.52317,-5.24,-4.31,-5.288663824498807
Nc1nn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05220326_decoy,TRY1,Decoy,0,-5.16289,-7.43,-1.12,-6.997115408932638
Nc1nn([C@@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05220343_decoy,TRY1,Decoy,0,-5.6102,-7.1,-1.22,-7.714266145801893
NC(=O)c1nnn([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1CO,C05502351_decoy,TRY1,Decoy,0,-6.60071,-7.3,-1.8,-8.095379233301035
O=S(=O)([O-])C[C@H](O)C[NH2+]C(CO)(CO)CO,C01611595_decoy,TRY1,Decoy,0,-5.6648,-3.81,-2.86,-4.407716472622937
[NH3+][C@H](CS(=O)(=O)SC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C01623385_decoy,TRY1,Decoy,0,-7.3746,-5.62,-1.49,-6.877725935769968
OC[C@@H](O)CO[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O,C06184893_decoy,TRY1,Decoy,0,-5.6358,-4.96,-2.85,-4.23088607872732
O=C1NC(=S)N[C@]12O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O,C12502895_decoy,TRY1,Decoy,0,-7.34802,-5.17,-1.26,-4.26804456217331
C[C@@H](O[C@H]1[C@@H]([NH3+])[C@@H](O)O[C@@H](CO)[C@@H]1O)C(=O)[O-],C13508863_decoy,TRY1,Decoy,0,-5.1962,-4.2,-3.1,-3.9927588337947566
[NH3+][C@@H]1[C@@H](O)[C@@H](O)[C@H](COS(=O)(=O)[O-])O[C@@H]1O,C13544895_decoy,TRY1,Decoy,0,-5.37954,-4.71,-0.64,-4.368602056097074
O=C([O-])[C@H]1CS[C@H]([C@H](O)[C@H](O)[C@@H](O)CO)[NH2+]1,C17211410_decoy,TRY1,Decoy,0,-7.55961,-3.81,-1.29,-4.187304948245839
NC(=O)c1[nH]cnc1/N=N/SC[C@@H]([NH3+])C(=O)[O-],C05605513_decoy,TRY1,Decoy,0,-6.32481,-5.4,-1.1,-7.744969546834577
Nc1nc2ncc([C@H](O)[C@H](O)CO)nc2c(=O)[nH]1,C12428336_decoy,TRY1,Decoy,0,-6.82808,-7.2,-0.01,-8.168559626603935
Nc1nc2ncc([C@H](O)[C@@H](O)CO)nc2c(=O)[nH]1,C17176123_decoy,TRY1,Decoy,0,-6.88226,-7.24,-0.29,-7.761870786273629
OC[C@@H](O)CO[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O,C35644458_decoy,TRY1,Decoy,0,-5.65187,-6.98,-3.68,-6.439844681356406
C[C@@H](O[C@@H]1[C@H]([NH3+])[C@H](O)O[C@@H](CO)[C@H]1O)C(=O)[O-],C35645498_decoy,TRY1,Decoy,0,-5.48013,-5.92,-2.17,-6.412672296999877
Nc1ccc(SCc2nc(N)nc(N)n2)cn1,C37192319_decoy,TRY1,Decoy,0,-7.36716,-7.26,-1.55,-9.329585360656882
NC(=O)NC(=O)CCSCC[C@H]([NH3+])C(=O)[O-],C37736309_decoy,TRY1,Decoy,0,-6.17196,-4.61,-1.57,-7.129587560876857
NC(=O)NC(=O)CCSCC[C@@H]([NH3+])C(=O)[O-],C37736310_decoy,TRY1,Decoy,0,-7.48925,-5.64,-3.8,-6.94585835297189
[NH3+][C@H](CSCSC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C13298609_decoy,TRY1,Decoy,0,-7.6929,-3.66,-2.13,-4.95610947810613
[NH3+][C@@H](CSCSC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C01531043_decoy,TRY1,Decoy,0,-7.84339,-3.59,-1.9,-5.0520235382817225
NC1=N[C@@H](O)c2ncn(COC(CO)CO)c2N1,C38339087_decoy,TRY1,Decoy,0,-6.84546,-6.94,-0.48,-8.466358873624184
N#C[C@H](CC(=O)/C=N/NC(N)=O)SC[C@@H]([NH3+])C(=O)[O-],C38534756_decoy,TRY1,Decoy,0,-7.94844,-4.24,-1.5,-4.816223892086613
N#C[C@@H](CC(=O)/C=N/NC(N)=O)SC[C@@H]([NH3+])C(=O)[O-],C38534757_decoy,TRY1,Decoy,0,-7.65906,-4.61,-3.21,-5.268866330018826
CCC[C@](C)(NC(=O)[C@H]([NH3+])CC(N)=O)C(=O)[O-],C40482932_decoy,TRY1,Decoy,0,-8.12588,-5.24,-1.69,-8.10351788960853
NNc1ncnc(Nc2ccc(F)c(F)c2)c1N,C40783893_decoy,TRY1,Decoy,0,-6.79532,-6.61,-0.31,-7.79105049867333
Nc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O,C01698590_decoy,TRY1,Decoy,0,-5.58904,-8.37,-0.88,-8.018873430114555
Nc1nc(=O)n([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)cc1CO,C44062840_decoy,TRY1,Decoy,0,-6.10407,-5.85,-2.36,-6.121558971193851
O=C([O-])[C@@H]1CS[C@@H]([C@@H](O)[C@H](O)[C@@H](O)CO)[NH2+]1,C44171251_decoy,TRY1,Decoy,0,-7.30559,-4.01,-1.9,-4.510810978241179
C[C@@H](O[C@@H]1[C@@H]([NH3+])[C@H](O)O[C@@H](CO)[C@@H]1O)C(=O)[O-],C44608441_decoy,TRY1,Decoy,0,-5.19403,-5.02,-1.63,-4.079021988734192
[NH3+][C@@H]1[C@@H](OS(=O)(=O)[O-])[C@@H](O)[C@@H](CO)O[C@H]1O,C44608616_decoy,TRY1,Decoy,0,-6.14844,-6.69,-1.51,-7.427882975236296
[NH3+][C@@H]1[C@@H](O)[C@@H](O)[C@H](COS(=O)(=O)[O-])O[C@H]1O,C44608626_decoy,TRY1,Decoy,0,-6.91411,-7.37,-0.7,-8.746007566167613
O=C1NC(=O)C(=CNC(CO)(CO)CO)C(=O)N1,C05454319_decoy,TRY1,Decoy,0,-6.13073,-5.17,-2.14,-4.464598506021325
Nc1cc(N)nc(SCc2nnsc2N)n1,C50839422_decoy,TRY1,Decoy,0,-8.42367,-6.95,-1.7,-10.706073897807505
O=C(NCCO)C(C(=O)NCCO)C(=O)NCCO,C59366398_decoy,TRY1,Decoy,0,-7.2213,-5.05,-2.91,-7.397411888176511
CC(C)(C(=O)N(CC(N)=O)CC(N)=O)C(N)=S,C61808953_decoy,TRY1,Decoy,0,-6.37901,-4.03,-3.48,-4.228698620220916
CC[C@@H](C(=O)N(CC(N)=O)CC(N)=O)C(N)=S,C61808974_decoy,TRY1,Decoy,0,-8.46934,-3.94,-2.93,-4.636397491698013
C[C@H]([NH2+]C[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(=O)[O-],C65742691_decoy,TRY1,Decoy,0,-4.41222,-4.84,-2.51,-3.474333679331384
CC(C)[C@H]([NH2+]C[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(=O)[O-],C65742708_decoy,TRY1,Decoy,0,-5.05479,-5.3,-1.09,-4.52251456847749
CC(C)[C@H]([NH2+]C[C@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(=O)[O-],C65742709_decoy,TRY1,Decoy,0,-4.54952,-4.74,-1.65,-3.662630029370177
OC[C@@H](O)CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C65742772_decoy,TRY1,Decoy,0,-6.24578,-4.76,-2.79,-4.431369420114819
OCC(CO)(CO)[NH2+]C[C@H](O)COc1ccccc1,C03159212_decoy,TRY1,Decoy,0,-6.60193,-5.03,-2.48,-4.672687739665339
C[C@@H]([NH3+])C(=O)N[C@@H]1[C@H]2C(C(=O)C[C@@H](O)[C@H]2O)C(=O)O[C@@H]1C,C13307884_decoy,TRY1,Decoy,0,-8.67278,-6.55,-1.91,-9.976878034977016
OCC(CO)(CO)[NH2+]C[C@@H](O)COc1ccccc1,C03159211_decoy,TRY1,Decoy,0,-5.74724,-5.85,-1.88,-6.4234176978021225
NC(=S)C(=S)N/C=C1\C(=[NH2+])NN(c2ccccc2)C1=O,C08665240_decoy,TRY1,Decoy,0,-7.86201,-5.5,-3.34,-4.934656404057656
OC[C@@H](O)[C@H](O)[C@@H](O)/C(C[NH+]1CCCCC1)=N\O,C25503463_decoy,TRY1,Decoy,0,-6.98843,-6.55,-0.23,-7.403927226660732
Nc1nc(-c2cccc(CC[NH3+])c2)c2nc[nH]c2n1,C32520409_decoy,TRY1,Decoy,0,-7.72929,-5.01,-1.75,-4.060996936173452
CC(=O)NCCNc1ccc(NC(=O)[C@@H](C)[NH3+])nc1,C31960621_decoy,TRY1,Decoy,0,-8.02164,-6.0,-1.43,-10.42066927695585
C[C@@H]([NH2+]CCNS(C)(=O)=O)C(=O)NC(N)=O,C35207946_decoy,TRY1,Decoy,0,-6.94563,-4.13,-1.39,-4.676296716010953
[NH3+][C@@H]1[C@@H](O)[C@@H](OCc2ccccc2)O[C@H](CO)[C@H]1O,C35636448_decoy,TRY1,Decoy,0,-6.76317,-6.37,-1.66,-6.567933296689495
Nc1cc[nH+]c2c1ncn2[C@@H]1C[C@H](CO)[C@H](O)[C@@H]1O,C36295115_decoy,TRY1,Decoy,0,-7.82358,-5.6,-0.62,-4.715957643718163
CC[C@@H](C)[C@@H]([NH3+])C(=O)Nc1cnn(CC(N)=O)c1,C37024704_decoy,TRY1,Decoy,0,-8.02477,-5.31,-4.46,-6.477908089048498
C[C@]1(NC(=O)[C@H]([NH3+])CC(N)=O)CCS(=O)(=O)C1,C37627303_decoy,TRY1,Decoy,0,-8.23734,-4.82,-1.79,-5.025901829920167
COCCn1cc(NC(=O)[C@H]([NH3+])CC(N)=O)cn1,C37630162_decoy,TRY1,Decoy,0,-7.68202,-5.46,-1.18,-6.661370284023567
CC[C@@H](C)[C@@H](NC(=O)[C@H]([NH3+])CC(N)=O)C(=O)OC,C37630362_decoy,TRY1,Decoy,0,-8.17781,-6.22,-3.04,-8.286376975705506
CS(=O)(=O)CC[C@H]([NH3+])C(=O)NCCCC(N)=O,C37660278_decoy,TRY1,Decoy,0,-6.6707,-4.37,-1.87,-4.802420758423699
CCn1cc(NC(=O)[C@@H]([NH3+])CC(N)=O)ccc1=O,C37766004_decoy,TRY1,Decoy,0,-7.20481,-6.87,-2.02,-8.551257462543367
CNC(=O)CN1CCN(C(=O)[C@@H]([NH3+])CC(N)=O)CC1,C37800974_decoy,TRY1,Decoy,0,-8.96996,-5.84,-2.4,-8.315908811246008
CCCCCCN(CCO)C(=O)[C@@H]([NH3+])CC(N)=O,C37821445_decoy,TRY1,Decoy,0,-8.47985,-5.8,-2.84,-7.719280002594542
NC(=O)C[C@H]([NH3+])C(=O)N(CCO)CC(F)(F)F,C37827472_decoy,TRY1,Decoy,0,-8.17552,-6.02,-1.41,-8.575094136803681
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)CO)C2O,C19326165_decoy,TRY1,Decoy,0,-7.50323,-5.86,-1.27,-5.691853920516632
O=S1(=O)CC[C@@H]([NH2+][C@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2O)C1,C40177491_decoy,TRY1,Decoy,0,-6.19171,-4.76,-2.35,-3.6572949778189408
NC(=O)C[NH+]1CCC(NC(=O)Cn2cc(N)cn2)CC1,C40335997_decoy,TRY1,Decoy,0,-7.60822,-6.51,-1.96,-6.48150367336865
Cc1[nH]ncc1S(=O)(=O)NC1(/C(N)=N/O)CC[NH+](C)CC1,C40377072_decoy,TRY1,Decoy,0,-7.25486,-7.57,-3.49,-7.168940050372633
CC(C)(C)[C@H]([NH3+])C(=O)N[C@@H](Cc1c[nH+]c[nH]1)C(=O)[O-],C40487069_decoy,TRY1,Decoy,0,-7.59201,-6.78,-1.22,-10.512705028470682
Nc1cccc(OC[C@H](O)C[NH+](CCO)CCO)c1,C40694739_decoy,TRY1,Decoy,0,-6.56633,-5.67,-2.54,-6.416479359048195
CCCNc1nc[nH+]c(NNc2ccccc2)c1N,C40707709_decoy,TRY1,Decoy,0,-7.14156,-4.8,-0.76,-4.454631875900085
CN(C)Nc1[nH+]cnc(NNc2ccccc2)c1N,C40757406_decoy,TRY1,Decoy,0,-6.37976,-6.41,0.29,-6.106316696466173
CCS(=O)(=O)N1CCC(NC(=O)[C@H]([NH3+])CC(N)=O)CC1,C40831666_decoy,TRY1,Decoy,0,-8.56315,-6.45,-1.22,-10.746420382756876
NC(=O)C[C@H]([NH3+])C(=O)N[C@H]1CCCc2occc21,C40831895_decoy,TRY1,Decoy,0,-7.78454,-6.87,-3.1,-7.396877867402213
CN(CCC[NH3+])S(=O)(=O)NCCCC(N)=O,C42525415_decoy,TRY1,Decoy,0,-8.12137,-5.71,-1.86,-7.222427658806027
C[NH+](C)C(C)(C)CNc1ncc(N)cc1C(N)=O,C43411407_decoy,TRY1,Decoy,0,-6.16069,-6.01,-0.47,-8.264880491318985
Cc1cc2oc(=[NH2+])c([C@@H]([NH3+])CC(=O)[O-])c(O)c2cc1C,C44216613_decoy,TRY1,Decoy,0,-8.06267,-5.15,-2.28,-4.234744187967079
CCC(CC)(C[NH3+])C(=O)NCCS(N)(=O)=O,C44762776_decoy,TRY1,Decoy,0,-7.22544,-4.48,0.07,-5.113647477467486
CCC[C@@](C)([NH3+])C(=O)NCCCS(N)(=O)=O,C45088220_decoy,TRY1,Decoy,0,-8.80822,-4.49,-2.08,-5.457584675755124
Cc1c(C(=O)NC(C)(C)C(N)=O)cnn1CCC[NH3+],C45093772_decoy,TRY1,Decoy,0,-8.13846,-5.32,-2.1,-5.890010354729818
O=C(NC1CC[NH2+]CC1)N[C@H](Cc1c[nH+]c[nH]1)C(=O)[O-],C48835215_decoy,TRY1,Decoy,0,-6.83061,-4.95,-1.45,-4.841348636872189
CC(C)c1csc(NC(=O)[C@@H]([NH3+])CC(N)=O)n1,C49237231_decoy,TRY1,Decoy,0,-7.68133,-5.61,-1.78,-7.03951491792551
CN[C@H]1[C@@H](O)[C@@H]([NH2+]C)[C@@H](O)[C@H]2O[C@@H]3O[C@H](C)CC(=O)[C@@]3(O)O[C@@H]12,C57406608_decoy,TRY1,Decoy,0,-8.41207,-5.72,-1.06,-5.536027866451746
CN[C@H]1[C@@H](O)[C@@H]([NH2+]C)[C@@H](O)[C@H]2O[C@@H]3O[C@H](C)CC(=O)[C@]3(O)O[C@@H]12,C57406610_decoy,TRY1,Decoy,0,-7.35894,-5.44,-2.28,-4.336913520040126
NC(=O)CN(CC(N)=O)C(=O)C[C@H]1CCC[NH2+]C1,C61808806_decoy,TRY1,Decoy,0,-7.23623,-4.43,-1.0,-4.8594257965243495
C[C@@H]1CCC[C@H](C(=O)N(CC(N)=O)CC(N)=O)[NH2+]1,C61809080_decoy,TRY1,Decoy,0,-6.63973,-4.43,-0.39,-4.653801944732549
C[C@H](CC(N)=O)C[C@@H]([NH3+])c1ccc2[nH]c(=O)oc2c1,C61830269_decoy,TRY1,Decoy,0,-6.63689,-5.61,-1.27,-4.872896434560765
NC(=O)CCCNC(=O)c1ccc(C#CC[NH3+])cn1,C61872207_decoy,TRY1,Decoy,0,-9.59411,-5.28,-1.87,-5.553491614957739
[NH3+][C@H](c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1cc[nH]n1,C62775790_decoy,TRY1,Decoy,0,-7.1405,-6.73,-0.55,-4.378317479331258
CC(C)(C[NH3+])NS(=O)(=O)c1c[nH]c(=O)[nH]c1=O,C63020582_decoy,TRY1,Decoy,0,-6.08953,-4.45,-1.66,-3.75051091601409
C[C@H](C/C(N)=N/O)N(C)c1cc[nH+]c(C(N)=O)c1,C63090242_decoy,TRY1,Decoy,0,-6.23451,-5.37,-2.93,-4.345677003575352
C[NH2+]C[C@H]1CCCCN1Cc1nc(N)nc(N)n1,C63168855_decoy,TRY1,Decoy,0,-7.38005,-6.11,-0.74,-7.315818075163298
C[C@@H]([NH3+])CCNS(=O)(=O)c1c[nH]c(=O)[nH]c1=O,C63170949_decoy,TRY1,Decoy,0,-7.55288,-6.91,-4.91,-7.527303760358357
[NH3+][C@@H]1CCC[C@@H]1NS(=O)(=O)c1c[nH]c(=O)[nH]c1=O,C63175089_decoy,TRY1,Decoy,0,-8.0624,-7.32,-1.67,-7.607678326290687
CCCNC(=O)NC(=O)C[NH+]1C[C@@H](O)C[C@@H]1C(N)=O,C67129300_decoy,TRY1,Decoy,0,-8.65801,-6.2,-1.2,-7.27579683777877
C[NH+]1[C@@H](NC(=O)C(C)(C)O)C(C)(C)C(C)(C)[C@H]1NC(=O)C(C)(C)O,C01733220_decoy,TRY1,Decoy,0,-6.77924,-5.01,-1.25,-4.77867340766348
C[NH+]1[C@H](NC(=O)C(C)(C)O)C(C)(C)C(C)(C)[C@H]1NC(=O)C(C)(C)O,C01733221_decoy,TRY1,Decoy,0,-6.35031,-5.93,-2.39,-5.3523838302224185
C[NH+]1[C@@H](NC(=O)C(C)(C)O)C(C)(C)C(C)(C)[C@@H]1NC(=O)C(C)(C)O,C01733222_decoy,TRY1,Decoy,0,-6.22983,-4.4,-0.95,-4.481784431197507
C[NH+]1CCN(NC(=S)Nc2ccc(S(N)(=O)=O)cc2)CC1,C00467584_decoy,TRY1,Decoy,0,-7.2925,-5.01,-2.05,-4.129944178176265
NNC(=O)C[C@H]1C(=O)NCC[NH+]1Cc1c(Cl)cccc1Cl,C00142598_decoy,TRY1,Decoy,0,-8.4759,-4.97,-1.27,-5.097339008111174
NNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1c(Cl)cccc1Cl,C00142592_decoy,TRY1,Decoy,0,-8.20257,-6.44,-3.66,-5.316303948538586
C[C@@H]1CCc2c(sc(NC(=O)CN3CC[NH2+]CC3)c2C(N)=O)C1,C19497183_decoy,TRY1,Decoy,0,-9.20811,-6.08,-2.7,-5.744239009267633
CC1CC[NH+]([C@@H]2[C@H](O)[C@H](CO)O[C@@H]2CNC(=O)NC(C)C)CC1,C20466005_decoy,TRY1,Decoy,0,-6.30985,-4.76,-1.66,-4.536727656491554
NC(=O)c1ccc(C[NH+]2Cc3ccccc3C[C@H]2C(N)=O)c([N+](=O)[O-])c1,C22011372_decoy,TRY1,Decoy,0,-6.41051,-7.37,-1.2,-8.873734541477752
COc1ccc(CN2CC[NH+](Cc3nc(N)nc(N)n3)CC2)cc1,C22935093_decoy,TRY1,Decoy,0,-8.49099,-8.01,-1.08,-13.115471856936717
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(NC(=O)C2CC2)cc1,C28349508_decoy,TRY1,Decoy,0,-6.84995,-6.28,-2.48,-5.456136663663958
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(NC(=O)C2CC2)cc1,C28349519_decoy,TRY1,Decoy,0,-6.81209,-5.6,-2.43,-5.027715517532098
NC(=O)c1ccc2ncc(-c3cccc(NC4CC[NH2+]CC4)n3)n2c1,C29044637_decoy,TRY1,Decoy,0,-8.5078,-5.39,-1.64,-4.432301552250342
CS(=O)(=O)Nc1ccc(NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)cc1Cl,C37041217_decoy,TRY1,Decoy,0,-7.27624,-5.44,-1.46,-4.461891686604524
CS(=O)(=O)Nc1ccc(NC(=O)[C@H]2C[C@@H](O)C[NH2+]2)cc1Cl,C37041220_decoy,TRY1,Decoy,0,-6.69661,-5.96,-3.7,-4.573157105791122
C[NH+]1CCC(NS(=O)(=O)c2c(NN)nc3sccn23)CC1,C37556278_decoy,TRY1,Decoy,0,-8.13588,-4.31,-2.75,-4.8322294593535045
[NH3+][C@@H]1CCCC[C@H]1N/C=C1\C(=O)NC(=O)N(Cc2ccc(F)cc2)C1=O,C20461187_decoy,TRY1,Decoy,0,-10.8311,-5.65,0.05,-5.7278440752689725
COc1cc([C@@H](C(N)=O)N2CCC[NH2+]CC2)cc(Br)c1O,C37943822_decoy,TRY1,Decoy,0,-8.21178,-4.98,-1.31,-5.175212148621563
Cc1ccc2c(c1)=C(NNC(=O)C(=O)Nc1ccc(O)cc1)C(=O)[NH+]=2,C03468093_decoy,TRY1,Decoy,0,-7.88863,-8.02,-2.41,-6.740126354279291
COCc1ccc(C(=O)NNC(=O)c2c[nH+]c3ccccc3c2N)o1,C40345912_decoy,TRY1,Decoy,0,-7.85553,-6.01,-1.98,-6.089538329740608
C[NH+]1CCC(NS(=O)(=O)c2ccc(Cl)s2)(/C(N)=N/O)CC1,C40377070_decoy,TRY1,Decoy,0,-9.24706,-6.08,-1.2,-5.86589422677657
COc1ccc2[nH]cc(C3=CC[NH+]([C@@H](C)C(=O)NC(N)=O)CC3)c2c1,C40554263_decoy,TRY1,Decoy,0,-6.94619,-5.98,-1.25,-5.322372865242287
C[NH+]1CCC[C@H](NS(=O)(=O)c2c(NN)nc3sccn23)C1,C40716262_decoy,TRY1,Decoy,0,-8.38983,-5.37,-0.85,-4.994707882900287
C[NH+]1CCC[C@@H](NS(=O)(=O)c2c(NN)nc3sccn23)C1,C40716263_decoy,TRY1,Decoy,0,-8.39518,-5.51,-1.54,-5.192972117636723
Cc1ccccc1C(=O)NNc1ncnc(N2CC[NH+](C)CC2)c1N,C40726333_decoy,TRY1,Decoy,0,-7.47378,-7.53,-1.34,-6.417336764551881
CC(=O)Nc1ccc(Nc2ncnc(N3CC[NH+](C)CC3)c2N)cc1,C40726408_decoy,TRY1,Decoy,0,-7.32825,-5.97,-2.39,-5.3216545544190605
CC1(C)CC(Nc2ncnc(N(CC#N)CC#N)c2N)CC(C)(C)[NH2+]1,C40736576_decoy,TRY1,Decoy,0,-7.22611,-5.72,-1.71,-4.712231841091086
Cc1nc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)sc1C,C40756915_decoy,TRY1,Decoy,0,-8.12366,-5.82,-1.14,-5.036279982170487
C[C@H](NC(=O)c1coc([C@@H]([NH3+])[C@@H](C)O)n1)c1cccc2ccccc12,C43217850_decoy,TRY1,Decoy,0,-7.87174,-7.69,-4.07,-6.6921861470950565
C[C@@H](NC(=O)c1coc([C@@H]([NH3+])[C@@H](C)O)n1)c1cccc2ccccc12,C43217851_decoy,TRY1,Decoy,0,-8.76091,-7.93,-2.59,-6.2898855644540745
C[C@H](NC(=O)c1coc([C@@H]([NH3+])[C@H](C)O)n1)c1cccc2ccccc12,C43217852_decoy,TRY1,Decoy,0,-8.9409,-7.8,-3.63,-6.124566748891784
[NH3+][C@H](CC(=O)[O-])c1c(O)oc2ccccc2/c1=[NH+]\Cc1ccccc1,C44217514_decoy,TRY1,Decoy,0,-6.24348,-5.59,-1.07,-4.165857666733769
Cc1ccc(Sc2ccc([C@H]([NH3+])CC(N)=O)cc2[N+](=O)[O-])cc1,C44253746_decoy,TRY1,Decoy,0,-6.45744,-5.7,-2.84,-5.0407692643608
Cc1ccc(Sc2ccc([C@@H]([NH3+])CC(N)=O)cc2[N+](=O)[O-])cc1,C44253749_decoy,TRY1,Decoy,0,-7.72577,-6.11,-1.98,-5.346666227887357
Cc1ccc(Sc2ccc([N+](=O)[O-])cc2[C@H]([NH3+])CC(N)=O)cc1,C44253956_decoy,TRY1,Decoy,0,-9.0108,-5.06,-1.86,-6.073572214320272
Cc1ccc(Sc2ccc([N+](=O)[O-])cc2[C@@H]([NH3+])CC(N)=O)cc1,C44253959_decoy,TRY1,Decoy,0,-7.7197,-6.87,-2.77,-8.045523119445978
CC1(C)CC(NC(=O)NCCCNS(C)(=O)=O)CC(C)(C)[NH2+]1,C45866315_decoy,TRY1,Decoy,0,-8.9348,-4.62,-1.41,-5.370195169162881
C[C@@H](C(=O)NC(N)=O)[NH+]1CCC(C(=O)Nc2ccc(Cl)cn2)CC1,C47262446_decoy,TRY1,Decoy,0,-7.4928,-5.54,-1.81,-5.39575379089955
CC(=O)Nc1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C48605031_decoy,TRY1,Decoy,0,-8.32664,-6.36,-3.59,-5.35969913584321
CNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C#CC[NH3+])cc1Cl,C49106331_decoy,TRY1,Decoy,0,-8.66488,-5.39,-4.33,-5.549497666952233
CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C#CC[NH3+])cc1Cl,C49106333_decoy,TRY1,Decoy,0,-8.88364,-6.47,-2.84,-7.428666129450655
[NH3+][C@H]1CCCC[C@H]1N/C=C1\C(=O)NC(=O)N(Cc2ccc(F)cc2)C1=O,C20461189_decoy,TRY1,Decoy,0,-9.37726,-6.04,-1.33,-5.708471420562708
C[NH+]1CCC[C@@H](CNC(=O)c2cc(Br)cnc2NN)C1,C51114262_decoy,TRY1,Decoy,0,-7.56756,-4.7,-0.82,-5.292420694860944
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCC[C@H](O)C1,C52635862_decoy,TRY1,Decoy,0,-9.11871,-5.86,-2.23,-5.857739127675053
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCC[C@H](O)C1,C52635863_decoy,TRY1,Decoy,0,-7.68157,-6.14,-1.95,-6.374843877327107
CNC(=O)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55027999_decoy,TRY1,Decoy,0,-7.49622,-4.58,-2.13,-4.655525048707738
CNC(=O)NC(=O)COC(=O)c1sc2[nH+]c(C)cc(C)c2c1N,C10645064_decoy,TRY1,Decoy,0,-7.71562,-7.36,-2.94,-5.877743980165374
C[NH2+]Cc1ccc(O[C@@H](C)C(=O)NC(N)=O)c(Br)c1,C62700908_decoy,TRY1,Decoy,0,-6.88062,-6.35,-0.8,-7.018905747789188
COc1ccc([C@@H]2NO[C@H](C3=C(N)[NH+]=N[C@@H]3SC)N2)cc1OC,C64612592_decoy,TRY1,Decoy,0,-9.44322,-6.26,-1.88,-11.025636400350372
NC(=O)NC(=O)CC[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67401344_decoy,TRY1,Decoy,0,-8.56459,-7.72,-2.36,-6.241124161397296
c1scc2c1COCc1cscc1-2,C01763641_decoy,TRY1,Decoy,0,-8.17168,-4.74,0.05,-3.04273297042622
FC(F)(F)C(F)(F)C(F)(F)[C@H]1CO1,C05480497_decoy,TRY1,Decoy,0,-3.72681,-3.52,-0.49,-2.8427229360151043
Brc1ccc2ncccc2c1,C00078186_decoy,TRY1,Decoy,0,-6.11448,-5.3,0.23,-4.177803533966636
Cc1cnc(F)c(I)c1,C02384114_decoy,TRY1,Decoy,0,-5.70178,-4.71,-0.03,-5.14072577338491
F[C@H](C(F)(F)F)C(F)(F)[C@@H]1CCCO1,C02530871_decoy,TRY1,Decoy,0,-4.65983,-3.55,-2.66,-2.874213306416808
C[C@@H]1OC(C(Cl)(Cl)Cl)O[C@H]1C,C01656288_decoy,TRY1,Decoy,0,-6.43976,-3.48,-0.9,-2.766936448628742
Brc1ccoc1Br,C02572476_decoy,TRY1,Decoy,0,-6.08462,-2.59,0.02,-2.0221178402539493
BrC1=C2C=CC=CN2CC=C1,C04086497_decoy,TRY1,Decoy,0,-5.46382,-3.43,-0.39,-1.791252681747192
CC(=O)c1sccc1Br,C00153408_decoy,TRY1,Decoy,0,-6.52522,-3.2,-0.63,-2.95872148790215
O=c1sc2sc(=S)sc2s1,C04524645_decoy,TRY1,Decoy,0,-8.84362,-3.0,0.29,-2.9677082315070704
Brc1cnc(Br)nc1,C08698478_decoy,TRY1,Decoy,0,-6.0297,-2.77,-0.37,-2.045288461580604
Cc1nc(C#Cc2ccc(Cl)nc2)cs1,C13680970_decoy,TRY1,Decoy,0,-7.53742,-3.71,-1.47,-2.677849363107326
CC(C)(C)SCC(=O)C(F)(F)F,C13859381_decoy,TRY1,Decoy,0,-5.21135,-3.27,-1.05,-3.22820747406966
COC(=O)[C@@]1(C)CC(F)(F)[C@]1(F)Cl,C15442379_decoy,TRY1,Decoy,0,-5.47099,-3.19,-2.19,-3.075283325435725
O=C(CI)C(F)(F)F,C16158475_decoy,TRY1,Decoy,0,-4.64246,-2.89,-0.53,-2.3204532454611524
Cc1cc(Cl)c(Br)cn1,C21982018_decoy,TRY1,Decoy,0,-6.6432,-3.42,-0.37,-2.303710764446325
Clc1cnc(I)nc1,C22005578_decoy,TRY1,Decoy,0,-6.15285,-2.83,-0.05,-2.071963973024758
O=S1(=O)C2CCCC1(Br)CCC2,C32134816_decoy,TRY1,Decoy,0,-5.41173,-3.71,-2.12,-2.3065674083508183
C[C@@H]1c2ccsc2CCN1CCC#N,C32814859_decoy,TRY1,Decoy,0,-7.74696,-4.21,-0.79,-4.006681908101595
O=C1COc2c(F)cc(Br)cc21,C35652490_decoy,TRY1,Decoy,0,-5.71541,-5.24,-2.01,-3.957011092289906
Cc1nc2ccc(Br)cn2c1C,C36259700_decoy,TRY1,Decoy,0,-6.10719,-4.28,-0.15,-2.190755939433968
Cc1c2cc(Br)ccc2nn1C,C36533453_decoy,TRY1,Decoy,0,-6.45941,-5.4,-0.08,-4.272338720398547
CSc1ncnc2sc(C)c(C)c12,C00422605_decoy,TRY1,Decoy,0,-7.30654,-4.86,-0.4,-3.85197389317374
O=C1N=CC=C2S[C@H](Br)C=C12,C38534306_decoy,TRY1,Decoy,0,-6.88798,-5.36,-0.54,-5.231854989475069
N#Cc1ncc(Br)cc1Br,C38540432_decoy,TRY1,Decoy,0,-7.01981,-4.24,-0.42,-3.9097976659568574
CC1=N[C@@H]2C=Cc3nc(C)sc3C2=C1C,C39224401_decoy,TRY1,Decoy,0,-6.6875,-5.33,-0.41,-2.683116770257339
CS[C@H]1CC[C@@]2(C[C@H](F)CN2F)C1,C39505569_decoy,TRY1,Decoy,0,-5.36375,-3.28,-1.74,-2.2368750282816467
F[C@@H]1CC[C@]2(C1)C[C@H](Cl)CN2Cl,C39506199_decoy,TRY1,Decoy,0,-7.4114,-4.35,-0.68,-2.622720297307732
CO[C@@H]1CN(Br)[C@]2(CC[C@H](F)C2)C1,C39506567_decoy,TRY1,Decoy,0,-7.04569,-3.47,-0.98,-3.1877912046324446
F[C@H]1CC[C@@]2(C1)[C@H](Cl)CCCN2F,C39512273_decoy,TRY1,Decoy,0,-6.12924,-4.13,-0.87,-2.487201892268335
F[C@H]1CC[C@@]2(C1)[C@H](Br)CCCN2F,C39512277_decoy,TRY1,Decoy,0,-6.21815,-3.83,-1.64,-2.466364553607278
N#C[C@H]1C=CC(c2ccccc2)=NC1=S,C39709917_decoy,TRY1,Decoy,0,-6.60925,-6.54,-2.87,-6.3970350021774935
BrC1=C(Br)CN=C1,C39947876_decoy,TRY1,Decoy,0,-6.04316,-2.32,0.04,-1.8687968579598144
C[C@H]1C=CC[C@@H]2CS(=O)(=O)C[C@@]21C,C43761798_decoy,TRY1,Decoy,0,-6.43631,-3.49,-1.57,-2.23591893368737
O=C1C=C[C@]2(CCO2)[C@H]2[C@@H]1[C@H]1C=C[C@@H]2C1,C43763444_decoy,TRY1,Decoy,0,-6.90878,-5.05,-2.5,-3.20368804108224
O=C1C=C[C@]2(CO2)[C@H]2[C@@H]1[C@@H]1C=C[C@H]2C12CC2,C43763449_decoy,TRY1,Decoy,0,-6.43328,-5.26,-1.2,-3.0477280289427817
O=C1C=C[C@@H]2C[C@@]34C=CC[C@@H]3CC[C@@H]4[C@H]12,C45072166_decoy,TRY1,Decoy,0,-6.45812,-5.09,-1.59,-2.8091684805300208
O=C1CC[C@H]2[C@H]1C=CC21SCCCS1,C45072263_decoy,TRY1,Decoy,0,-7.81155,-4.19,-0.02,-3.1040876746420785
Cc1csc(SC/C=C/Cl)n1,C49824484_decoy,TRY1,Decoy,0,-7.37715,-4.44,-0.2,-6.0240571694224405
N#Cc1ccccc1N1Cc2ccccc2C1,C50912530_decoy,TRY1,Decoy,0,-5.32737,-5.78,-0.19,-4.765839766895668
C=C(Br)CN1CCSCC1,C52441524_decoy,TRY1,Decoy,0,-6.86145,-2.97,-1.41,-3.234759269615532
COC1=NC=CC[C@]1(F)Br,C55161682_decoy,TRY1,Decoy,0,-6.11402,-4.07,-0.32,-3.118163684563894
CS(C)=Nc1ccc(Br)cn1,C59366345_decoy,TRY1,Decoy,0,-6.4267,-3.01,-0.79,-2.6806811912170208
C[C@H]1CC[C@@H]2CCCC[C@@H]2S1(=O)=O,C03163034_decoy,TRY1,Decoy,0,-6.77031,-3.92,-1.04,-2.5390143995489445
C[C@@H](Br)CC[C@@H]1CCCO1,C53339013_decoy,TRY1,Decoy,0,-6.16228,-3.29,-1.0,-3.714194502447322
Fc1cc2cc(CCl)c(Cl)nc2cc1F,C63116525_decoy,TRY1,Decoy,0,-8.43468,-5.21,-2.19,-3.844921167733671
O=CC1=CN=C2C(F)=C(F)C(F)=C(F)[C@H]12,C19615414_decoy,TRY1,Decoy,0,-5.85136,-4.89,,99.0
N#C[C@@H]1C(=S)N=C(C(F)(F)F)C2=C1CCCC2,C39712597_decoy,TRY1,Decoy,0,-6.28234,-4.39,-0.14,-3.304327874530132
ClC1=NC=C[C@@H]2N=CC(Br)=C12,C64032818_decoy,TRY1,Decoy,0,-7.10219,-4.29,,99.0
CC(=O)c1csc(Br)c1,C39268248_decoy,TRY1,Decoy,0,-6.93897,-3.63,0.1,-3.3093751931823485
CC(C)CN(C(=O)C[NH+]1CCc2ccccc2C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C07002254_decoy,TRY1,Decoy,0,-7.25894,-5.71,-2.76,-5.0661079602059145
C[NH2+]CC(=O)N[C@H]1C[C@H]2C(=O)Nc3ccc(-c4ccc(SC)cc4)cc3C(=O)N2C1,C08296910_decoy,TRY1,Decoy,0,-9.38145,-7.41,-2.06,-7.913041596420023
Cc1cccc2c1NC(=O)[C@]21[NH2+][C@H]([C@H](C)O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12881684_decoy,TRY1,Decoy,0,-7.79527,-7.1,-0.84,-5.263270956713376
C[C@H](O)[C@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C12882709_decoy,TRY1,Decoy,0,-9.13844,-6.1,-0.73,-6.102999747992752
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H]([C@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12883158_decoy,TRY1,Decoy,0,-7.19587,-8.93,-1.1,-8.432351327037843
Cc1ccc2c(c1)[C@@]1([NH2+][C@H]([C@H](C)O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12883169_decoy,TRY1,Decoy,0,-7.76816,-5.74,-1.67,-4.681444609817022
COc1cc([C@@H]2[NH+]=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)ccc1OC(C)C,C19354084_decoy,TRY1,Decoy,0,-8.80849,-6.89,-2.52,-5.205139283653102
COc1cc([C@H]2[NH+]=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)ccc1OC(C)C,C19354085_decoy,TRY1,Decoy,0,-8.539,-6.9,-1.23,-5.226778408427938
COC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](NC(=O)Nc3ccc(F)cc3)[C@@H]2O)CC1,C20463620_decoy,TRY1,Decoy,0,-6.89438,-6.72,-1.35,-6.747487958414602
C[NH+]1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccc(O)cc2O)N3)CC1,C20681800_decoy,TRY1,Decoy,0,-8.59926,-7.91,-3.44,-5.839819041559953
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCN(Cc2ccc(Cl)s2)CC1,C23334536_decoy,TRY1,Decoy,0,-11.2084,-7.13,-0.88,-7.962809093210845
O=C1NC(=O)[C@H](Cc2ccc(N3CCC([NH2+]C[C@H](O)c4cccnc4)CC3)cc2)S1,C27855166_decoy,TRY1,Decoy,0,-9.09638,-6.66,-1.54,-6.194688792315902
O=C1NC(=O)[C@@H](Cc2ccc(N3CCC([NH2+]C[C@H](O)c4cccnc4)CC3)cc2)S1,C27855175_decoy,TRY1,Decoy,0,-8.77919,-6.25,-2.39,-5.448987523562178
COc1cccc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)c1OC,C24985529_decoy,TRY1,Decoy,0,-10.6285,-6.91,-1.32,-6.599282732448295
COC1=C[C@@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467150_decoy,TRY1,Decoy,0,-6.60883,-7.92,-1.3,-4.458210910960842
COC1=C[C@@H]2C[C@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467154_decoy,TRY1,Decoy,0,-6.9125,-5.72,-1.55,-4.93531072977798
CC(C)S(=O)(=O)[P@]1(=O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(O)=C[C@@H]3C[C@@H]2CO1,C39469892_decoy,TRY1,Decoy,0,-5.98018,-5.09,-3.9,-4.246530023690166
NC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)COC(=O)C1=c2ccccc2=[NH+]C(=O)C1,C39611100_decoy,TRY1,Decoy,0,-6.54243,-4.83,-2.41,-4.837963168646511
NC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)COC(=O)C1=c2ccccc2=[NH+]C(=O)C1,C39611103_decoy,TRY1,Decoy,0,-8.7748,-8.81,-2.65,-10.935144177312196
CCN1C(=O)[C@@H](C2=NNC(=O)/C2=C\[C@H]2C(=O)[NH+]=c3c(C)cccc3=C2O)[C@H](O)c2ccccc21,C39939868_decoy,TRY1,Decoy,0,-9.23834,-9.3,-1.43,-6.380828890733095
CCN1C(=O)[C@H](C2=NNC(=O)/C2=C\[C@H]2C(=O)[NH+]=c3c(C)cccc3=C2O)[C@H](O)c2ccccc21,C39939870_decoy,TRY1,Decoy,0,-8.9764,-5.89,-1.15,-4.424003455247715
Cc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713626_decoy,TRY1,Decoy,0,-7.44656,-7.98,-1.37,-6.356608000349805
Cc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713627_decoy,TRY1,Decoy,0,-7.50281,-7.54,-1.57,-7.53114740321328
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C44713705_decoy,TRY1,Decoy,0,-9.52007,-6.36,-2.25,-6.061884735414612
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)ccc1F,C44713906_decoy,TRY1,Decoy,0,-8.14188,-7.87,-3.05,-6.178106169885366
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(C)c1,C44714197_decoy,TRY1,Decoy,0,-7.747,-7.74,-2.18,-6.9507850859363245
CCC(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714490_decoy,TRY1,Decoy,0,-8.91118,-7.16,-1.16,-7.883084470675556
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C22785880_decoy,TRY1,Decoy,0,-8.85608,-8.77,-2.05,-6.837689085210107
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)C4CCC4)CC34CC[NH2+]CC4)[nH]c2c1,C44737204_decoy,TRY1,Decoy,0,-8.40344,-7.15,-1.82,-6.847219056147452
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C22785874_decoy,TRY1,Decoy,0,-8.03948,-8.46,-1.26,-5.903281762847652
NS(=O)(=O)c1ccc(CC[NH2+][C@@H]2CC(=O)N(c3ccc(Cl)c(C(F)(F)F)c3)C2=O)cc1,C20457692_decoy,TRY1,Decoy,0,-9.07244,-8.35,-3.35,-6.439097138194272
COc1cc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(Cl)c1OC,C12506771_decoy,TRY1,Decoy,0,-8.08509,-6.75,-2.88,-5.566472497001473
CS(=O)(=O)N[C@@H]1Nc2ccc(C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)cc2S1,C63281124_decoy,TRY1,Decoy,0,-9.63602,-8.49,-2.21,-7.155934557633286
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)NC(=S)N(CCc4ccccc4)[C@H]3O)[C@H]1[NH+]=2,C63375918_decoy,TRY1,Decoy,0,-7.21221,-6.26,-4.33,-5.012533237691955
COc1ccc2c(c1)=C(CCNC(=O)C[C@H]1C(=O)Oc3c(ccc(O)c3O)[C@@H]1C)C[NH+]=2,C63385425_decoy,TRY1,Decoy,0,-8.46363,-6.99,-2.92,-5.639916051599743
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C63933353_decoy,TRY1,Decoy,0,-9.189,-6.12,-2.25,-6.248789247427321
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc(C)c4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64019218_decoy,TRY1,Decoy,0,-7.43118,-9.55,-1.41,-5.840644536266738
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4ccccc4F)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64019817_decoy,TRY1,Decoy,0,-7.51258,-8.77,-3.13,-7.109317850826214
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccccc4F)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64019819_decoy,TRY1,Decoy,0,-7.22232,-6.87,-1.32,-5.399527247224219
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4cc(C)cc(C)c4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64062064_decoy,TRY1,Decoy,0,-7.9001,-7.62,-1.08,-5.983781331473407
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cc(C)cc(C)c4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64062066_decoy,TRY1,Decoy,0,-7.6292,-9.6,-2.4,-5.885323516857119
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4ccc(C)cc4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097965_decoy,TRY1,Decoy,0,-6.88455,-8.93,-2.7,-8.32672378026135
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4ccc(C)cc4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097967_decoy,TRY1,Decoy,0,-7.68674,-5.74,-1.75,-5.080734955634856
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cc(C)ccc4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097971_decoy,TRY1,Decoy,0,-8.23074,-7.22,-0.63,-5.631001912245945
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4cccc(Cl)c4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097974_decoy,TRY1,Decoy,0,-7.74271,-6.36,-2.73,-5.666099227193812
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc(Cl)c4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097976_decoy,TRY1,Decoy,0,-8.80332,-7.33,-1.17,-5.825216086285892
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4cc(Cl)ccc4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097983_decoy,TRY1,Decoy,0,-8.15373,-6.61,-1.56,-5.21773756483
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cc(Cl)ccc4C)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C64097985_decoy,TRY1,Decoy,0,-8.61607,-6.66,-3.12,-5.884646268755231
O=C1[C@H]([C@@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@H](O)N1c1cccc(C(F)(F)F)c1,C64098013_decoy,TRY1,Decoy,0,-7.37951,-7.53,-2.97,-5.110898056337027
COc1cccc(C(=O)N[C@@H](C)C(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)c1OC,C20588500_decoy,TRY1,Decoy,0,-9.07297,-8.48,-1.4,-8.102609709297818
COCCNC(=O)C[C@@H]1c2nc(NC(=O)c3ccc(OC)cc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222263_decoy,TRY1,Decoy,0,-10.2413,-7.84,-1.9,-9.020448307514274
C[NH+](Cc1c(C(=O)N/N=C/c2ccccc2C(=O)[O-])nnn1-c1nonc1N)C1CCCCC1,C01881929_decoy,TRY1,Decoy,0,-6.9244,-7.24,-2.16,-6.674752224326478
CCCCn1c(N)c(N(CCC)CC(=O)N[C@H](C)c2ccc3c(c2)OCCO3)c(=O)[nH]c1=O,C11350555_decoy,TRY1,Decoy,0,-7.6872,-7.49,-2.25,-6.926944118737344
CC(=O)N[C@@H]1[C@@H](O/N=C2/C(=O)N(CCOc3ccccc3C)c3ccc(C)cc32)O[C@H](CO)[C@H](O)[C@@H]1O,C12636371_decoy,TRY1,Decoy,0,-7.78753,-7.68,-2.56,-6.145469883823178
CC(C)(CO)NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3[C@@H](O)C[C@@]21C,C12889299_decoy,TRY1,Decoy,0,-10.6404,-7.47,-2.58,-7.474845607130939
C/C(=N/Nc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COc1ccccc1)c1ccc(O)cc1,C05295515_decoy,TRY1,Decoy,0,-8.70012,-7.8,-2.2,-7.549424876313657
C/C(=N/Nc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@@H](O)COc1ccccc1)c1ccc(O)cc1,C05295523_decoy,TRY1,Decoy,0,-9.04998,-7.53,-2.14,-6.573426715454132
COc1ccc(NC(=S)NNC(=O)c2cnn3c2N[C@H](C)C[C@@H]3C(F)(F)F)c(OC)c1,C02793725_decoy,TRY1,Decoy,0,-8.38676,-8.02,-2.66,-8.774566231467928
CCCCN(C(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14623730_decoy,TRY1,Decoy,0,-7.78143,-5.5,-4.59,-5.989395928145528
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)CNC(=O)c1ccc(Cl)cc1Cl,C15384834_decoy,TRY1,Decoy,0,-9.18884,-7.26,-2.35,-7.3920645065588575
COc1cc(C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc(OC)c1OCC(N)=O,C15759882_decoy,TRY1,Decoy,0,-9.58147,-5.78,-2.49,-7.765852481756406
CCCCn1c(SCc2nc(N)nc(N)n2)nc2cc(S(=O)(=O)N(CC)CC)ccc21,C17673347_decoy,TRY1,Decoy,0,-9.37622,-7.97,-1.42,-9.068893382527508
CC(C)n1cc(/C=N/Nc2nnc(SCC(=O)Nc3cccc(Cl)c3Cl)n2N)cn1,C20827691_decoy,TRY1,Decoy,0,-9.9259,-7.62,-3.2,-7.165450897155941
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(O)c3)n2)s1,C20906594_decoy,TRY1,Decoy,0,-11.3592,-8.56,-1.53,-8.562748785261656
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NCc2ccc(C(F)(F)F)cc2)n1N,C20911406_decoy,TRY1,Decoy,0,-9.53282,-6.7,-3.62,-5.861671582532379
Cc1cc(F)ccc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(C(C)C)c2C)n1N,C20911666_decoy,TRY1,Decoy,0,-9.41304,-8.42,-1.94,-7.1439769925933
Cc1ccc(/C=N/Nc2nnc(SCC(=O)Nc3nnc(SC(C)C)s3)n2N)cc1,C20918508_decoy,TRY1,Decoy,0,-10.3717,-7.01,-3.23,-6.559005572490981
CC(C)n1cc(/C=N/Nc2nnc(SCC(=O)NC3C4CC5CC(C4)CC3C5)n2N)cn1,C20920467_decoy,TRY1,Decoy,0,-8.9984,-6.67,-1.05,-6.553909376557285
O=C(CSc1n[nH]c(N/N=C/c2ccc([N+](=O)[O-])cc2)n1)NNC(=O)c1ccc(F)cc1,C20923181_decoy,TRY1,Decoy,0,-8.0572,-5.94,-2.43,-5.785867711482994
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)c3ccc(F)cc3)n[nH]2)cc1,C20923317_decoy,TRY1,Decoy,0,-9.69299,-7.53,-2.67,-6.593453499163286
COc1ccc(O)c(/C=N/Nc2nc(SCCC(=O)Nc3cccc([N+](=O)[O-])c3)n[nH]2)c1,C21075771_decoy,TRY1,Decoy,0,-8.98078,-7.95,-3.76,-6.898673054392548
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccc(Cl)cc3)n2)c1,C21077940_decoy,TRY1,Decoy,0,-9.50267,-8.93,-3.15,-8.479721537498506
CC[C@@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)s1,C21078080_decoy,TRY1,Decoy,0,-10.5941,-8.62,-2.98,-10.715757312181418
COc1ccccc1Nc1nc(N)nc(CSc2nc3ccccc3c(=O)n2CCCO)n1,C21740583_decoy,TRY1,Decoy,0,-8.26271,-8.43,-1.32,-9.260062743046277
NC(=O)c1c(NC(=O)COC(=O)c2ccc(NC(=O)c3ccco3)s2)sc2c1CCC2,C23576073_decoy,TRY1,Decoy,0,-11.742,-8.09,-3.29,-7.89124118007962
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1Sc1nnc(COc2ccccc2C)n1C1CCCC1,C32594373_decoy,TRY1,Decoy,0,-7.58253,-6.72,-1.53,-7.049167192452598
COC[C@@H]1O[C@H](O[C@H]2OC(=O)C([C@H](O)c3ccccc3)=C2c2ccccc2)[C@H](NC(C)=O)[C@H](O)[C@@H]1O,C35270824_decoy,TRY1,Decoy,0,-5.81276,-5.21,-0.93,-4.876730506810055
COc1cc([C@H](C(=O)NC(C)(C)C)N(Cc2ccco2)C(=O)c2c(O)cccc2O)ccc1O,C36500680_decoy,TRY1,Decoy,0,-7.9681,-6.81,-3.37,-8.00918035571298
CCOc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccc(OCC(N)=O)cc4)[C@H]32)cc1OC,C09436928_decoy1,TRY1,Decoy,0,-6.91368,-6.05,,-5.752095009138949
CCCCN1C(=O)N=C([O-])[C@@H](N(C(=O)CSc2nc(C(C)(C)C)n[nH]2)C2CCCC2)[C@@H]1[NH3+],C38762960_decoy,TRY1,Decoy,0,-8.91488,-6.07,-3.32,-6.183559790757671
COc1cc([C@H]2C(C#N)=C(N)O[C@@H]3N=NC(CSc4ccc(C)cc4)=C23)ccc1OCC(N)=O,C38915308_decoy,TRY1,Decoy,0,-9.53443,-7.41,-3.38,-6.620314267873336
Cc1ccc(C)c(N2C(SCC(=O)NCc3ccco3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361889_decoy,TRY1,Decoy,0,-8.68501,-8.3,-1.8,-8.910762311326414
CCOc1ccc(N2C(SCC(=O)NC3CCCC3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362555_decoy,TRY1,Decoy,0,-8.34642,-7.62,-3.34,-7.63059774991584
C[C@@H](Sc1nnc(C2CC2)n1CCC(N)=O)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C45842293_decoy,TRY1,Decoy,0,-10.0482,-5.64,-3.05,-6.891679136998556
CC/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1nncn1C)c1ccc(O)cc1,C09232759_decoy,TRY1,Decoy,0,-8.51719,-8.09,-2.66,-7.511919897620202
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCc2nc3ccc([N+](=O)[O-])cc3[nH]2)n1N,C20911806_decoy,TRY1,Decoy,0,-9.61287,-7.54,-2.71,-7.563334271748579
CCOC(=O)c1ccc(NC(=O)C2=C(C)Nc3nc(CCCO)nn3[C@@H]2c2ccc(O)cc2)cc1,C09637248_decoy,TRY1,Decoy,0,-9.10451,-7.39,-1.43,-8.1129172812772
N#Cc1c(CCCNC(=O)NCCc2cc(F)cc3c2OCOC3)nn(-c2ccccc2)c1N,C58210093_decoy,TRY1,Decoy,0,-8.6048,-7.61,-2.0,-6.6697447964210514
COc1cc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3O)n2)cc(OC)c1OC,C58996921_decoy,TRY1,Decoy,0,-8.96381,-8.11,-4.38,-7.020357195895768
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)Nc1ccc2c(c1)OCO2,C58997325_decoy,TRY1,Decoy,0,-9.84133,-7.99,-3.33,-9.048562186225826
CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(OC)ccc3O)n2)s1,C58998032_decoy,TRY1,Decoy,0,-11.1999,-7.68,-4.52,-10.07542430151842
CC(C)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)s1,C59015478_decoy,TRY1,Decoy,0,-11.0223,-8.84,-2.13,-9.340552001135702
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3nc(C)cs3)n[nH]2)c(O)c1,C59039169_decoy,TRY1,Decoy,0,-10.0514,-6.32,-3.21,-6.17111870757479
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3cc(C)ccc3C)n[nH]2)c([N+](=O)[O-])cc1O,C59040092_decoy,TRY1,Decoy,0,-8.72781,-8.67,-2.44,-10.363727266880511
COc1cc(/C=N/Nc2nc(SCC(=O)NNc3ccc(Cl)cc3)n[nH]2)cc(OC)c1OC,C59830859_decoy,TRY1,Decoy,0,-10.2757,-6.16,-2.91,-6.532671254391567
C[C@@H](Sc1n[nH]c(N/N=C/c2cccc(Br)c2)n1)C(=O)NNC(=O)C1CCC1,C59878468_decoy,TRY1,Decoy,0,-9.71123,-7.98,-2.11,-8.120072945186491
CCOc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccc(OCC(N)=O)cc4)[C@@H]32)cc1OC,C09436928_decoy2,TRY1,Decoy,0,-6.32821,-6.72,,-6.062028198597051
CCOc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccc(OCC(N)=O)c(OC)c4)[C@H]32)cc1,C08569309_decoy,TRY1,Decoy,0,-6.98588,-5.39,-1.59,-5.414290920629829
CSC[C@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64163990_decoy,TRY1,Decoy,0,-7.2169,-5.97,-2.89,-5.520559516959223
COc1cc([C@@H]2C(C#N)=C(N)OC3=NN=C(CSc4ccc(C)cc4)[C@H]32)ccc1OCC(N)=O,C09370602_decoy,TRY1,Decoy,0,-8.95301,-5.48,-1.38,-5.894275948257083
Nc1ccc(OP(=O)(Oc2ccc(N)cc2)Oc2ccc(N)cc2)cc1,C02383160_decoy,TRY1,Decoy,0,-7.21741,-6.12,-0.77,-5.901844356740347
CCNc1ncnc2c1c(C(N)=S)cn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04983182_decoy,TRY1,Decoy,0,-8.14642,-4.34,-1.49,-5.587199156596834
NC(=S)Nc1nnc(-c2ccc(-c3nnc(NC(N)=S)o3)cc2)o1,C01630171_decoy,TRY1,Decoy,0,-7.19679,-6.69,-1.05,-5.054604619273162
Nc1ccc(NS(=O)(=O)CS(=O)(=O)Nc2ccc(N)cc2)cc1,C01703757_decoy,TRY1,Decoy,0,-8.07125,-7.18,-1.22,-8.583431593367406
Nc1ncnc2c1nc(NCc1ccco1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08984694_decoy,TRY1,Decoy,0,-7.08328,-7.51,-1.87,-9.231203403745766
C[C@]1(O)[C@@](C)(O)[C@](C)(Sc2ccc(N)cc2)O[C@@](C)(CO)[C@]1(C)O,C09915908_decoy,TRY1,Decoy,0,-6.75793,-6.22,-3.44,-4.744746877454647
COc1ccc(-c2[nH]c3nc(N)[nH]c(=O)c3c2-c2c(N)nc(N)[nH]c2=O)cc1F,C12371124_decoy,TRY1,Decoy,0,-7.58722,-6.44,-1.52,-5.555532690952478
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c21,C13424714_decoy,TRY1,Decoy,0,-8.62164,-8.27,-1.32,-7.718763682447832
Cc1cc(O)c(C(c2ccc(O)c(O)c2)c2c(O)cc(C)[nH]c2=O)c(=O)[nH]1,C16266818_decoy,TRY1,Decoy,0,-8.24397,-6.55,-2.57,-5.604665765728583
Oc1nc(Nc2ccccc2)nc(O)c1-c1c(O)nc(Nc2ccccc2)nc1O,C16857126_decoy,TRY1,Decoy,0,-6.89753,-7.69,-1.42,-6.9971840818581175
CC1=C(C(=O)NNC(N)=S)CC2=C(N1)c1ccccc1/C2=N\NC(N)=S,C03112227_decoy,TRY1,Decoy,0,-8.80557,-7.4,-0.74,-6.059819050345307
Nc1nc2c(nc(Nc3ccc(-c4ccccc4)cc3)n2[C@@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1,C22055818_decoy,TRY1,Decoy,0,-7.07171,-8.29,-2.99,-8.555984354480707
OC[C@H](O)[C@@H](O)[C@@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C14712143_decoy,TRY1,Decoy,0,-7.08618,-6.11,-2.42,-6.09526070337071
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(O)(O)=S)[C@@H](O)[C@@H]1O,C03871399_decoy,TRY1,Decoy,0,-6.84506,-7.63,-0.53,-7.240813739906618
C/C(CNc1nc(N)nc(N)c1/N=N/c1ccc(Cl)cc1)=N\NC(N)=O,C17422091_decoy,TRY1,Decoy,0,-7.55026,-6.96,-1.75,-6.879269663909271
NC(=O)c1c(NC(=O)CSc2nc(N)cc(=O)[nH]2)sc2c1CCC2,C12486783_decoy,TRY1,Decoy,0,-10.3361,-6.74,-1.39,-6.564633831480233
Nc1nc2c(nc(Nc3ccc(-c4ccccc4)cc3)n2[C@H]2C[C@@H](O)[C@H](CO)O2)c(=O)[nH]1,C34889521_decoy,TRY1,Decoy,0,-7.91863,-9.27,-1.04,-10.348678512755408
COC(=O)[C@]1(O)C[C@@H](O)[C@H](O)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)C1,C35465643_decoy,TRY1,Decoy,0,-8.06692,-5.19,-1.57,-5.763343826272273
OC[C@@H](O)[C@@H](O)[C@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C05047796_decoy,TRY1,Decoy,0,-6.31905,-6.72,-0.33,-5.3889064696806965
OC[C@@H](O)[C@H](O)[C@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C05047798_decoy,TRY1,Decoy,0,-6.59144,-5.4,-2.11,-6.261807879113803
C[C@@H]1O[C@@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@H]2c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O,C36020292_decoy,TRY1,Decoy,0,-8.79357,-7.28,-0.97,-6.659409346543228
Cc1[nH+]n(CCO)c(N)c1[C@]1(O)C(=O)Nc2c(Cl)cc(Cl)cc21,C06051752_decoy,TRY1,Decoy,0,-7.01161,-8.13,-1.67,-9.336231385503698
O=C1c2cc(O)cc(O)c2C(=O)c2c1cc(O)c([C@@H](CO)CCO)c2O,C06091284_decoy,TRY1,Decoy,0,-8.42667,-7.81,-1.07,-6.8624912983425
C[C@H](/C=C/[C@]1(O)[C@@H](C)C[C@@H](O)CC1(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35454673_decoy,TRY1,Decoy,0,-7.1939,-6.64,-2.76,-5.124324691837951
C[C@@H]1O[C@@H](Oc2ccc([C@@H]3Oc4cc(O)cc(O)c4C(=O)[C@@H]3O)cc2O)[C@H](O)[C@H](O)[C@H]1O,C31159341_decoy,TRY1,Decoy,0,-9.24412,-9.23,-2.87,-7.214114442559024
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c21,C28537536_decoy,TRY1,Decoy,0,-8.64421,-7.52,-3.38,-7.151775459526918
Nc1cc(S(N)(=O)=O)ccc1SSc1ccc(S(N)(=O)=O)cc1N,C03954156_decoy,TRY1,Decoy,0,-11.9689,-7.11,-2.55,-7.500978274851795
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c12,C04349776_decoy,TRY1,Decoy,0,-8.0272,-7.37,-2.05,-6.428817885145674
COc1ccc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1O,C03983954_decoy,TRY1,Decoy,0,-9.22402,-8.23,-1.38,-6.893450816165686
NC(=O)CS[C@H]1NN[C@@H]([C@@H]2C=C(c3ccc(Cl)cc3)N=N2)N1N,C38999323_decoy,TRY1,Decoy,0,-8.74744,-5.03,-0.92,-4.581991785388647
OC[C@@H]1O[C@@H](Nc2ccc(N[C@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)[C@H](O)[C@@H]1O,C36032846_decoy,TRY1,Decoy,0,-6.02377,-5.73,-1.62,-4.664836301426954
NN1[C@@H](SCc2cc(=O)[nH]c3ccccc23)NN[C@@H]1[C@@H](O)c1ccccc1,C39969325_decoy,TRY1,Decoy,0,-8.05022,-8.8,-2.44,-7.790239647759754
CC1(C)CC(Nc2ncnc(Nc3ccccc3Cl)c2N)CC(C)(C)[NH2+]1,C40760740_decoy,TRY1,Decoy,0,-7.45113,-5.73,-1.76,-4.522182109431513
NC(=O)c1c(Nc2nc(NC3CCCC3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026389_decoy,TRY1,Decoy,0,-8.80881,-7.71,-0.98,-12.065571785319024
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1cc(Br)cs1,C43291179_decoy,TRY1,Decoy,0,-8.30328,-6.67,-1.99,-10.096897732037585
COc1ccc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c2)cc1O,C44171792_decoy,TRY1,Decoy,0,-8.29196,-8.17,-4.14,-5.851912143193081
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)c3[nH]nc-2c31,C44964122_decoy,TRY1,Decoy,0,-7.42877,-6.17,-1.49,-4.75109927350591
CN(C)c1ccc(O)c2c1C[C@H]1C[C@@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)c3[nH]nc-2c31,C44964124_decoy,TRY1,Decoy,0,-7.94993,-5.9,-0.93,-5.602743509009059
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)c3[nH]nc-2c31,C44964126_decoy,TRY1,Decoy,0,-7.5383,-5.48,-3.76,-3.873804540804149
CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C([O-])[C@]3(O)c3[nH]nc-2c31,C44964128_decoy,TRY1,Decoy,0,-8.56979,-7.26,-2.9,-6.20759658077103
N/C(=N\O)c1ccc(-c2cnc(-c3ccc(/C(N)=N/O)nc3)s2)cc1,C49109350_decoy,TRY1,Decoy,0,-10.6282,-7.4,-1.33,-10.17595644608865
OC[C@@H](O)[C@H](O)[C@@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C15922352_decoy,TRY1,Decoy,0,-7.72939,-7.67,-3.01,-7.601790638965648
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(O)(O)=S)[C@@H](O)[C@H]1O,C13543489_decoy,TRY1,Decoy,0,-6.7853,-8.62,-0.95,-7.92175838171749
CC1=C(C(N)=O)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)C(C(N)=O)=C(N)O1,C58949611_decoy,TRY1,Decoy,0,-6.04806,-5.18,-2.2,-4.6226207886186375
Nn1c(N/N=C/c2ccc(O)cc2)nnc1N/N=C/c1ccc(O)cc1,C16400397_decoy,TRY1,Decoy,0,-9.03207,-8.91,-3.71,-8.11912161997688
C[NH2+][C@H](C)c1ccc(Sc2nc(N)cc(N)n2)c(Br)c1,C61700316_decoy,TRY1,Decoy,0,-8.20406,-6.17,-1.16,-7.951353372387618
COc1ccc([C@H]2CC(=O)N=C3SC(N)=c4c(N)c(C#N)c(N)nc4=C32)cc1OC,C13122003_decoy1,TRY1,Decoy,0,-6.48166,-5.53,,-3.745113139371961
COc1ccc([C@@H]2CC(O)=Nc3sc(=[NH2+])c4c(N)c(C#N)c(N)[nH+]c4c32)cc1OC,C13122002_decoy2,TRY1,Decoy,0,-7.42391,-6.92,,-5.003137219212208
COc1ccc([C@H]2CC(O)=Nc3sc(=[NH2+])c4c(N)c(C#N)c(N)[nH+]c4c32)cc1OC,C13122003_decoy2,TRY1,Decoy,0,-7.47075,-5.63,,-4.794682004290587
O=C1c2c(O)cccc2[C@H]([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21,C04214775_decoy,TRY1,Decoy,0,-8.41405,-8.57,-0.72,-8.445744914487284
Cc1nnc(-c2cnn(C)c2N)n1CCNc1[nH+]cc(C(F)(F)F)cc1Cl,C05753238_decoy,TRY1,Decoy,0,-8.80144,-6.8,-1.02,-9.901444077821184
CCCCn1c(N)c(N(CCOC)C(=O)C[NH+]2CCCCCC2)c(=O)[nH]c1=O,C06942422_decoy,TRY1,Decoy,0,-7.70536,-6.36,-1.4,-10.383802649848976
CCc1ccc2c(c1)[C@@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(CCCOC)C(=O)[C@H]31)C(=O)N2,C12901569_decoy,TRY1,Decoy,0,-8.86341,-6.37,-2.57,-6.093274386930923
CCc1ccc2c(c1)[C@@]1([NH2+][C@H]([C@@H](C)O)[C@H]3C(=O)N(CCCOC)C(=O)[C@H]31)C(=O)N2,C12901582_decoy,TRY1,Decoy,0,-7.48124,-6.39,-1.23,-5.58866318881228
C[C@H](Sc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)NC(N)=O,C16927515_decoy,TRY1,Decoy,0,-7.59975,-7.41,-1.06,-7.265966963093758
COC(=O)c1c(NC(=O)C[NH+](C)Cc2cnn(C)c2C)sc(C(N)=O)c1C,C17080387_decoy,TRY1,Decoy,0,-8.46523,-5.54,-2.54,-5.727410789156857
NS(=O)(=O)c1ccc(NCc2cc[nH+]c(N3CCOCC3)c2)c([N+](=O)[O-])c1,C26717164_decoy,TRY1,Decoy,0,-7.24689,-6.15,-1.36,-5.145515749774309
NS(=O)(=O)c1ccc(NCc2ccc(N3CCOCC3)[nH+]c2)c([N+](=O)[O-])c1,C28935773_decoy,TRY1,Decoy,0,-7.43355,-5.99,-3.55,-4.722022150423073
COc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3cnccn3)CC2)n1,C36830251_decoy,TRY1,Decoy,0,-7.51081,-6.41,-0.87,-5.427564425734448
O=C(NCCOCCO)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39601610_decoy,TRY1,Decoy,0,-9.04662,-7.14,-1.47,-7.179314279900786
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39631518_decoy,TRY1,Decoy,0,-8.67897,-5.78,-0.93,-6.527809212730477
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39631524_decoy,TRY1,Decoy,0,-8.9409,-5.86,-3.8,-6.039517464665245
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39683838_decoy,TRY1,Decoy,0,-8.3061,-6.05,-2.89,-5.90486745190786
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)S[C@@H]1NN=C(SCC(N)=O)S1,C39733844_decoy,TRY1,Decoy,0,-8.00237,-6.43,-3.9,-5.125997148400427
C[NH2+][C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@]12CCC(=O)NCCN1CCOCC1,C12531461_decoy,TRY1,Decoy,0,-8.08832,-5.29,-2.19,-5.306221927613048
C[C@H]([NH2+][C@H](C)c1ccc(OC(F)F)cc1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C44802830_decoy,TRY1,Decoy,0,-5.96573,-5.68,-3.24,-5.407204717405704
C[C@@]1(NNC(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)CCS(=O)(=O)C1,C45186648_decoy,TRY1,Decoy,0,-8.40934,-7.63,-1.82,-5.951020739586563
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C45557149_decoy,TRY1,Decoy,0,-7.06593,-6.79,-0.76,-6.277977575602344
CC[C@@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)[NH+]1CCc2ccccc2C1,C46310681_decoy,TRY1,Decoy,0,-8.44907,-7.89,-2.71,-6.244294143179073
CC[C@@H](CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)[NH+]1CCc2ccccc2C1,C46310685_decoy,TRY1,Decoy,0,-8.76583,-8.09,-2.76,-6.644800092473452
CC(C)CNC(=O)NC(=O)[C@@H](C)N1CC[NH+](CCNC(=O)c2ccco2)CC1,C46765914_decoy,TRY1,Decoy,0,-7.8065,-5.44,-2.31,-4.922352961982074
N#Cc1ccccc1OCC(=O)NNC(=O)NC1CCN(c2cccc[nH+]2)CC1,C46943763_decoy,TRY1,Decoy,0,-7.07168,-7.05,-2.73,-5.336157316498079
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)Cn2cc[nH+]c2)c2ccccc2c1=O,C47029038_decoy,TRY1,Decoy,0,-7.16138,-5.59,-0.92,-5.112090956913955
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)C(=O)NCCCn3cc[nH+]c3)c2)n1,C48598438_decoy,TRY1,Decoy,0,-8.0928,-6.66,-3.16,-5.950218190494093
CCC[C@@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)C1,C51057070_decoy,TRY1,Decoy,0,-7.5659,-6.29,-3.01,-5.136215975622596
CCC[C@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)C1,C51057072_decoy,TRY1,Decoy,0,-7.83524,-6.24,-1.15,-5.490893207712725
CCC[C@@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)C1,C51057074_decoy,TRY1,Decoy,0,-8.00737,-7.0,-2.17,-5.846023308035262
CCC[C@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)C1,C51057076_decoy,TRY1,Decoy,0,-7.44811,-6.68,-4.04,-5.256044961257588
C=CC[NH2+]CC(=O)Nc1nnc(SCC(=O)Nc2ccccc2OC)s1,C59435214_decoy,TRY1,Decoy,0,-8.70766,-6.73,-3.04,-6.905066593878562
Cc1ccc([C@@H](CNS(=O)(=O)c2ccc3[nH]c(=O)[nH]c(=O)c3c2)[NH+](C)C)cc1,C60321553_decoy,TRY1,Decoy,0,-7.18293,-7.62,-4.22,-5.291863760597231
Cc1ccc([C@H](CNS(=O)(=O)c2ccc3[nH]c(=O)[nH]c(=O)c3c2)[NH+](C)C)cc1,C60321554_decoy,TRY1,Decoy,0,-6.82243,-8.07,-2.94,-5.429376248145191
CC(C)(CNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1F)[NH+]1CCCCC1,C60441902_decoy,TRY1,Decoy,0,-9.82757,-7.18,-3.36,-5.847091519617142
CC[NH+]1CCN(c2ccccc2NC(=O)C(=O)NCCNS(C)(=O)=O)CC1,C41404777_decoy,TRY1,Decoy,0,-8.10891,-5.17,-4.47,-5.713472815934654
CC(C)NC(=O)NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39760485_decoy,TRY1,Decoy,0,-8.34002,-8.12,-1.17,-10.392650262429884
COc1ccc2c(c1)=C(CCNC(=O)CCC1=C(C)Nc3ncnn3[C@H]1O)C[NH+]=2,C63329004_decoy,TRY1,Decoy,0,-7.87898,-7.53,-3.03,-6.738584036200878
O=C(NCCNC(=O)[C@@H]1C=c2ccccc2=[NH+]1)C(=O)Nc1ccc2c(c1)OCO2,C63376343_decoy,TRY1,Decoy,0,-8.05731,-8.53,-3.26,-7.180778158423075
C[NH+]1CCN(C(C)(C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]23)CC1,C63704175_decoy,TRY1,Decoy,0,-8.18176,-5.85,-1.59,-5.669113716251425
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NC1CC[NH+](CC(F)F)CC1,C64256116_decoy,TRY1,Decoy,0,-7.68654,-5.67,-1.08,-5.411679016577105
CC(C)c1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)cnn1-c1ccccn1,C64886050_decoy,TRY1,Decoy,0,-7.28541,-5.79,-1.79,-5.067464759997402
Cc1ccc(-c2cnc(CCC(=O)NNC(=O)NCCCn3cc[nH+]c3)o2)cc1,C64886428_decoy,TRY1,Decoy,0,-8.54412,-7.99,-3.59,-7.035248934176694
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc(Cl)c2c(c1)OCCCO2,C64886725_decoy,TRY1,Decoy,0,-9.02461,-6.28,-1.44,-6.188234781052967
NC(=O)CSc1nnc(SC[C@H](O)C[NH+]2CCc3ccccc3C2)s1,C65169727_decoy,TRY1,Decoy,0,-9.02377,-6.61,-2.18,-7.002376521527562
CCn1ncnc1[C@H]1[C@H](c2ccccc2)NC[NH+]1CCNc1nc(C)cc(=O)[nH]1,C65410951_decoy,TRY1,Decoy,0,-7.45386,-7.14,-3.14,-6.532407580107912
CC(=O)Nc1cc(NC(=O)C(=O)NC[C@@H](C)[NH+]2CCCC[C@@H]2C)c(F)cc1F,C65557185_decoy,TRY1,Decoy,0,-8.02798,-6.46,-3.49,-5.502228211143189
CCCNC(=O)C[NH+]1CCC(NC(=O)C(=O)Nc2ccc(SC)nc2)CC1,C66209305_decoy,TRY1,Decoy,0,-8.7056,-5.95,-3.32,-6.152539377419039
COCCNC(=O)NC(=O)[C@H](C)[NH2+]CC1(c2ccc(OC)cc2)CCOCC1,C66392843_decoy,TRY1,Decoy,0,-7.77558,-6.96,-4.07,-6.092721284247213
NC(=O)C[NH+]1CCC[C@H](NC(=O)c2cnc(OCC(F)(F)F)c(Cl)c2)C1,C66448230_decoy,TRY1,Decoy,0,-7.70396,-6.78,-1.51,-5.322647833131805
C[NH+]1CCN(c2ncccc2CNC(=O)NCCNc2ncccc2C#N)CC1,C66891514_decoy,TRY1,Decoy,0,-7.39238,-6.43,-2.12,-5.654482767278122
CC[NH+]1CCN([C@H](C)CNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC1,C67613208_decoy,TRY1,Decoy,0,-9.21307,-5.75,-0.92,-6.825909662963061
CC1CC[NH+](C[C@H](O)CNC(=O)NCCCn2nc3n(c2=O)CCCC3)CC1,C67628123_decoy,TRY1,Decoy,0,-8.21595,-7.59,-2.8,-7.039401914583914
C[NH+](C)CCNC(=O)C[C@@H]1c2nc(Nc3cccnc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03841643_decoy,TRY1,Decoy,0,-10.2681,-6.81,-2.83,-7.013979704763993
CC(C)CN(C(=O)C[NH+]1CCN(c2ccc(O)cc2)CC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C08687883_decoy,TRY1,Decoy,0,-8.93732,-7.64,-2.06,-6.47916403073568
CC(C)[C@@H]([NH2+]CC(=O)Nc1sccc1C(N)=O)c1ccc2c(c1)OCCCO2,C08734793_decoy,TRY1,Decoy,0,-8.58923,-7.6,-1.8,-8.482432139393804
N#C/C(=C\Nc1ccc(S(=O)(=O)NC(N)=[NH2+])cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1,C09015742_decoy,TRY1,Decoy,0,-10.1838,-8.68,-1.54,-7.144669660808286
C[NH+](C)Cc1c(C(=O)N/N=C/c2ccc(O)cc2O)nnn1-c1nonc1N,C02221718_decoy,TRY1,Decoy,0,-8.75296,-7.74,-3.6,-7.04591647739975
CCC[C@H]1C[C@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)O)[NH+](C)C1,C11592629_decoy,TRY1,Decoy,0,-8.14175,-5.11,-2.61,-5.239739314656421
C[C@@H](C(=O)NC[C@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)N1CC[NH+](C)CC1,C12715938_decoy,TRY1,Decoy,0,-7.38688,-4.82,-1.6,-5.04488429037059
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12795358_decoy,TRY1,Decoy,0,-7.17295,-5.96,-0.98,-4.978896063372561
[NH3+][C@H](CS)C(=O)NCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C06021993_decoy,TRY1,Decoy,0,-11.0848,-4.61,-2.35,-6.259979479124453
O=C1N=C(O)[C@H](/C=[NH+]/[C@@H]2[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]2O)C(=O)N1c1ccc(F)cc1,C13298003_decoy,TRY1,Decoy,0,-7.92521,-7.91,-1.79,-5.7008263901287055
O=C(Nc1ccc(F)cc1F)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCC(O)CC3)[NH+]2C1,C15708737_decoy,TRY1,Decoy,0,-8.6961,-5.69,-2.05,-5.472763616132333
CC(C)[NH+]1CCN(c2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C04256219_decoy,TRY1,Decoy,0,-6.83763,-7.8,-1.48,-8.518969269613606
CCC[C@]12CN3C[C@](CCC)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323234_decoy,TRY1,Decoy,0,-8.30953,-5.4,-1.91,-6.551277361896592
[NH3+][C@@H](CS)C(=O)NCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12,C22052053_decoy,TRY1,Decoy,0,-10.195,-5.57,-3.4,-6.154714307865639
C[C@H](C(=O)NC(=O)NC1CC1)N1CC[NH+]([C@@H](C)C(=O)NC(=O)NC2CC2)CC1,C22817399_decoy,TRY1,Decoy,0,-8.25965,-7.48,-1.62,-7.803577144191575
C[C@H]1CCCC[C@H]1[NH+](CC(=O)NC(=O)NC1CC1)CC(=O)NC(=O)NC1CC1,C31469604_decoy,TRY1,Decoy,0,-8.1161,-7.05,-3.67,-8.213719612772396
Cc1ccc(OC[C@H](O)C[NH2+][C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1,C36385859_decoy,TRY1,Decoy,0,-7.42706,-6.68,-3.13,-6.969920402639982
Cc1ccc(OC[C@@H](O)C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1,C36385862_decoy,TRY1,Decoy,0,-7.88798,-7.05,-2.57,-7.6990822634876706
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323209_decoy,TRY1,Decoy,0,-8.97421,-6.24,-3.57,-6.739105234498536
Nc1nc2c(nc(SCC[NH3+])n2[C@@H]2O[C@@H]3CO[P@](O)(=S)O[C@H]3[C@H]2O)c(=O)[nH]1,C38580923_decoy,TRY1,Decoy,0,-8.93812,-7.21,-1.62,-8.06766973451763
C/C=C/C=C/C=C\C(=O)N[C@H](C(=O)O[C@H](C1=C2C=CC(Cl)=C[C@@H]2N=C1)[C@H]1NC(=O)CNC1=O)[C@@H](C)[NH3+],C39559754_decoy,TRY1,Decoy,0,-8.75477,-5.95,-1.61,-5.872810387648139
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@H](c2cc(C)on2)ON1,C39656098_decoy,TRY1,Decoy,0,-8.21162,-8.9,-2.07,-7.529119583666249
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39661847_decoy,TRY1,Decoy,0,-8.14522,-7.02,-3.02,-6.168900266609736
Cc1ccsc1C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661902_decoy,TRY1,Decoy,0,-8.97027,-6.13,-2.87,-6.131258388936015
CCOC(=O)C1=C(N)OC2=c3ccccc3=[NH+]C(=O)[C@H]2[C@H]1c1ccc(O)c(O)c1,C39767161_decoy,TRY1,Decoy,0,-6.99472,-6.26,-4.49,-5.100341721997429
Cc1cc2c(c(=O)n1CC[NH+](C)C)[C@]1(C(=O)N(CC(N)=O)c3ccccc31)C(C#N)=C(N)O2,C39919030_decoy,TRY1,Decoy,0,-6.69005,-4.71,-3.19,-4.566196271834868
Cc1cc2c(c(=O)n1CC[NH+](C)C)[C@@]1(C(=O)N(CC(N)=O)c3ccccc31)C(C#N)=C(N)O2,C39919031_decoy,TRY1,Decoy,0,-5.79069,-6.64,-0.89,-4.788843880169396
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)Cl)[NH+](C)C1,C39945941_decoy,TRY1,Decoy,0,-8.10615,-5.22,-2.19,-5.280368154994148
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(Br)cc1,C40782324_decoy,TRY1,Decoy,0,-6.94012,-5.52,-2.31,-4.844255259247217
CC[NH+](CC)CCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1,C41026388_decoy,TRY1,Decoy,0,-9.18778,-5.88,-1.87,-7.669641864512505
CCC(CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCC1,C41327685_decoy,TRY1,Decoy,0,-8.56192,-6.76,-3.87,-7.098166249587545
CCOc1ccc(Nc2c(C)c(NCCCCC[NH3+])c(C#N)c3ccnn23)cc1,C45244882_decoy,TRY1,Decoy,0,-9.02857,-7.06,-1.35,-7.967069235806712
NC(=O)c1c(NC(=O)C[NH+]2CCC[C@H](C(=O)NC3CC3)C2)sc2c1CCC2,C51047838_decoy,TRY1,Decoy,0,-10.1772,-6.92,-1.35,-7.340245020108022
CCCNC(=O)C[NH+](CCC)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C53366477_decoy,TRY1,Decoy,0,-9.55466,-5.5,-3.31,-6.4267254725369405
C[C@H]([NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1ccccc1C#N,C56159827_decoy,TRY1,Decoy,0,-7.35957,-7.53,-2.02,-6.975789218231218
C[C@H]([NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1ccccc1C#N,C56159828_decoy,TRY1,Decoy,0,-7.27217,-7.86,-2.98,-6.481440930740917
CC[NH+](CC)[C@@H](C)CNC(=O)NNC(=O)Nc1ccc(Br)cc1,C56624086_decoy,TRY1,Decoy,0,-8.54456,-4.54,-2.13,-5.114695591453633
CC[NH+](CC)[C@H](C)CNC(=O)NNC(=O)Nc1ccc(Br)cc1,C56624087_decoy,TRY1,Decoy,0,-7.66133,-6.04,-2.01,-6.749614423166812
CC1CC[NH+](CCNC(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1,C49203697_decoy,TRY1,Decoy,0,-8.52222,-6.94,-2.98,-6.199778618228761
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1N[C@H](COc3ccccc3NC(C)=O)NO1)C[NH+]=2,C63818741_decoy,TRY1,Decoy,0,-7.92047,-7.78,-2.26,-7.819181749261763
NC(=O)CS[C@@H]1NN[C@H](N2CCN(C(=O)CC3=c4ccccc4=[NH+]C3)CC2)S1,C64409698_decoy,TRY1,Decoy,0,-8.87152,-6.74,-1.6,-6.773962652811743
O=C(CCNC(=O)c1c[nH]c2ccccc12)NNC(=O)NCCCn1cc[nH+]c1,C64885939_decoy,TRY1,Decoy,0,-8.20837,-7.38,-4.36,-6.781970256593228
CC[NH+](CC)[C@H](CNC(=O)C[C@H](NC(N)=O)c1ccccc1C)c1ccco1,C67275146_decoy,TRY1,Decoy,0,-7.02215,-6.6,-2.63,-5.7239230240075365
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C67380625_decoy,TRY1,Decoy,0,-8.94556,-6.5,-2.68,-5.825050902715497
COCCn1c(=S)[nH]c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C03985211_decoy,TRY1,Decoy,0,-7.5825,-6.58,-2.23,-5.093264508591669
OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C04102353_decoy,TRY1,Decoy,0,-8.43788,-8.62,-4.8,-7.632866581851571
CCOc1c(Cl)cc(Cl)cc1C[NH2+]CCNC(=O)c1nonc1N,C04384160_decoy,TRY1,Decoy,0,-8.53078,-7.21,-2.51,-7.812857674395941
C[C@H]([NH2+]C[C@H](O)COc1ccc(C#N)cc1)c1ccc(S(N)(=O)=O)cc1,C09512761_decoy,TRY1,Decoy,0,-9.67992,-7.26,-0.98,-6.658134287365355
C[C@@H]([NH2+]C[C@H](O)COc1ccc(C#N)cc1)c1ccc(S(N)(=O)=O)cc1,C09512763_decoy,TRY1,Decoy,0,-8.5515,-7.23,-2.38,-6.512964784864675
CCOc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCCC2)ccc1O,C12411455_decoy,TRY1,Decoy,0,-10.0308,-7.56,-3.49,-7.6842775088097826
Nc1nc(NCC[NH+]2CCOCC2)nc(Nc2ccccc2F)c1[N+](=O)[O-],C04305914_decoy,TRY1,Decoy,0,-6.27735,-6.93,-0.96,-8.093873173374229
Nc1nc(NCC[NH+]2CCOCC2)nc(Nc2cccc(F)c2)c1[N+](=O)[O-],C04306360_decoy,TRY1,Decoy,0,-5.83878,-7.06,-0.2,-6.78810822817067
[NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13424994_decoy,TRY1,Decoy,0,-8.51941,-7.17,-3.15,-7.852894966290322
NC(=O)COc1ccc(Cl)cc1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1,C20873352_decoy,TRY1,Decoy,0,-8.90425,-5.96,-2.15,-6.406726087022715
COc1cc(CCC2CC[NH+](Cc3nc(N)nc(N)n3)CC2)cc(OC)c1,C08751096_decoy,TRY1,Decoy,0,-8.29695,-6.76,-1.79,-7.648137971896478
C[C@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+]1CCC(C(N)=O)CC1,C23259083_decoy,TRY1,Decoy,0,-7.02292,-6.42,-2.89,-5.454195439116583
C[C@@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+]1CCC(C(N)=O)CC1,C23259086_decoy,TRY1,Decoy,0,-8.04209,-6.65,-2.75,-5.655887487650595
Cc1ccc2n(c1)cc(-c1ccc(/C=N/Nc3nc(N)nc(N)n3)cc1)[n+]2C,C26836850_decoy,TRY1,Decoy,0,-7.26151,-7.66,-1.19,-4.890226765266751
CC(C)Cn1c(N)c(C(=O)C[NH2+][C@@H](C)c2ccccc2Cl)c(=O)[nH]c1=O,C28955205_decoy,TRY1,Decoy,0,-7.4661,-6.57,-2.93,-6.955135843463559
CCNc1nc(NNC(=S)Nc2ccc([N+](=O)[O-])cc2)nc(NCC)[nH+]1,C35682763_decoy,TRY1,Decoy,0,-6.95694,-5.38,-1.4,-5.066650862923162
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C36593227_decoy,TRY1,Decoy,0,-5.76278,-7.46,-1.63,-7.356678584198029
[NH3+]CCCCCCN[C@@H]1N=C2C(=O)N=CN=C2N1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345365_decoy,TRY1,Decoy,0,-7.87149,-4.82,-3.4,-5.7535801554911
COc1ccc(Cl)cc1Nc1ncnc(NCCCn2cc[nH+]c2)c1N,C40702612_decoy,TRY1,Decoy,0,-8.42265,-4.86,-3.51,-5.894310738406686
C[NH+]1CCN(Nc2ncnc(Nc3ccccc3Br)c2N)CC1,C40756887_decoy,TRY1,Decoy,0,-8.26333,-6.11,-1.48,-5.891996657030383
C[NH+]1CCN(Nc2ncnc(Nc3ccc(Br)cc3)c2N)CC1,C40756900_decoy,TRY1,Decoy,0,-8.0849,-4.68,-0.71,-4.325383530218381
C[NH+]1CCN(Nc2ncnc(Nc3cccc(Br)c3)c2N)CC1,C40756990_decoy,TRY1,Decoy,0,-8.05138,-5.53,-0.63,-4.776728645286413
Cc1ccc2cccc(Nc3ncnc(NCCCn4cc[nH+]c4)c3N)c2n1,C40758780_decoy,TRY1,Decoy,0,-7.37504,-6.22,-1.43,-5.934942121984625
Cc1ccc2c(Nc3ncnc(NNC(=O)c4ccco4)c3N)cccc2[nH+]1,C40794610_decoy,TRY1,Decoy,0,-7.46638,-8.12,-1.6,-8.26350217105617
Nc1c(NCCCn2cc[nH+]c2)ncnc1NNC(=O)COc1ccccc1,C40795407_decoy,TRY1,Decoy,0,-7.5481,-5.96,-3.08,-5.451280308704003
COc1ccc(OCC(=O)NNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C42910419_decoy,TRY1,Decoy,0,-7.25545,-4.72,-3.78,-4.662905509873019
CC1(C)CC(NC(=O)NNC(=O)COc2ccccc2C#N)CC(C)(C)[NH2+]1,C42911043_decoy,TRY1,Decoy,0,-7.60362,-6.32,-4.74,-5.177335561906796
CC(C)[NH+](CCNC(=O)NNC(=O)c1cc(Br)c[nH]1)C(C)C,C43065155_decoy,TRY1,Decoy,0,-8.51682,-6.19,-0.38,-6.1778766030209
NC(=O)C[C@H]([NH3+])c1cc([N+](=O)[O-])ccc1Sc1nc2cccnc2s1,C44254155_decoy,TRY1,Decoy,0,-8.23876,-4.83,-1.93,-5.486385881400906
CC[C@H](CNC(=O)NNC(=O)C(=O)NC1CC1)[NH+]1CCc2ccccc2C1,C46312572_decoy,TRY1,Decoy,0,-8.61892,-6.51,-1.86,-5.705750506869586
CCC(CC)(CNC(=O)NNC(=O)c1cc(Br)c[nH]1)[NH+](C)C,C46950610_decoy,TRY1,Decoy,0,-7.40824,-5.3,-1.21,-5.1612441447198645
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1cccs1,C48743420_decoy,TRY1,Decoy,0,-8.04344,-6.76,-1.94,-6.186276553546742
Nc1[nH]nc2nc(NCCOCCO)c3c(c12)CC[NH+](C1CCCCC1)C3,C08554336_decoy,TRY1,Decoy,0,-8.37467,-7.69,-0.96,-9.506125225566448
COc1ccc(N2C(=O)/C(=C/N[C@H]3CCCC[C@H]3[NH3+])C(=O)NC2=S)cc1,C20329261_decoy,TRY1,Decoy,0,-9.0535,-6.25,-1.09,-5.607394412869303
[NH3+][C@H]1CCCC[C@H]1N/C=C1\C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393249_decoy1,TRY1,Decoy,0,-8.48833,-7.03,,-6.398863880243493
[NH3+][C@@H]1CCCC[C@@H]1N/C=C1\C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393240_decoy1,TRY1,Decoy,0,-9.84564,-6.04,,-5.833233805838673
O=C(CNc1ccccc1[NH+]1CCC(O)CC1)NC(=O)NCC(F)(F)F,C55887897_decoy,TRY1,Decoy,0,-6.51046,-7.09,0.01,-7.336256580394179
Cc1cccc(NC(=O)C[NH+](C)CC(=O)Nc2sccc2C(N)=O)c1C,C16637358_decoy,TRY1,Decoy,0,-8.26164,-7.48,-1.38,-7.255509782298683
CC(C)(CO)[NH2+]CC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-],C58866900_decoy,TRY1,Decoy,0,-5.64489,-6.29,-2.11,-4.605288344629702
COc1cccc2cc(C(N)=O)/c(=[NH+]/c3ccc(S(N)(=O)=O)cc3)oc12,C59170349_decoy,TRY1,Decoy,0,-7.4471,-6.37,-1.3,-4.809788131695846
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CC[NH+](C)C)nc1,C62504802_decoy,TRY1,Decoy,0,-8.15752,-5.27,-3.63,-5.017985696451037
N#Cc1cc2c(N)c(C(=O)NCCC3=c4ccccc4=[NH+]C3)sc2nc1N,C63529309_decoy,TRY1,Decoy,0,-9.25049,-8.35,-0.6,-6.8261358605758415
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1ccccc1Nc1ccccc1,C64886643_decoy,TRY1,Decoy,0,-7.73624,-7.04,-3.54,-6.5595506190074016
CCCCCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115427_decoy,TRY1,Decoy,0,-8.57983,-4.26,-0.84,-5.934402721837084
CCOCCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115443_decoy,TRY1,Decoy,0,-7.58863,-4.25,-2.31,-5.703541079369948
CC(=O)NC[C@H]1CCC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1,C67418239_decoy,TRY1,Decoy,0,-8.69249,-5.66,-1.81,-5.791114798408513
COc1cc([C@H](CC(=O)c2c(O)c3ccccc3n(C)c2=O)[NH2+]CCO)cc(OC)c1O,C03846585_decoy,TRY1,Decoy,0,-8.58156,-7.81,-1.46,-6.387530314258339
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)O)[NH+](C)C1,C05469942_decoy,TRY1,Decoy,0,-7.6363,-6.91,-2.31,-6.95614036658914
CC[NH+](CC)C[C@@H](O)CNc1ncnc2c1ncn2Cc1ccc(S(N)(=O)=O)cc1,C01703641_decoy,TRY1,Decoy,0,-7.9523,-5.15,-3.86,-5.296529322957091
CCOc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2)cc(Cl)c1OCC(N)=O,C06870219_decoy,TRY1,Decoy,0,-8.26026,-5.88,-4.15,-5.152639107815627
C[NH+](CC(=O)Nc1cc(C(N)=O)cc(C(N)=O)c1)Cc1cc([N+](=O)[O-])ccc1Cl,C11012591_decoy,TRY1,Decoy,0,-7.04914,-7.72,-1.65,-7.206830336594415
COc1ccc(Cl)cc1NC(=O)C[NH+](C)CC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12542668_decoy,TRY1,Decoy,0,-8.22759,-7.14,-4.57,-7.948479081229422
C[NH+](CCC(=O)Nc1sccc1C(N)=O)CC(=O)Nc1ccc(Cl)c(Cl)c1,C13004125_decoy,TRY1,Decoy,0,-9.74754,-7.2,-2.23,-7.842496017586837
COCCN(C(=O)C[NH+](C)CC(=O)Nc1ccccc1SC)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13150478_decoy,TRY1,Decoy,0,-7.32282,-6.68,-2.38,-6.507097453479829
CNC(=O)c1cc2c(Oc3ccc(/C=C/C(=O)NCC[NH+](CCO)CCO)cc3)cncc2s1,C13864434_decoy,TRY1,Decoy,0,-8.9722,-5.86,-3.68,-5.367570553224859
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)CC(=O)Nc1ccccc1C(=O)NCc1ccco1,C15420244_decoy,TRY1,Decoy,0,-6.74971,-8.0,-2.83,-8.017595776761688
O=C(NCC[NH+]1CCOCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3cccc(C(F)(F)F)c3)S[C@@H]21,C08636331_decoy,TRY1,Decoy,0,-9.2806,-8.16,-1.56,-8.939741255857339
COc1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C08636334_decoy,TRY1,Decoy,0,-9.4587,-6.51,-1.82,-6.430294586424218
COc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)cc(Br)c1OCC(N)=O,C16195361_decoy,TRY1,Decoy,0,-8.61769,-7.02,-2.91,-9.162732899564146
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)c(C)c1,C23259806_decoy,TRY1,Decoy,0,-7.3783,-7.21,-4.4,-5.722533110968737
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c(C)c1,C23259810_decoy,TRY1,Decoy,0,-7.35437,-7.47,-3.86,-5.9036723202200605
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](C(=O)[C@H]([NH3+])CC(N)=O)C2,C27324853_decoy,TRY1,Decoy,0,-9.40755,-8.95,-2.2,-10.367183100797815
Cc1ccc(S(=O)(=O)NCC(=O)N/N=C/c2cn(C[C@@H](O)C[NH2+]CCCO)c3ccccc23)cc1,C28295693_decoy,TRY1,Decoy,0,-8.68275,-5.95,-4.27,-6.2222310911193786
COc1ccccc1NC(=O)C1CC[NH+]([C@@H](C)C(=O)Nc2sccc2C(N)=O)CC1,C29907658_decoy,TRY1,Decoy,0,-8.13758,-5.65,-1.51,-5.914922380739147
[NH3+]CCCC[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cc(Cl)ccc2O)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C34387433_decoy,TRY1,Decoy,0,-9.60677,-5.19,-3.24,-6.703105111415872
[NH3+]CCCC[C@@]1(C(=O)[O-])[NH2+][C@H](c2cc(Cl)ccc2O)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C34387434_decoy,TRY1,Decoy,0,-8.58319,-6.79,-1.9,-7.047898219963675
[O-][C@@H](COc1ccc(OC[C@@H](O)C[NH2+]C[C@@H]2CCCO2)cc1)[NH2+]C[C@@H]1CCCO1,C33927854_decoy,TRY1,Decoy,0,-9.16867,-5.24,-2.54,-6.390024323077803
[O-][C@@H](COc1ccc(OC[C@@H](O)C[NH2+]C[C@H]2CCCO2)cc1)[NH2+]C[C@@H]1CCCO1,C33927856_decoy,TRY1,Decoy,0,-8.97698,-5.34,-2.85,-5.255494563713053
COCCNC(=S)/N=C(\Nc1nc(C)cc(C)n1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C14158025_decoy,TRY1,Decoy,0,-7.66128,-5.1,-2.61,-5.014104552243955
C[NH2+]C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)COC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1,C33738406_decoy,TRY1,Decoy,0,-9.73363,-6.99,-2.02,-8.668847445867698
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C03978029_decoy,TRY1,Decoy,0,-9.27459,-5.64,-3.74,-6.474166176911249
COc1ccc(/C=N\NC(=[NH2+])c2nonc2N)cc1CSc1nc2ccccc2o1,C38803962_decoy,TRY1,Decoy,0,-10.3638,-8.29,-2.67,-8.84431259813531
CCOc1ccc(NC(=[NH2+])Nc2nc(CS[C@@H]3NN=C(C)S3)cc(=O)[nH]2)cc1,C38964177_decoy,TRY1,Decoy,0,-8.90966,-5.86,-2.84,-5.457329425948746
CCOc1ccc(NC(=[NH2+])Nc2nc(CS[C@H]3NN=C(C)S3)cc(=O)[nH]2)cc1,C38964178_decoy,TRY1,Decoy,0,-9.3895,-6.71,-0.69,-7.22597558190422
COCCC(=O)N[C@@H]1c2cc(NCC[C@H](C)O)c[nH+]c2N(CCc2c[nH]c3ccccc23)[C@@H]1C(=O)OC,C39352474_decoy,TRY1,Decoy,0,-8.4246,-5.95,-3.28,-6.128148633981812
C=CCN1C([NH3+])=CC(O)=N[C@H]1SCC(=O)Nc1nc(CC(=O)OCC)cs1,C39355849_decoy,TRY1,Decoy,0,-8.23358,-6.05,-2.69,-6.174814152149419
O=C(NC[C@@H]1N[C@@H](c2ccccc2)CS1)c1ccc(C[NH+]2CCC[C@H]2CO)[nH]c1=O,C39445386_decoy,TRY1,Decoy,0,-8.26074,-6.96,-3.41,-5.496187188942555
COCCNC(=O)CC[C@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]Cc1ccc(CO)o1,C35442599_decoy,TRY1,Decoy,0,-8.21854,-5.12,-1.76,-5.4694916206871325
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1c(F)cccc1Cl,C40744448_decoy,TRY1,Decoy,0,-7.37787,-7.39,-2.35,-7.724818276352193
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(OCc2ccc(F)cc2Cl)cc1,C40744454_decoy,TRY1,Decoy,0,-8.12013,-6.17,-1.93,-5.407903225109587
Nc1c(NCCCn2cc[nH+]c2)ncnc1NNC(=O)COc1ccc(Cl)cc1Cl,C40795590_decoy,TRY1,Decoy,0,-8.99654,-6.65,-2.13,-6.015887498813973
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)NCC(=O)c2ccc(Br)cc2)co1,C33911817_decoy,TRY1,Decoy,0,-9.39356,-8.64,-2.06,-8.860540262953432
COC(=O)c1ccccc1Sc1c([C@H]([NH3+])CC(N)=O)c(C(F)(F)F)nn1C,C44253920_decoy,TRY1,Decoy,0,-5.36501,-5.78,-3.79,-4.801741372661264
COC(=O)c1ccccc1Sc1c([C@@H]([NH3+])CC(N)=O)c(C(F)(F)F)nn1C,C44253923_decoy,TRY1,Decoy,0,-9.72787,-4.55,-3.19,-6.026468012622495
C/C=C/C=C/C=C\C(=O)N[C@H](C(=O)O[C@@H](c1c[nH]c2cc(Cl)ccc12)[C@H]1NC(=O)CNC1=O)[C@@H](C)[NH3+],C44606392_decoy,TRY1,Decoy,0,-8.91414,-8.18,-2.68,-9.41763001811529
O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)[NH2+]C[C@H](O)COCc2ccc3c(c2)OCO3)cc1,C07238871_decoy,TRY1,Decoy,0,-6.89779,-6.84,-2.02,-6.017584028480706
CC[NH+](CC)CCCNC(=S)NNC(=O)c1cnn2c1N[C@@H](c1ccccc1)C[C@@H]2C(F)F,C20613895_decoy,TRY1,Decoy,0,-7.31593,-8.23,-1.89,-7.509893603189285
Cc1cc(C)nc(/N=C(/NC(=S)Nc2ccccc2Cl)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161167_decoy,TRY1,Decoy,0,-9.73585,-7.74,-2.83,-7.443252998260754
COc1cc(/C=N/[NH+]=C(\N)c2nonc2N)cc(Br)c1OCc1ccccc1C,C13477566_decoy1,TRY1,Decoy,0,-8.7719,-8.13,,-10.305567490469688
O=C(CC[C@@H]1NN[C@H](C(=O)Nc2ccccc2)S1)NCCC1=c2ccccc2=[NH+]C1,C63686257_decoy,TRY1,Decoy,0,-9.07754,-7.39,-1.42,-6.578403823554511
COc1cc([C@@H](CC(=O)c2c(O)c3ccccc3n(C)c2=O)[NH2+]CCO)cc(OC)c1O,C03846586_decoy,TRY1,Decoy,0,-8.17556,-7.09,-1.81,-5.850826099969045
NNC(=O)C1=NO[C@H](CN(CCNc2[nH+]cc(C(F)(F)F)cc2Cl)S(=O)(=O)c2ccc(F)cc2)C1,C06182544_decoy,TRY1,Decoy,0,-9.62816,-8.51,-2.24,-9.18556145614764
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1,C09194345_decoy,TRY1,Decoy,0,-8.98653,-8.13,-2.71,-8.20156644069247
CC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1,C09884163_decoy,TRY1,Decoy,0,-8.26546,-7.9,-2.34,-6.853611782685169
CC[NH+](CC)CCSc1nc(N)c(NC(=O)c2ccc(Br)o2)c(=O)[nH]1,C10243481_decoy,TRY1,Decoy,0,-7.63179,-5.75,-1.66,-7.17734534501033
CC[NH+](CC)C[C@H](O)CNc1ncnc2c1ncn2Cc1ccc(S(N)(=O)=O)cc1,C12410613_decoy,TRY1,Decoy,0,-9.09215,-6.11,-2.35,-5.649669407866948
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OCC(N)=O,C16688328_decoy,TRY1,Decoy,0,-7.76541,-6.63,-1.07,-6.392588235274836
CCOC(=O)C1=C(C[NH2+]C2CC(C)(C)NC(C)(C)C2)NC(=O)N[C@@H]1c1ccc2c(c1)OCO2,C12412577_decoy,TRY1,Decoy,0,-7.31099,-6.32,-1.78,-5.616902150339526
CC[NH+](CC)CCCN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC1CCCCC1)c1ccc(F)cc1,C19927693_decoy,TRY1,Decoy,0,-9.47086,-7.58,-3.61,-9.331142000754635
C/C(=N\Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1)c1cccs1,C20835870_decoy,TRY1,Decoy,0,-9.6971,-7.87,-3.55,-8.530504891393619
CC1(C)CC(NC(=O)CSc2nnc(N/N=C/c3cccc(O)c3)n2N)CC(C)(C)[NH2+]1,C20915705_decoy,TRY1,Decoy,0,-8.09344,-6.9,-1.89,-5.740747620818194
COc1ccc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c(OC)c1,C14156522_decoy,TRY1,Decoy,0,-10.5183,-7.82,-2.06,-9.90751757797385
Cc1cc(C)nc(N/C(=N/C(=S)NC[C@@H]2CCCO2)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1,C14158062_decoy,TRY1,Decoy,0,-9.87778,-6.62,-1.34,-6.430185668491137
CC(C)(C)NC(=O)C[NH+]1CCCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C22782017_decoy,TRY1,Decoy,0,-8.91234,-7.8,-2.46,-5.975998426493928
Cc1ccc(NC(=O)C[NH+]2CCN([C@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1,C23376963_decoy,TRY1,Decoy,0,-9.44132,-7.7,-1.38,-6.961200469496016
Cc1ccc(NC(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1,C23376965_decoy,TRY1,Decoy,0,-9.4199,-7.96,-2.87,-7.183258758015682
C=CCNC(=O)C[NH+]1CCN(CC(=O)N(CCCC)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)CC1,C27559312_decoy,TRY1,Decoy,0,-8.5736,-6.77,-2.66,-6.882276875923993
Cc1ccc(S(=O)(=O)NCC(=O)N/N=C/c2cn(C[C@H](O)C[NH2+]CCCO)c3ccccc23)cc1,C28295695_decoy,TRY1,Decoy,0,-8.99259,-6.89,-2.89,-6.293081764719188
COc1ccc2c(CCNC(=O)CS[C@@H]3N[NH2+]NN3c3cccc(Cl)c3)c[nH]c2c1,C39021651_decoy,TRY1,Decoy,0,-9.54114,-7.67,-2.02,-7.760340866933857
COc1ccc2c(CCNC(=O)CS[C@H]3N[NH2+]NN3c3cccc(Cl)c3)c[nH]c2c1,C39021654_decoy,TRY1,Decoy,0,-8.8965,-6.08,-1.44,-5.332999528062481
COCCC(=O)N[C@@H]1c2cc(NCC[C@@H](C)O)c[nH+]c2N(CCc2c[nH]c3ccccc23)[C@@H]1C(=O)OC,C39352475_decoy,TRY1,Decoy,0,-8.33626,-6.88,-2.97,-6.28236655881688
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(N[C@@H](C)C(C)(C)O)c[nH+]c2N1CCc1c[nH]c2ccccc12,C39352577_decoy,TRY1,Decoy,0,-8.01944,-7.61,-1.71,-7.151991253152775
O=C(NC[C@@H]1N[C@H](c2ccccc2)CS1)c1ccc(C[NH+]2CCC[C@H]2CO)[nH]c1=O,C39445385_decoy,TRY1,Decoy,0,-9.33368,-7.67,-1.52,-6.300703937615824
O=C(NC[C@H]1N[C@H](c2ccccc2)CS1)c1ccc(C[NH+]2CCC[C@H]2CO)[nH]c1=O,C39445387_decoy,TRY1,Decoy,0,-9.64266,-6.64,-1.76,-6.550249972413635
O=S(=O)(Oc1ccccc1)c1ccc([C@@H](CNc2ccccc2O)N2CC[NH2+][C@H](O)C2)cc1,C39534291_decoy,TRY1,Decoy,0,-8.93645,-8.71,-3.32,-7.868882370160179
O=S(=O)(Oc1ccccc1)c1ccc([C@H](CNc2ccccc2O)N2CC[NH2+][C@H](O)C2)cc1,C39534292_decoy,TRY1,Decoy,0,-9.51009,-6.66,-1.4,-8.166327487579357
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661817_decoy,TRY1,Decoy,0,-9.7894,-6.99,-2.04,-6.198476870677581
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661855_decoy,TRY1,Decoy,0,-9.6869,-9.02,-2.93,-9.800452379565169
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C39936967_decoy,TRY1,Decoy,0,-7.38255,-5.92,-2.17,-5.360198775638607
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NCc3ccc(CO)o3)C[NH+]12)NCc1ccc(F)cc1,C22922266_decoy,TRY1,Decoy,0,-8.06851,-5.82,-1.04,-5.644230361163465
Cc1c(C[NH2+]CCNC(=O)c2nonc2N)c2ccccc2n1Cc1ccccc1Cl,C40744396_decoy,TRY1,Decoy,0,-6.71762,-8.24,-3.77,-6.167602392435769
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCc1ccc(F)cc1Cl,C40744537_decoy,TRY1,Decoy,0,-7.64281,-7.69,-2.84,-6.610582076446117
C/C=C/C=C/C=C\C(=O)N[C@@H](C(=O)O[C@@H](c1c[nH]c2cc(Cl)ccc12)[C@H]1NC(=O)CNC1=O)[C@@H](C)[NH3+],C44606396_decoy,TRY1,Decoy,0,-9.22339,-6.3,-1.27,-6.311771020072976
COCCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]Cc1ccc(CO)o1,C44681603_decoy,TRY1,Decoy,0,-8.86002,-5.82,-1.13,-9.737039127544106
CC[NH+](CC)CCCNC(=S)NNC(=O)c1cnn2c1N[C@H](c1ccccc1)C[C@H]2C(F)F,C20613894_decoy,TRY1,Decoy,0,-8.79916,-6.78,-2.95,-5.919144666508488
C[NH+](CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)CC(=O)Nc1ccccc1Cl,C30999508_decoy,TRY1,Decoy,0,-10.3864,-7.09,-2.33,-8.609275126861576
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(C)c(C)c2)NCCc2c[nH]c[nH+]2)n1,C14156512_decoy,TRY1,Decoy,0,-9.66562,-5.82,-2.54,-6.312542214017448
COc1ccc(OC)c(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c1,C14156524_decoy,TRY1,Decoy,0,-9.29413,-7.21,-2.82,-9.235308855556482
Cc1cc(C)nc(N/C(=N/C(=S)Nc2cccc(OC(F)(F)F)c2)NCCc2c[nH]c[nH+]2)n1,C14156570_decoy,TRY1,Decoy,0,-8.94403,-7.64,-2.86,-8.626447604306136
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3ccc(C)c(Cl)c3)n2)s1,C13634088_decoy,TRY1,Decoy,0,-10.3379,-6.02,-1.49,-7.883912151860364
COc1cc(/C=N/[NH+]=C(/N)c2nonc2N)cc(Br)c1OCc1ccccc1C,C13477566_decoy2,TRY1,Decoy,0,-8.68594,-6.38,,-6.771829472738094
O=C(CC[C@H]1NN[C@H](C(=O)Nc2ccccc2)S1)NCCC1=c2ccccc2=[NH+]C1,C63686255_decoy,TRY1,Decoy,0,-8.66148,-8.53,-1.38,-6.33837296704411
CCc1ccccc1Nc1nc(N)nc(CN2C(=O)N[C@@H](CC3=c4ccccc4=[NH+]C3)C2=O)n1,C63726269_decoy,TRY1,Decoy,0,-7.40935,-9.17,-3.11,-6.580110868385706
COc1cccc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c1,C18097751_decoy,TRY1,Decoy,0,-11.6757,-8.27,-1.87,-11.04603662114762
[NH3+]CCCCNc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05022611_decoy,TRY1,Decoy,0,-7.07901,-7.33,-1.78,-6.79703074938057
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@H]1C[C@@H]2Cn1cc(C[NH3+])nn1,C08299048_decoy,TRY1,Decoy,0,-8.54066,-5.97,-1.69,-7.760216265107672
[NH3+]CCNc1ccc(NCC[NH3+])c2c1C(=O)c1ccncc1C2=O,C01535903_decoy,TRY1,Decoy,0,-8.19439,-5.61,-1.51,-7.605357833696551
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCc2cccc([N+](=O)[O-])c2)c1,C03954275_decoy,TRY1,Decoy,0,-6.77653,-8.35,-1.82,-6.8464398814024365
Nc1ncnc2c1nc(NCC[NH3+])n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09886051_decoy,TRY1,Decoy,0,-6.75461,-6.87,-0.83,-7.002139993487576
Nc1ncnc2c1nc(NCC[NH3+])n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09886053_decoy,TRY1,Decoy,0,-6.41889,-6.65,-0.48,-7.93088604339928
[NH3+]CCCCNc1nc2c(=O)[nH]cnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09886088_decoy,TRY1,Decoy,0,-7.42758,-6.69,-1.73,-7.396785731547606
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCC(C(N)=O)CC1,C12791451_decoy,TRY1,Decoy,0,-7.72669,-5.32,-2.89,-5.065508733804615
Nc1nc(SCC[NH3+])nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05733439_decoy,TRY1,Decoy,0,-7.87061,-7.04,-1.59,-8.034452781945099
Nc1ncnc2c1nnn2[C@@H]1O[C@@H](CSCC[NH3+])[C@@H](O)[C@@H]1O,C05011588_decoy,TRY1,Decoy,0,-8.41405,-7.02,-2.31,-7.38246059121868
Nc1cc[nH+]c(NCCCCCCCCCCNc2cc(N)cc[nH+]2)c1,C13740386_decoy,TRY1,Decoy,0,-9.40833,-6.65,-3.5,-6.744309536644042
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)C2=O,C19312830_decoy,TRY1,Decoy,0,-8.13843,-5.37,-0.93,-5.916076651657159
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19322870_decoy,TRY1,Decoy,0,-7.91399,-5.75,-1.16,-7.0010257035674845
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@@H]3[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)C2O,C19331315_decoy,TRY1,Decoy,0,-7.05625,-5.78,-1.56,-5.256879807677312
CCC[NH+](CCC)Cc1c(C(=O)NN)nnn1-c1nonc1N,C03627636_decoy,TRY1,Decoy,0,-6.55976,-6.38,-2.96,-7.470412743169236
Cc1cc(O)oc2cc(=[NH+]C(=O)[C@@H]([NH3+])CCCNC(N)=O)ccc1-2,C25757209_decoy,TRY1,Decoy,0,-8.1824,-7.13,-3.5,-6.694706887929539
N/C(=N\O)c1ccc(-c2ccc(-c3ccc(C(=[NH2+])NO)cc3)o2)cn1,C27548774_decoy,TRY1,Decoy,0,-9.39438,-8.59,-1.27,-10.752464703553002
Nc1ccn(CC[NH2+]CCn2cnc3nc(N)[nH]c(=O)c32)c(=O)n1,C17210316_decoy,TRY1,Decoy,0,-7.34139,-7.38,-1.14,-7.022751731149074
NC(=[NH2+])SCC(=O)n1ccc(=O)n(C(=O)CSC(N)=[NH2+])c1=O,C04642684_decoy,TRY1,Decoy,0,-6.92306,-6.31,-1.25,-6.755331030549168
NC(=O)CCNS(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl,C37581719_decoy,TRY1,Decoy,0,-9.41487,-6.4,-2.69,-7.946420979978665
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2O,C19323015_decoy,TRY1,Decoy,0,-7.72644,-5.86,-3.21,-5.603404988500135
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2O,C19323021_decoy,TRY1,Decoy,0,-7.2483,-5.04,-0.68,-5.047633268821278
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19322865_decoy,TRY1,Decoy,0,-7.47527,-4.23,-0.83,-4.621410012246368
CC[C@H](C)[C@H]([NH3+])[C@H]1NN=C(SCc2c(C)[nH]c(=O)[nH]c2=O)O1,C38661690_decoy,TRY1,Decoy,0,-8.10531,-7.26,-2.28,-6.9501513068727965
[NH3+]CCCCN[C@@H]1N=C2C(=O)N=CN=C2N1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345077_decoy,TRY1,Decoy,0,-8.24592,-6.56,-0.72,-7.24186816265096
OCC(CO)(CO)[NH2+]CC1=CN=[NH+][C@H]1c1ccc(Cl)cc1Cl,C39938419_decoy,TRY1,Decoy,0,-8.16875,-6.55,-2.33,-6.136599102695159
O=C1[NH+]=c2ccccc2=[NH+][C@H]1/C(=N\Nc1ccccc1)[C@H](O)[C@H](O)CO,C40151083_decoy,TRY1,Decoy,0,-7.51564,-7.48,-1.25,-6.530310768140158
NC(=O)N/N=C(\[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO,C40151114_decoy,TRY1,Decoy,0,-6.59208,-7.39,-2.72,-8.005681791503024
NC(=O)N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2ccccc2=[NH+]C1=O,C40151118_decoy,TRY1,Decoy,0,-6.33149,-7.59,-0.99,-7.306261174856861
CC1(C)CC(Nc2ncnc(NC[C@@H]3CCCO3)c2N)CC(C)(C)[NH2+]1,C40686985_decoy,TRY1,Decoy,0,-7.54455,-4.97,-2.07,-4.279891484834988
CC(C)(C)NNc1[nH+]cnc(Nc2ccc(Br)cn2)c1N,C40779882_decoy,TRY1,Decoy,0,-7.37074,-5.34,-1.2,-4.353154506998322
C[C@@H](O)[C@H]([NH3+])c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C43217252_decoy,TRY1,Decoy,0,-7.58128,-6.17,-3.4,-5.213868574078513
CC[NH+](CC)CCC[C@H](C)NC(=O)c1coc([C@@H]([NH3+])[C@H](C)O)n1,C43217940_decoy,TRY1,Decoy,0,-7.55192,-5.38,-2.52,-6.404449699250208
COc1cc(C[C@@H](C)[NH3+])cc(-c2cc(C[C@@H](C)[NH3+])cc(OC)c2O)c1O,C44461566_decoy,TRY1,Decoy,0,-11.3955,-6.6,-0.17,-9.39594308802786
CC(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1SCCCCCC[NH3+],C04533982_decoy,TRY1,Decoy,0,-8.3319,-4.69,-3.61,-7.797752051587826
[NH2+]=C(N/N=C\c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C48532946_decoy,TRY1,Decoy,0,-8.85418,-7.83,-1.41,-8.759048102403918
CCC[NH+]1CCC2(CC1)NC(=O)N(CCC(=O)NCC[NH3+])C2=O,C57849044_decoy,TRY1,Decoy,0,-7.71586,-6.09,-1.53,-5.693326714000899
C[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(CC(N)=O)CC(N)=O,C61804956_decoy,TRY1,Decoy,0,-8.08338,-3.75,-4.31,-5.019087811725416
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)N(CC(N)=O)CC(N)=O,C61805195_decoy,TRY1,Decoy,0,-6.78647,-3.84,-2.21,-4.626274007630649
C[C@H](CC(N)=O)C[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C61830743_decoy,TRY1,Decoy,0,-7.19578,-6.96,-1.99,-8.071343574214206
CN(C)CCNc1[nH+]c2c(c3c1C[NH+](C1CCCCC1)CC3)[C@@H]([NH3+])N=N2,C38752253_decoy,TRY1,Decoy,0,-8.78822,-6.77,0.02,-8.202413586504127
NC(=O)CCN1C[C@@H](C[NH2+]CCC2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C63868606_decoy,TRY1,Decoy,0,-7.55175,-6.3,-1.83,-4.932442989923817
CC(C)[NH+](CCS(=O)(=O)CC[NH+](CC(N)=O)C(C)C)CC(N)=O,C65208976_decoy,TRY1,Decoy,0,-7.81101,-4.2,-3.63,-5.130202671338323
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)NCCCc2n[nH]c(N)c2C#N)C1,C48333302_decoy,TRY1,Decoy,0,-7.73232,-7.91,-1.51,-8.1236776281243
Cc1ccc2c(c1)=[NH+][C@@H](CN(C)c1cc(NCCO)[nH+]c(N)n1)[NH+]=2,C65452581_decoy,TRY1,Decoy,0,-7.20392,-6.0,-1.49,-4.859131395647381
Nc1nc(NCCO)cc(N2CCC[C@@H](C3[NH+]=c4ccccc4=[NH+]3)C2)n1,C65454833_decoy,TRY1,Decoy,0,-8.10695,-5.74,-1.85,-6.554236907367398
NC(=O)Cn1cc(NC(=O)NC2CC[NH+](CC(N)=O)CC2)cn1,C47691582_decoy,TRY1,Decoy,0,-8.25663,-6.19,-2.91,-5.793923412064235
Cc1cc(=O)[nH]c(NCC[NH2+]C[C@@H]2[NH+]=c3ccc(C)c(C)c3=[NH+]2)n1,C65525978_decoy,TRY1,Decoy,0,-7.83364,-6.97,-2.1,-5.547594528457474
[NH3+]CCCCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C65734849_decoy,TRY1,Decoy,0,-8.72727,-5.35,-1.55,-6.076609170816899
Nc1cc(N)nc(SC[C@H](O)C[NH+]2CCc3ccccc3C2)n1,C66481577_decoy,TRY1,Decoy,0,-8.52811,-6.49,-1.89,-5.708704084922833
Cc1c(Cl)cccc1NC(=O)C[C@@H]([NH2+]CCCCCC[NH3+])C(=O)[O-],C05258207_decoy,TRY1,Decoy,0,-8.27455,-5.83,-2.59,-7.184557608194421
[NH2+]=C(N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C05713732_decoy,TRY1,Decoy,0,-8.61623,-7.9,-3.49,-6.910586607653938
CC1(C)Cc2c(sc(NC(=O)C(=O)NCCC[NH3+])c2C(N)=O)CO1,C06759059_decoy,TRY1,Decoy,0,-8.88246,-6.13,-2.68,-6.4921146997492105
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2Cn1cc(C[NH3+])nn1,C08299044_decoy,TRY1,Decoy,0,-7.66364,-6.49,-2.19,-5.948285002365881
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCCOc2ccc([N+](=O)[O-])cc2)c1,C08649782_decoy,TRY1,Decoy,0,-10.1636,-8.41,-2.12,-9.084066540321238
Nc1ncnc2c1nc(NCC[NH3+])n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09886052_decoy,TRY1,Decoy,0,-7.80056,-8.03,-1.75,-8.400539327014336
[NH3+]CCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09886087_decoy,TRY1,Decoy,0,-8.10597,-6.32,-1.44,-7.299402399481245
[NH3+]CCCCNc1nc2c(=O)[nH]cnc2n1[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12318164_decoy,TRY1,Decoy,0,-7.49039,-7.18,-1.53,-7.829948438012104
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@@H]3[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)C2=O,C19312821_decoy,TRY1,Decoy,0,-7.25202,-5.85,-1.38,-5.556292988162324
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)C2=O,C19312827_decoy,TRY1,Decoy,0,-7.11028,-4.63,-1.05,-4.588354855375186
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@@H]3[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19322868_decoy,TRY1,Decoy,0,-7.90851,-5.8,-1.41,-6.155127927592486
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO)C2=O,C19323212_decoy,TRY1,Decoy,0,-7.83733,-4.33,-0.96,-5.0915923051111855
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)C2O,C19331311_decoy,TRY1,Decoy,0,-7.99224,-5.49,-0.91,-6.077523573510455
C[C@@]1(CCCc2ccc(N)cc2)[NH+]=C(N)N=C(N)N1c1ccccc1,C16981844_decoy,TRY1,Decoy,0,-7.80734,-7.75,-1.27,-8.63148544747754
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2O,C19323012_decoy,TRY1,Decoy,0,-7.35845,-4.45,-1.71,-4.660391723462793
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2O,C19323018_decoy,TRY1,Decoy,0,-7.61561,-6.03,-2.25,-3.3128924682336254
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19322873_decoy,TRY1,Decoy,0,-7.82305,-6.25,-2.73,-6.145458893624644
CC[C@@H](C)[C@H]([NH3+])[C@H]1NN=C(SCc2c(C)[nH]c(=O)[nH]c2=O)O1,C38661688_decoy,TRY1,Decoy,0,-9.70738,-7.17,-1.72,-7.860878343599225
[NH3+]CCCCN[C@H]1N=C2C(=O)N=CN=C2N1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39345076_decoy,TRY1,Decoy,0,-8.07143,-7.4,-1.04,-7.567607631864492
ONC[C@H](c1ccc(-c2ccccc2O)cc1)N1CC[NH2+][C@H](O)C1,C39534041_decoy,TRY1,Decoy,0,-8.7945,-5.98,-1.75,-6.010284393036938
OCC(CO)(CO)[NH2+]CC1=CN=[NH+][C@@H]1c1ccc(Cl)cc1Cl,C39938418_decoy,TRY1,Decoy,0,-7.95132,-5.01,-1.78,-5.3166142203658495
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1/C(=N\Nc1ccccc1)[C@H](O)[C@H](O)CO,C40151081_decoy,TRY1,Decoy,0,-7.86418,-5.73,-2.33,-5.7910154001675975
CC1(C)CC(Nc2ncnc(NCc3ccccc3)c2N)CC(C)(C)[NH2+]1,C40709271_decoy,TRY1,Decoy,0,-8.75113,-5.72,-1.68,-5.080987442873304
COc1ccc(Nc2[nH+]cnc(NNc3ccccc3)c2N)c(OC)c1,C40754414_decoy,TRY1,Decoy,0,-6.67956,-6.01,-1.58,-6.430933825528887
C[NH+]1CCN(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)CC1,C40756227_decoy,TRY1,Decoy,0,-6.87165,-5.54,-2.19,-4.515219833412004
Cc1ccccc1C(=O)NNc1ncnc(NN2CC[NH+](C)CC2)c1N,C40756942_decoy,TRY1,Decoy,0,-7.70633,-7.76,-1.32,-6.799672714468816
CC(=O)Nc1ccc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)cc1,C40757003_decoy,TRY1,Decoy,0,-6.99561,-4.91,-2.34,-4.475756928578075
C[NH+]1CCN(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)CC1,C40757049_decoy,TRY1,Decoy,0,-6.66826,-6.21,-2.16,-6.241567940715283
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1ccc(Cl)cn1,C40757432_decoy,TRY1,Decoy,0,-7.22831,-7.06,-1.35,-5.221671273258559
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1cccnc1Cl,C40757656_decoy,TRY1,Decoy,0,-7.51607,-7.09,0.2,-7.638615817573479
C[C@@H](Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N)c1ccccc1,C40760186_decoy,TRY1,Decoy,0,-6.9307,-5.91,-1.31,-4.372585972808964
Cc1ccc(CNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40760786_decoy,TRY1,Decoy,0,-7.47711,-5.69,-2.14,-5.054048987354942
CC(C)CCNc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40760868_decoy,TRY1,Decoy,0,-7.58848,-4.99,-1.86,-5.184452857893091
CC1(C)CC(NC(=O)NNC(=S)NC2CCCC2)CC(C)(C)[NH2+]1,C42910415_decoy,TRY1,Decoy,0,-8.37648,-5.4,-1.33,-5.322527300560625
C[C@H](O)[C@H]([NH3+])c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C43217251_decoy,TRY1,Decoy,0,-7.73179,-6.11,-3.12,-5.859200694876797
CCN(CC(N)=O)c1ccc(/N=C2\C=C(C)C(O)=C\C2=[NH+]\C(N)=O)cc1,C44709943_decoy,TRY1,Decoy,0,-7.47216,-6.76,-0.96,-5.205062628451423
CCCn1c(N)c(C(=O)C[NH+]2CCC(C(N)=O)CC2)c(=O)[nH]c1=O,C45311369_decoy,TRY1,Decoy,0,-7.00749,-6.37,-2.99,-5.1911292950121135
CC(C)[NH+]1CCC2(CC1)NC(=O)N(CCC(=O)NCC[NH3+])C2=O,C57849045_decoy,TRY1,Decoy,0,-7.86356,-6.31,-1.36,-7.060213585888837
CC1(C)CC(NC(=O)Nc2ccccc2SCC(N)=O)CC(C)(C)[NH2+]1,C58156804_decoy,TRY1,Decoy,0,-7.24505,-7.15,-2.51,-7.985343328724253
COc1cccc(C[NH2+]CC[NH2+]C[C@H](C)O)c1OCC(=O)NC(C)(C)C,C20872705_decoy,TRY1,Decoy,0,-7.90335,-4.37,-3.6,-4.997853349179309
CC[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)N(CC(N)=O)CC(N)=O,C61805191_decoy,TRY1,Decoy,0,-7.35283,-4.46,-1.99,-4.849757936508824
CS(=O)(=O)c1ccc(N(CC[NH3+])CC[NH3+])c(S(C)(=O)=O)c1,C61806658_decoy,TRY1,Decoy,0,-8.32764,-4.48,-3.14,-5.3543751556072925
NC(=O)CCN1C[C@H](C[NH2+]CCC2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C63868608_decoy,TRY1,Decoy,0,-7.49098,-6.6,-2.4,-6.501003063546088
O=C1CC=C(C(=O)NCC(=O)Nc2ccc(N3CN[NH2+]N3)cc2)C=N1,C64422948_decoy,TRY1,Decoy,0,-9.02511,-7.31,-0.17,-7.50776312727418
CCN1NC(C)=C(NC(=O)C[NH2+]CCc2c[nH]c(=O)[nH]c2=O)[C@@H]1C,C65407109_decoy,TRY1,Decoy,0,-7.86068,-5.8,-2.77,-5.416346957206656
Cc1cc(=O)[nH]c(NCC[NH2+]C[C@H]2[NH+]=c3ccc(C)c(C)c3=[NH+]2)n1,C65525977_decoy,TRY1,Decoy,0,-7.06134,-7.46,-2.38,-5.521921505060509
[NH3+]CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C38275623_decoy,TRY1,Decoy,0,-9.04874,-5.78,-1.92,-8.59598169784404
NC(=O)C(NC(=O)NC1CC[NH+](CC2CCCCC2)CC1)C(N)=O,C66038014_decoy,TRY1,Decoy,0,-8.52136,-4.9,-2.95,-5.9971927981529705
Nc1cc(N)nc(SC[C@@H](O)C[NH+]2CCc3ccccc3C2)n1,C66481576_decoy,TRY1,Decoy,0,-9.12506,-7.31,-0.96,-9.735677537418006
CC1CC[NH+](C[C@@H](O)CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1,C67581302_decoy,TRY1,Decoy,0,-8.08836,-7.11,-1.87,-5.557906032472463
O[C@@H](C[NH2+]CCCC[NH2+]C[C@H](O)C(F)(F)F)C(F)(F)F,C04050482_decoy,TRY1,Decoy,0,-6.11804,-4.38,-1.38,-4.348368224652136
COCc1cc(C)[nH+]c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1C(N)=O,C04751816_decoy,TRY1,Decoy,0,-8.37503,-5.0,-3.1,-5.646776956780878
CCc1ccccc1NC(=O)C[C@H]([NH2+]CCC[NH3+])C(=O)[O-],C05257720_decoy,TRY1,Decoy,0,-8.02051,-6.31,-3.07,-8.619499530913751
C[NH2+]CCC[NH2+][C@@H](CC(=O)Nc1ccc(O)cc1)C(=O)[O-],C05257864_decoy,TRY1,Decoy,0,-7.1396,-6.37,-2.95,-6.815166831918488
C[C@@H](C[NH3+])C[NH+]1CCCN(c2ccnc(C(N)=O)c2)CC1,C35673123_decoy,TRY1,Decoy,0,-8.84307,-6.72,-1.37,-7.698404199012288
Nc1cc(N)cc(C(=O)OCC2[NH+]=c3cc4ccccc4cc3=[NH+]2)c1,C39698438_decoy,TRY1,Decoy,0,-7.27552,-8.41,-1.21,-6.808051808042354
CCCC[NH+](CC(N)=O)C[C@@H](O)COc1ccccc1N,C42690786_decoy,TRY1,Decoy,0,-6.23835,-4.58,-3.17,-4.320940237632746
CC(C)C[NH+](CC(N)=O)C[C@@H](O)COc1ccc(N)cc1,C42690855_decoy,TRY1,Decoy,0,-5.87878,-6.02,-2.3,-6.508473384990777
CC[C@H]([NH3+])[C@@H](c1ccc(C)cc1)[NH+](CC(N)=O)CC(C)C,C42915713_decoy,TRY1,Decoy,0,-7.25665,-4.03,-2.55,-5.083821960669997
CC[C@@H]([NH3+])[C@@H](c1ccc(C)cc1)[NH+](CC(N)=O)CC(C)C,C42915714_decoy,TRY1,Decoy,0,-7.76758,-3.9,-1.7,-4.588136579757117
CC[C@H]([NH3+])[C@H](c1ccc(C)cc1)[NH+](CC(N)=O)CC(C)C,C42915715_decoy,TRY1,Decoy,0,-7.22335,-4.97,-1.71,-5.3992849421296905
C[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+]1CCC(CC(N)=O)CC1,C42955076_decoy,TRY1,Decoy,0,-7.03266,-6.19,-2.33,-6.998551097595126
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+]1CCC(CC(N)=O)CC1,C42955080_decoy,TRY1,Decoy,0,-7.54652,-5.67,-2.48,-4.75048822279615
C[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+]1CCC(CC(N)=O)CC1,C42955084_decoy,TRY1,Decoy,0,-7.17853,-4.17,-1.87,-4.469816886267076
CCCC[NH+](CC(N)=O)[C@H](c1ccccc1F)[C@H]([NH3+])CC,C43045862_decoy,TRY1,Decoy,0,-7.18775,-3.73,-1.32,-4.626569967313253
CC[C@H]([NH3+])[C@@H](c1ccccc1F)[NH+](CC(N)=O)CC(C)C,C43045876_decoy,TRY1,Decoy,0,-6.9833,-4.21,-2.24,-5.299742923158036
NC(=O)CC1CC[NH+]([C@H](C[NH3+])c2ccccc2Cl)CC1,C43052443_decoy,TRY1,Decoy,0,-5.6175,-4.67,-2.37,-4.100113779601178
C[C@H]([NH3+])[C@@H](c1ccccc1Cl)[NH+]1CCC(CC(N)=O)CC1,C43052448_decoy,TRY1,Decoy,0,-8.27749,-6.35,-2.7,-7.133868116328321
C[C@@H]([NH3+])[C@@H](c1ccccc1Cl)[NH+]1CCC(CC(N)=O)CC1,C43052450_decoy,TRY1,Decoy,0,-6.53745,-5.16,-2.39,-4.279928203339995
CC[C@@H]([NH3+])[C@@H](c1ccccc1Cl)[NH+](CC(N)=O)CC(C)C,C43052882_decoy,TRY1,Decoy,0,-6.29705,-4.92,-1.77,-5.167875993857208
NC(=O)CC1CC[NH+]([C@H](C[NH3+])c2ccccc2Br)CC1,C43093187_decoy,TRY1,Decoy,0,-7.40871,-5.13,-2.36,-5.288999884826621
NC(=O)CC1CC[NH+]([C@@H](C[NH3+])c2ccccc2Br)CC1,C43093189_decoy,TRY1,Decoy,0,-6.45057,-6.13,-1.14,-8.562408187376986
C[C@H]([NH3+])[C@@H](c1ccccc1Br)[NH+]1CCC(CC(N)=O)CC1,C43093191_decoy,TRY1,Decoy,0,-6.41973,-6.33,-1.61,-6.690889159386505
C[C@H]([NH3+])[C@H](c1ccccc1Br)[NH+]1CCC(CC(N)=O)CC1,C43093195_decoy,TRY1,Decoy,0,-6.26175,-5.22,-2.47,-4.500292091276341
CC[C@H]([NH3+])c1nc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)co1,C43210055_decoy,TRY1,Decoy,0,-8.45425,-5.51,-1.29,-8.961379410626947
CC[C@@H]([NH3+])[C@@H](c1sccc1C)[NH+]1CCCC[C@@H]1C(N)=O,C43248699_decoy,TRY1,Decoy,0,-6.36053,-4.0,-1.21,-4.233378284052209
CC[C@@H]([NH3+])[C@H](c1sccc1C)[NH+]1CCCC[C@@H]1C(N)=O,C43248701_decoy,TRY1,Decoy,0,-7.22469,-4.9,-2.71,-4.940333866275693
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)CC(N)=O,C43259815_decoy,TRY1,Decoy,0,-8.1177,-4.38,-2.04,-5.218345312687937
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)CC(N)=O,C43285410_decoy,TRY1,Decoy,0,-7.86708,-4.62,-1.32,-4.70601323683962
CCCC[NH+](CC(N)=O)[C@@H](c1cc(Br)cs1)[C@H]([NH3+])CC,C43287661_decoy,TRY1,Decoy,0,-7.42939,-4.78,-3.09,-5.293172674914532
CC[C@@H]([NH3+])CC(C[C@H]([NH3+])CC)c1ccc(OC(F)(F)F)cc1,C44402401_decoy,TRY1,Decoy,0,-9.68012,-5.97,-1.27,-8.93059321115868
CCCC[C@H](CC)COc1cc(C[C@@H](C)[NH3+])c(OC)cc1C[C@@H](C)[NH3+],C44461714_decoy,TRY1,Decoy,0,-9.2611,-4.63,-3.18,-8.08084485280656
CCCC[C@H](CC)COc1cc(C[C@@H](C)[NH3+])c(OC)cc1C[C@H](C)[NH3+],C44461716_decoy,TRY1,Decoy,0,-8.80462,-5.75,-4.47,-7.386957073216433
[NH3+]CC1CC[NH+](CC(=O)NC(=O)NCc2ccco2)CC1,C44513909_decoy,TRY1,Decoy,0,-8.38727,-6.17,-2.34,-6.150166470706195
[NH3+]C[C@@H]1CCCC[NH+]1CC(=O)NC(=O)NC1CCCCC1,C44559065_decoy,TRY1,Decoy,0,-9.49163,-4.64,-3.66,-5.901126707718124
C[C@@]([NH3+])(CCCCn1cc[nH+]c1-c1cccs1)C(N)=O,C45461291_decoy,TRY1,Decoy,0,-8.35814,-4.23,-1.89,-5.844381744194242
CCCC[NH+](CCO)C[C@H](O)COc1ccccc1C[NH3+],C49009887_decoy,TRY1,Decoy,0,-7.82343,-4.08,-2.67,-4.95354054514835
CCCC[NH+](CC(N)=O)Cc1ccc(NN)c([N+](=O)[O-])c1,C51145180_decoy,TRY1,Decoy,0,-7.69847,-6.07,-3.28,-7.388709573458158
C/C(=N\N=C(N)N)c1cc(/C(C)=N/NC(N)=[NH2+])c(C)nc1C,C27316835_decoy,TRY1,Decoy,0,-9.11695,-6.86,-1.19,-8.418816663668789
CCCCCNC(=[NH2+])NN/C=C1\C=Nc2ccc(CO)cc21,C12503245_decoy,TRY1,Decoy,0,-8.16505,-5.91,-2.45,-6.230528090668863
[NH3+]CCN(CC[NH3+])c1ccccc1S(=O)(=O)C(F)F,C61806528_decoy,TRY1,Decoy,0,-8.4362,-4.8,-2.84,-5.997933467381545
CCC[NH2+]Cc1cc(F)ccc1N(CC(N)=O)CC(N)=O,C61808348_decoy,TRY1,Decoy,0,-6.40893,-4.75,-1.05,-5.276807747778255
[NH3+]Cc1cccc(OC[C@@H](O)C[NH+]2CCNC(=O)CC2)c1,C62099897_decoy,TRY1,Decoy,0,-8.807,-6.33,-1.48,-7.207131064187122
CC[C@]1(C(=O)NC2CC[NH+](CC(N)=O)CC2)CCC[NH2+]C1,C62855688_decoy,TRY1,Decoy,0,-6.88708,-4.87,-2.75,-4.834433526328713
CC[C@@]1(C(=O)NC2CC[NH+](CC(N)=O)CC2)CCC[NH2+]C1,C62855689_decoy,TRY1,Decoy,0,-7.45158,-4.61,-1.7,-4.636280133535752
C[C@]([NH3+])(CCCCN1CC[C@H]([NH+]2CCCCC2)C1)C(N)=O,C62982753_decoy,TRY1,Decoy,0,-8.36061,-6.0,-1.1,-6.755307244033836
CCC[C@H](C)NC(=O)C[NH+]1CCC[C@H](C(=O)NCC[NH3+])C1,C63179840_decoy,TRY1,Decoy,0,-7.96093,-5.32,-2.3,-5.405889560653711
C[C@@H](C(=O)NC(C)(C)C)[NH+]1CCC[C@H](C(=O)NCC[NH3+])C1,C63180336_decoy,TRY1,Decoy,0,-7.40016,-4.42,-1.01,-4.918692770524645
CC(C)CNC(=O)[C@@H](C)[NH+]1CCC[C@H](C(=O)NCC[NH3+])C1,C63180343_decoy,TRY1,Decoy,0,-8.49478,-5.02,-1.6,-6.041246230902517
N/C(NCCCCNc1cccc[nH+]1)=[NH+]/C[C@@H]1CCCO1,C66246657_decoy,TRY1,Decoy,0,-7.48488,-4.85,-3.37,-5.736414466358322
C[C@@H]1CCC[NH+](Cc2nnn(-c3nonc3N)c2C[NH+]2CCC[C@H](C)C2)C1,C04786484_decoy,TRY1,Decoy,0,-8.54664,-6.63,-1.21,-7.639271554124309
C[C@H]1CCC[NH+](Cc2nnn(-c3nonc3N)c2C[NH+]2CCC[C@H](C)C2)C1,C04786486_decoy,TRY1,Decoy,0,-8.34176,-6.67,-2.5,-7.493058541396032
C[NH+](C)CCCn1cnc2c(c1=[NH2+])[C@@H](c1ccco1)c1ccc(O)cc1O2,C05345632_decoy,TRY1,Decoy,0,-7.16653,-7.21,-0.82,-5.774730229488844
CC(C)[NH+]1CCC(=NNC(=O)C(=O)NN=C2CC[NH+](C(C)C)CC2)CC1,C05909583_decoy,TRY1,Decoy,0,-7.45854,-5.45,-1.07,-5.446882026073363
C/C(=N\CC[NH+]1CC[NH2+]CC1)c1c(C)[nH]n(-c2ccc([N+](=O)[O-])cc2)c1=O,C06295122_decoy,TRY1,Decoy,0,-7.79682,-5.67,-2.89,-4.686796040472271
C[NH2+]Cc1cn(C[C@H]2C[C@H]3CC[NH+]2C[C@@H]3C(=O)NCc2ccco2)nn1,C08297631_decoy,TRY1,Decoy,0,-7.74086,-5.42,-1.0,-5.155589454627275
C[C@@H]1CCC[NH+](Cc2nnn(-c3nonc3N)c2C[NH+]2CCC[C@@H](C)C2)C1,C15024154_decoy,TRY1,Decoy,0,-8.01281,-7.14,-2.32,-7.131082628806272
OCc1ccc(C[NH+]2CC[C@@H](N3CCN(c4cccc[nH+]4)CC3)[C@H](O)C2)o1,C19222728_decoy,TRY1,Decoy,0,-7.92777,-6.13,-2.42,-4.9494781534814285
Nc1nc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cn3)CC2)[nH+]c2ccccc12,C14323201_decoy,TRY1,Decoy,0,-6.02686,-6.71,-1.75,-5.474067763855262
N#Cc1nc(-c2ccco2)oc1N1CC[NH+](Cc2nc(N)c3ccccc3[nH+]2)CC1,C23186682_decoy,TRY1,Decoy,0,-7.4255,-6.04,-0.9,-4.741684428260138
COCCOC1CC[NH+]([C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)CC1,C23214177_decoy,TRY1,Decoy,0,-7.9385,-6.43,-0.8,-6.297441306653201
CCCCN1CC[NH+]([C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)CC1=O,C23231749_decoy,TRY1,Decoy,0,-8.1248,-5.52,-0.82,-4.73570272421844
[NH3+]CC(=O)N1CCC[C@@H](Cn2cc(C[NH+]3CCC4(CCCC4)C3)nn2)C1,C23340231_decoy,TRY1,Decoy,0,-9.64046,-7.92,-1.39,-7.633806567009898
[NH3+]CC(=O)N1CCC[C@H](Cn2cc(C[NH+]3CCC4(CCCC4)C3)nn2)C1,C23340233_decoy,TRY1,Decoy,0,-9.30354,-8.34,-0.34,-13.080811508403857
COc1cc2c(cc1OC)C[NH+](Cc1cc(=O)[nH]c(N3CC[NH2+]CC3)n1)CC2,C35564487_decoy,TRY1,Decoy,0,-8.46737,-7.59,-2.68,-5.336831221425948
COC(=O)[C@@H]1[NH+]=c2ccc(Cl)cc2=C1NC(=O)[C@@H](C)[NH+]1CCN(CCO)CC1,C38612311_decoy,TRY1,Decoy,0,-7.93111,-5.72,-0.4,-5.264864032573303
COc1cc(/C=N/[NH+]=C2/N=NC3=c4ccccc4=[NH+][C@H]3N2)ccc1OCCO,C39282980_decoy1,TRY1,Decoy,0,-7.69985,-5.54,,-4.890091814851489
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1)NCCn1cc[nH+]c1,C19148946_decoy,TRY1,Decoy,0,-6.96379,-6.8,-1.39,-7.1456741577079175
Cc1cc(C(=O)N2C[C@@H](C(=O)NCC[NH+](C)C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39626404_decoy,TRY1,Decoy,0,-8.08192,-6.01,-1.78,-5.903428743540836
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2,C39626899_decoy,TRY1,Decoy,0,-8.44066,-6.15,-1.42,-5.809205332999264
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39627159_decoy,TRY1,Decoy,0,-7.73307,-5.42,-1.13,-5.342809484339274
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C39627163_decoy,TRY1,Decoy,0,-8.72265,-6.38,-0.97,-6.125239033290013
Cc1cc(C(=O)N2C[C@@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)nn1C,C39628256_decoy,TRY1,Decoy,0,-8.5732,-6.09,-2.61,-5.765661538356454
Cc1noc(C)c1C(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39631056_decoy,TRY1,Decoy,0,-7.78289,-5.38,-1.29,-5.458581880371417
Cc1cc(C(=O)N2C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)nn1C,C39631098_decoy,TRY1,Decoy,0,-8.26864,-6.39,-1.83,-7.73909560583325
Cn1cccc1C(=O)N1C[C@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678998_decoy,TRY1,Decoy,0,-7.96014,-6.28,-2.74,-5.167885550491851
Cn1cccc1C(=O)N1C[C@@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678999_decoy,TRY1,Decoy,0,-7.85311,-6.18,-1.13,-5.559940077996677
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39679112_decoy,TRY1,Decoy,0,-8.60985,-4.76,-1.77,-5.517937896597035
COc1ccc2c(c1)=C[C@@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)[NH+]1CCC(O)CC1)C(=O)[NH+]=2,C39699335_decoy,TRY1,Decoy,0,-8.17711,-6.71,-0.88,-5.643352933261197
COc1cc(/C=N/[NH+]=C2/N=NC3=c4ccccc4=[NH+][C@@H]3N2)cc(OC)c1O,C39732735_decoy,TRY1,Decoy,0,-7.35926,-7.39,-0.23,-4.79117483186074
O=C(N[C@@H]1CC[NH2+]C1)c1cn2ccnc2c(N2CCN(c3cccc[nH+]3)CC2)n1,C40567006_decoy,TRY1,Decoy,0,-9.19805,-6.02,-1.07,-5.241895200860316
O=C(N[C@H]1CC[NH2+]C1)c1cn2ccnc2c(N2CCN(c3cccc[nH+]3)CC2)n1,C40567007_decoy,TRY1,Decoy,0,-7.50536,-6.14,-3.82,-7.072773524474146
CC[NH+]1CCN(c2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2[N+](=O)[O-])CC1,C40610606_decoy,TRY1,Decoy,0,-6.68611,-5.91,-1.73,-4.574742450677646
CCOC(=O)NC(=O)C[NH+](CC)Cc1cc(O)oc2c/c(=[NH+]\C(C)=O)ccc1-2,C45312921_decoy,TRY1,Decoy,0,-6.89927,-6.44,-1.94,-5.385999641530608
CN1NC=C([N+](=O)[O-])[C@@H]1C(=O)Nc1ccc(C2[NH+]=c3ccccc3=[NH+]2)cc1,C63119601_decoy,TRY1,Decoy,0,-5.96358,-7.2,-0.96,-4.988699863439817
CN(C)c1ccc(/C=N/N2CC(=O)C(C3[NH+]=c4ccccc4=[NH+]3)=C2N)cc1,C39953409_decoy,TRY1,Decoy,0,-7.06515,-5.4,-2.53,-4.5394824176597846
CC1=NN2C(NC(=O)CSC3[NH+]=c4ccccc4=[NH+]3)=CS[C@@H]2NC1=O,C63295403_decoy,TRY1,Decoy,0,-6.95782,-5.61,-1.6,-5.20208086595499
COc1cc(/C=N/NC2=N[C@@H]3[NH+]=c4ccccc4=C3N=[NH+]2)ccc1OCCO,C39282980_decoy2,TRY1,Decoy,0,-8.40564,-6.89,,-8.18724499263388
COc1cc2c(cc1OC)=[NH+][C@@H](C(=O)N1CCC(C(N)=O)([NH+]3CCCCC3)CC1)C=2,C63626187_decoy,TRY1,Decoy,0,-8.00708,-7.21,-2.84,-5.783180203314196
COCc1cc(C)nc2c1[C@@H](N)[C@@H]([C@@H]1[NH+]=c3ccc([N+](=O)[O-])cc3=[NH+]1)S2,C63766886_decoy,TRY1,Decoy,0,-7.1006,-5.44,-1.99,-4.330011244324045
COCc1cc(C)nc2c1[C@H](N)[C@H]([C@@H]1[NH+]=c3ccc([N+](=O)[O-])cc3=[NH+]1)S2,C63766889_decoy,TRY1,Decoy,0,-7.14493,-4.89,-1.39,-4.711257557347934
Cc1cc(C)n([C@@H]2C=CC(=O)N(CC(=O)NC3[NH+]=c4ccccc4=[NH+]3)N2)n1,C63831822_decoy,TRY1,Decoy,0,-6.81081,-8.16,-2.66,-6.531329744518248
COCCN(C(C)=O)[C@H]1NC(C)=C(C(=O)NC2[NH+]=c3ccccc3=[NH+]2)S1,C64369744_decoy,TRY1,Decoy,0,-7.12797,-5.96,-1.56,-5.30912357960634
CC[NH+]1CCN(c2cc(CNC(=O)NCCc3c(C)nn(C)c3C)cc[nH+]2)CC1,C64640758_decoy,TRY1,Decoy,0,-8.18435,-5.81,-1.5,-5.100214232459623
C[C@H](CCNc1nc(-c2ccncc2)nc2c1CC[NH2+]CC2)n1cc[nH+]c1,C65408688_decoy,TRY1,Decoy,0,-8.94593,-5.15,-0.6,-5.548719591006174
CN(C)c1[nH+]cccc1CNC(=O)NCc1cccnc1N1CC[NH+](C)CC1,C66891872_decoy,TRY1,Decoy,0,-8.23431,-5.24,-3.48,-4.962802723029546
C[C@@H](Cn1cc[nH+]c1)NC(=O)NCc1cccnc1N1CC[NH+](C)CC1,C66982375_decoy,TRY1,Decoy,0,-7.82363,-4.82,-1.37,-5.333298751606148
C[NH+]1CCCN(CC[NH2+]Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC1,C67219470_decoy,TRY1,Decoy,0,-7.60568,-6.99,-1.69,-5.39959964216425
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NC3CC[NH+](C4CC4)CC3)c2C1,C67494663_decoy,TRY1,Decoy,0,-9.84784,-5.38,-2.25,-5.957196708578462
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NC3CC[NH+](C4CC4)CC3)c2C1,C67494663_decoy,TRY1,Decoy,0,-9.84784,-5.38,-2.05,-5.957196708578462
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCc3cc[nH+]c(N(C)C)c3)c2C1,C67497214_decoy,TRY1,Decoy,0,-8.76361,-8.18,-3.51,-9.765977815109638
Nc1ncnc(NNC(=O)CNC(=O)COc2ccccc2)c1[N+](=O)[O-],C03912705_decoy,TRY1,Decoy,0,-7.09309,-7.96,-1.06,-9.868874573362488
COc1cc(/C=C/CO)cc(OC)c1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C06403645_decoy,TRY1,Decoy,0,-7.46393,-5.94,-2.47,-4.999962691344703
OC[C@@H](O)[C@@H](O)[C@H](O)/C=N\Nc1nc(-c2ccc(Cl)cc2)cs1,C04567715_decoy,TRY1,Decoy,0,-8.32189,-7.57,-0.85,-7.427691039335316
CCOC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C10186407_decoy,TRY1,Decoy,0,-6.94296,-5.29,-1.69,-4.979757094135893
O=C1C(Cl)=C(/N=C/[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C(=O)c2ccccc21,C04864449_decoy,TRY1,Decoy,0,-7.88697,-7.17,-1.79,-5.911069825273696
Cc1cc(Cl)ccc1OCC(=O)N/N=C/[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O,C13685842_decoy,TRY1,Decoy,0,-8.19057,-7.84,-2.52,-8.33385609951209
Cc1ccccc1OC[C@@H](O)Cn1c(NN)nc2c1c(=O)[nH]c(=O)n2C,C13763846_decoy,TRY1,Decoy,0,-7.98975,-7.3,-1.49,-9.978346253397095
COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C14709424_decoy,TRY1,Decoy,0,-6.25526,-6.89,-1.31,-7.430661681961916
OC[C@H](O)[C@H](O)[C@@H](O)/C=N/Nc1nc(-c2ccc(Cl)cc2)cs1,C16948661_decoy,TRY1,Decoy,0,-8.64878,-6.16,-2.23,-5.213866257352843
Cc1cc([N+](=O)[O-])c(NC[C@H](O)[C@@H](O)[C@@H](O)CO)cc1Br,C19926311_decoy,TRY1,Decoy,0,-6.58406,-7.48,-1.83,-7.592871498751011
Cc1c(NC(=O)CO/N=C(\N)c2nonc2N)c(=O)n(-c2ccccc2)n1C,C20076861_decoy,TRY1,Decoy,0,-7.29761,-6.96,-1.47,-5.865939178551865
CC(=O)NNC(=O)CSc1nnc(N/N=C/c2ccc(C)cc2)n1N,C20918294_decoy,TRY1,Decoy,0,-7.77709,-6.13,-1.88,-5.444545994875879
NS(=O)(=O)c1ccc(NNC(=S)NCCN2CCOCC2)cc1,C25196934_decoy,TRY1,Decoy,0,-9.20259,-5.28,-1.51,-5.809205680895619
COCc1c(C(=O)N/N=C\c2ccc(O)cc2O)nnn1-c1nonc1N,C27500649_decoy,TRY1,Decoy,0,-8.46786,-7.84,-2.41,-7.829565067157698
CNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1,C29718409_decoy,TRY1,Decoy,0,-7.22369,-6.5,-4.08,-5.33254953635271
CNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C29718415_decoy,TRY1,Decoy,0,-7.41267,-6.56,-2.73,-5.691659734341862
CC1=C(CC[C@@H](C)O)C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1,C31168496_decoy,TRY1,Decoy,0,-7.31396,-6.45,-1.66,-5.686047002558872
COc1cc([C@@H]2C(C(N)=O)=C(C)N=C3N=CNN32)ccc1OCC(N)=O,C04625607_decoy,TRY1,Decoy,0,-7.49676,-5.57,-1.31,-5.5007114928923455
C[C@H](Nc1n[nH]c(=O)[nH]c1=O)C(=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1,C36073980_decoy,TRY1,Decoy,0,-7.13689,-7.71,-3.45,-6.219586860984441
C[C@@H](Nc1n[nH]c(=O)[nH]c1=O)C(=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1,C36073982_decoy,TRY1,Decoy,0,-7.29833,-8.27,-1.94,-6.924652131051307
Cc1cc(Cl)ccc1OCC(=O)N/N=C/[C@H](O)[C@H](O)[C@H](O)[C@@H](C)O,C13133018_decoy,TRY1,Decoy,0,-8.8599,-5.35,-2.2,-6.092447115972008
Cc1cc(Cl)ccc1OCC(=O)N/N=C/[C@@H](O)[C@H](O)[C@H](O)[C@@H](C)O,C04763750_decoy,TRY1,Decoy,0,-8.19457,-6.35,-2.42,-5.611305609503551
COc1cc(/C=C/CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C03779261_decoy,TRY1,Decoy,0,-6.63335,-5.55,-0.11,-4.363813695088331
CSC1=N[C@@H](N/C(C)=C(/CCO)C(=O)N2NC(SC)=N[C@@H]2N)N=N1,C38783405_decoy,TRY1,Decoy,0,-7.86572,-4.55,-1.64,-5.314648387793545
NC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccccc1,C39361515_decoy,TRY1,Decoy,0,-7.41169,-7.13,-2.11,-6.844339992483839
NC(=O)CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccccc1,C39361516_decoy,TRY1,Decoy,0,-6.88352,-6.59,-0.72,-5.004737489089736
Cc1ccc(OC[C@@H]2NN[C@H](NC(=O)N[C@@H](C)c3ncn[nH]3)S2)cc1,C39499920_decoy,TRY1,Decoy,0,-7.66792,-6.89,-2.77,-5.9206926803482105
Cc1ccc(OC[C@H]2NN[C@@H](NC(=O)N[C@@H](C)c3ncn[nH]3)S2)cc1,C39499923_decoy,TRY1,Decoy,0,-8.57996,-7.36,-0.58,-6.230337819062108
O=C(CCNC(=O)c1ccco1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558611_decoy,TRY1,Decoy,0,-7.49029,-7.61,-1.53,-8.044898939741325
CCc1cccc(C)c1NC(=O)CS[C@@H]1NN[C@H]([C@@H]2C=C(C)N=N2)N1N,C39591880_decoy,TRY1,Decoy,0,-8.34363,-6.68,-1.41,-6.075990282512967
CCc1cccc(C)c1NC(=O)CS[C@H]1NN[C@@H]([C@@H]2C=C(C)N=N2)N1N,C39591888_decoy,TRY1,Decoy,0,-7.57064,-7.67,-2.52,-6.342469816198465
COc1ccc([C@@H]2C(C#N)=C(SCC(N)=O)NC(C)=C2C(N)=O)cc1,C39932432_decoy,TRY1,Decoy,0,-7.20793,-5.72,-1.49,-5.401240516195337
COc1ccc([C@H]2C(C#N)=C(SCC(N)=O)NC(C)=C2C(N)=O)cc1,C39932433_decoy,TRY1,Decoy,0,-7.41695,-5.69,-1.94,-4.97605916645852
C[C@H](Sc1nc(N)nc2[nH]cnc12)C(=O)NCCc1ccc(O)cc1,C44990267_decoy,TRY1,Decoy,0,-8.64252,-7.26,-1.78,-6.92761440409376
C[C@@H](Sc1nc(N)nc2[nH]cnc12)C(=O)NCCc1ccc(O)cc1,C44990270_decoy,TRY1,Decoy,0,-8.75084,-7.86,-1.89,-8.021199161166132
NC(=O)C(NC(=O)CCCOc1ccccc1Br)C(N)=O,C45063610_decoy,TRY1,Decoy,0,-7.89125,-6.5,-1.88,-7.370694422298879
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)Nc1ccc2[nH]c(=O)[nH]c2c1,C45605619_decoy,TRY1,Decoy,0,-9.07046,-7.03,-4.16,-5.921448759645857
C[C@H](Nc1ccc(OCC(N)=O)cc1)C(=O)NC(=O)NC[C@@H]1CCCO1,C45813321_decoy,TRY1,Decoy,0,-8.34582,-5.5,-1.6,-5.843578968304897
C[C@@H](Nc1ccc(OCC(N)=O)cc1)C(=O)NC(=O)NC[C@H]1CCCO1,C45813329_decoy,TRY1,Decoy,0,-8.12861,-6.44,-1.92,-5.99725288515406
Cc1ccc(N2C(=O)NC(=O)/C(=C\NC(CO)(CO)CO)C2=O)c(C)c1,C08301985_decoy,TRY1,Decoy,0,-7.41435,-6.0,-1.67,-5.332807218639858
CC(C)NC(=O)C(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O,C56196344_decoy,TRY1,Decoy,0,-7.37738,-7.63,-1.99,-6.150315665524686
C/C(=N\Nc1nc(S[C@H](C)C(=O)NC2CC2)n[nH]1)c1ccc(N)cc1,C59816124_decoy,TRY1,Decoy,0,-8.23664,-8.41,-2.2,-7.711981608224613
CC(C)C(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2ccccc2O)n1N,C59845112_decoy,TRY1,Decoy,0,-8.18961,-7.88,-2.8,-7.727671601251697
CC(C)C(=O)NNC(=O)[C@H](C)Sc1nnc(-c2ccccc2O)n1N,C59845113_decoy,TRY1,Decoy,0,-7.30863,-6.93,-3.05,-5.817512891976778
CC(C)CNC(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O,C65178783_decoy,TRY1,Decoy,0,-8.16538,-8.07,-0.86,-7.636490322044144
CCCCNC(=O)NC1(C(=O)NNC(=O)C(=O)NC(C)C)CCCCC1,C57428673_decoy,TRY1,Decoy,0,-8.4291,-6.1,-6.3,-6.90190149500294
COCCOc1ccccc1NC(=O)NCCCc1n[nH]c(N)c1C#N,C66403625_decoy,TRY1,Decoy,0,-7.24449,-7.02,-3.18,-7.168957880825467
Cc1ccccc1[C@H](CC(=O)NNC(=O)c1sccc1C)NC(N)=O,C66557171_decoy,TRY1,Decoy,0,-8.71689,-6.04,-3.31,-7.631061788300034
NC(=O)Cn1cc(NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)cn1,C67165274_decoy,TRY1,Decoy,0,-8.33579,-7.0,-3.03,-6.519107620386626
Cc1ccc2cccc(NC(=O)C(=O)NCCCc3n[nH]c(N)c3C#N)c2n1,C67491116_decoy,TRY1,Decoy,0,-8.06129,-8.79,-1.69,-7.020976937492311
C[NH+](C)CC(N)=S,C02012389_decoy,TRY1,Decoy,0,-5.03332,-3.64,-0.18,-5.128840086882347
[NH3+][C@@H]1CCC[C@@H]1Cl,C00158408_decoy,TRY1,Decoy,0,-6.69594,-4.11,-0.64,-4.582365734477133
CCC[C@@H](C)[NH3+],C01693430_decoy,TRY1,Decoy,0,-6.04564,-3.51,-2.01,-4.704515688689286
OCC1=CC[NH+]2CC[C@@H](O)[C@@H]12,C01996064_decoy,TRY1,Decoy,0,-6.24258,-3.93,-1.59,-2.93836808438511
[NH3+]CCn1cc(Cl)cn1,C02558413_decoy,TRY1,Decoy,0,-7.14426,-4.91,-1.06,-6.194303564153299
[NH3+]C[C@H](S)C(F)(F)F,C03866596_decoy,TRY1,Decoy,0,-6.61414,-4.66,-1.98,-6.587237498536897
OCC[C@@H]1C[NH2+]CCO1,C19091051_decoy,TRY1,Decoy,0,-5.60592,-2.75,-1.3,-2.8746492716601177
O[C@@H]1COC[C@@H]1[NH2+]C1CC1,C19126791_decoy,TRY1,Decoy,0,-3.72377,-3.04,-1.91,-2.416140812117384
N#CCSCC[NH3+],C19473670_decoy,TRY1,Decoy,0,-7.01878,-3.83,-0.48,-8.938227774031867
[NH3+]C[C@H]1COC2(CCCC2)O1,C20264030_decoy,TRY1,Decoy,0,-7.71705,-5.01,0.26,-10.19463939411477
Cc1noc(C)c1C[C@@H](C)[NH3+],C20442639_decoy,TRY1,Decoy,0,-7.13815,-4.57,-0.56,-9.902604738545008
C=C(C)[C@@H]1C[NH2+]CC[C@@H]1O,C21998527_decoy,TRY1,Decoy,0,-6.19862,-4.43,-0.95,-6.517151724826078
CN(C)[C@](C)(C[NH3+])C1CC1,C22149197_decoy,TRY1,Decoy,0,-6.52374,-2.68,-1.67,-3.398511905533584
C[NH2+][C@H]1CNC[C@@H]1OC,C33791774_decoy,TRY1,Decoy,0,-5.38248,-2.78,-1.82,-2.7554126787811866
[NH3+]C1=CC=NC1,C34278469_decoy,TRY1,Decoy,0,-5.3037,-4.11,0.84,-6.097185295479252
C#CC[NH2+][C@@H]1CCCC[C@H]1O,C37490963_decoy,TRY1,Decoy,0,-6.51955,-4.71,-2.68,-5.032708340738529
C[C@@H]1CC[C@H](CCCO)[NH2+]1,C37629577_decoy,TRY1,Decoy,0,-5.65209,-3.11,-1.64,-2.8572087406151696
O[C@@H]1CCC[C@@H]1[NH2+]CC1CC1,C37689614_decoy,TRY1,Decoy,0,-6.44202,-3.57,-0.45,-3.1174318640932257
CC(C)(C)[NH2+][C@@H]1COC[C@H]1O,C37882962_decoy,TRY1,Decoy,0,-4.75073,-2.98,-2.11,-2.441400971066817
CC(C)[NH2+][C@@]1(CO)CCSC1,C38115451_decoy,TRY1,Decoy,0,-6.86251,-3.38,-1.57,-3.477729666047339
NC(=S)C1=c2ccccc2=[NH+]C1,C38806827_decoy,TRY1,Decoy,0,-7.71359,-4.68,0.62,-3.616750278243328
[NH3+]C1C[C@H]2CCC3CC[C@H](C1)N32,C19515498_decoy,TRY1,Decoy,0,-8.64643,-4.06,-0.76,-2.9652260139899007
[NH3+]C1C[C@H]2CCC3CC[C@H](C1)N32,C19515498_decoy,TRY1,Decoy,0,-8.64643,-4.06,-1.57,-2.9652260139899007
C#C[C@@]1(O)CC[NH2+][C@H](C)C1,C39049566_decoy,TRY1,Decoy,0,-5.9704,-3.33,-1.17,-1.966976934362905
Oc1ccc2c(c1O)=[NH+]CC=2,C39059135_decoy,TRY1,Decoy,0,-5.49169,-6.77,-0.17,-4.441215077134854
Nc1ccc2c(c1)=C(C=O)C[NH+]=2,C39060567_decoy,TRY1,Decoy,0,-5.27315,-6.48,-1.73,-6.52468694012812
CN(C)C1(C[NH3+])CCC1,C39074022_decoy,TRY1,Decoy,0,-7.1675,-2.62,-1.18,-3.174080694654542
NO[C@H]1C[NH+]2CCC[C@H]1C2,C39078951_decoy,TRY1,Decoy,0,-5.78596,-3.38,-0.48,-2.856555959214728
O[C@H]1C[NH2+]C[C@H]1Cl,C39094854_decoy,TRY1,Decoy,0,-5.41507,-4.47,-0.2,-4.77706871986228
c1cc([C@@H]2C[NH2+]CCN2)co1,C39113401_decoy,TRY1,Decoy,0,-6.20081,-4.13,-1.21,-2.959024475128192
C#CC[C@@H](C)[NH3+],C39190960_decoy,TRY1,Decoy,0,-6.00897,-3.51,0.33,-7.298265495336037
[NH3+][C@H]1CC[C@@H]2CO[C@H]1O2,C39402908_decoy,TRY1,Decoy,0,-7.00602,-4.97,-0.63,-4.38032889413129
O[C@H]1C=C2C[NH2+]CC[C@H]2S1,C40845007_decoy,TRY1,Decoy,0,-7.10142,-3.65,0.14,-4.6192798881245904
C[C@@H]([NH3+])[C@H](C)N1CCOCC1,C41053712_decoy,TRY1,Decoy,0,-7.44981,-3.27,-0.95,-3.7160921234755984
Cc1cnn([C@H](C)[C@@H](C)[NH3+])c1,C41053927_decoy,TRY1,Decoy,0,-7.18322,-4.96,-0.09,-8.501697467571976
CCO[C@H](C)[C@@H](C)[NH3+],C41053951_decoy,TRY1,Decoy,0,-6.52128,-4.18,-1.6,-5.806249387027415
CC1(C[NH3+])OCCCO1,C41125616_decoy,TRY1,Decoy,0,-6.6968,-4.02,0.01,-7.123436701302223
CC1(C[NH3+])CC1,C43220731_decoy,TRY1,Decoy,0,-6.00324,-3.88,-0.38,-5.763408267428593
CS[C@H]([C@@H](C)[NH3+])C(F)(F)F,C43386374_decoy,TRY1,Decoy,0,-7.67362,-4.7,-0.73,-7.502994863378638
O[C@H]1CCCC[C@@]12[NH2+]CCS2,C43827799_decoy,TRY1,Decoy,0,-6.2285,-3.14,-0.25,-2.198026456371053
C1CNC2(C1)CC[NH2+]CC2,C44068825_decoy,TRY1,Decoy,0,-6.30018,-3.38,-0.08,-2.231675336720237
CC(C)(Cl)CCC[NH3+],C44249547_decoy,TRY1,Decoy,0,-7.37338,-4.0,-0.99,-5.833787788849948
CCCC1(CO)CC[NH2+]CC1,C49584935_decoy,TRY1,Decoy,0,-5.7614,-3.25,-0.86,-3.329046671454601
CC#CC[C@@H]([NH3+])C1CC1,C51665174_decoy,TRY1,Decoy,0,-6.50525,-4.26,-0.77,-3.41407441495363
C[C@@H]([NH3+])[C@H]1C[C@@H]1C1CCOCC1,C52175851_decoy,TRY1,Decoy,0,-8.03611,-5.34,-0.05,-10.13204063085928
CC(C)O[C@H]1CCC[C@H]1[NH3+],C54036227_decoy,TRY1,Decoy,0,-7.16702,-4.23,-1.84,-5.672143179307865
FC(F)(F)[C@H]1NCC[NH2+]1,C19319886_decoy,TRY1,Decoy,0,-4.18632,-4.58,-1.42,-4.667026917790118
[NH3+][C@H]1CCCC[C@@H]1OC1CCC1,C50520157_decoy,TRY1,Decoy,0,-7.65312,-4.62,-4.13,-1.601963122287448
O[C@H]1CC[NH+]([C@@H]2CCC[C@H]2O)C1,C61708299_decoy,TRY1,Decoy,0,-6.07956,-3.84,-0.69,-3.279798341685876
CO[C@H]1CC[C@@H]([NH3+])C1,C66351442_decoy,TRY1,Decoy,0,-6.89923,-3.41,-1.13,-3.0413545069882524
CN(C)C[C@@]1(O)CC[NH2+]C1,C34321172_decoy,TRY1,Decoy,0,-5.60098,-3.04,-0.96,-2.825946194636489
Cc1ccc2[nH]c(=O)c([C@@H](c3nnnn3Cc3ccccc3)[NH+]3CCC(O)CC3)cc2c1,C00907635_decoy,TRY1,Decoy,0,-8.72175,-8.41,-1.62,-14.466324574593436
Oc1cc(OCc2c[nH][n+](-c3ccccc3)c2)ccc1-c1n[nH]cc1Oc1ccccc1F,C09492581_decoy,TRY1,Decoy,0,-8.93286,-8.79,-2.15,-7.444958550913092
COc1ccc([C@@H]2c3ccc(O)cc3Oc3ncn(CCCN4CCOCC4)c(=[NH2+])c32)cc1,C19990886_decoy,TRY1,Decoy,0,-8.16655,-5.87,-0.9,-5.992187651586604
O=C(Nc1ccccc1)[C@H]1O[C@H](CC[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)CC[C@@H]1O,C30879058_decoy,TRY1,Decoy,0,-7.12776,-6.94,-1.34,-5.649507565725627
Cc1sc2nc(SCC(=O)N(C)C)nc(N3CC[NH+](CC(N)=O)CC3)c2c1C,C34759636_decoy,TRY1,Decoy,0,-8.77199,-4.95,-1.39,-5.5062057337797095
C[NH+]1CCN(CC(=O)N2CCNC(=O)[C@@H]2CC(=O)Nc2ccc(Br)cc2)CC1,C20676877_decoy,TRY1,Decoy,0,-8.88467,-7.16,-1.81,-7.608567152295821
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1c(F)cccc1Cl)NCCCN1CCCC1=O,C11841217_decoy,TRY1,Decoy,0,-8.72039,-5.32,-4.05,-5.214713352697006
CSC1=C[C@@H]2C[C@H]3CO[P@](=O)(S(=O)(=O)Oc4ccccc4)N[NH+]3C[C@@H]2C=C1O,C39469689_decoy,TRY1,Decoy,0,-6.52131,-5.78,-1.19,-4.1184670688841925
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39596574_decoy,TRY1,Decoy,0,-7.91698,-6.58,-1.71,-5.754635333393424
CCNC(=O)[C@H]1CN(C(=O)c2c(-c3c(F)cccc3Cl)noc2C)CC12CC[NH2+]CC2,C39598593_decoy,TRY1,Decoy,0,-7.46975,-5.49,-1.54,-5.567032084300243
CCCOCCNC(=O)[C@@H]1CN(C(=O)c2csc(Cl)c2OC)CC12CC[NH2+]CC2,C39607664_decoy,TRY1,Decoy,0,-7.82885,-5.83,-2.53,-5.740473926708272
CCCCNC(=O)[C@H]1CN(C(=O)c2cnc3c(c(C)nn3C)c2Cl)CC12CC[NH2+]CC2,C39624158_decoy,TRY1,Decoy,0,-9.11405,-5.1,-1.48,-5.394151734616916
COc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H]3CCCC[C@H]3C)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39635865_decoy,TRY1,Decoy,0,-9.4224,-5.51,-2.38,-5.767924375059918
CCOc1ccccc1CNC(=O)[C@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C39638776_decoy,TRY1,Decoy,0,-8.78187,-7.44,-1.09,-7.045472964948347
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCCc2ccccc2F)C2(CC[NH2+]CC2)C1,C39639008_decoy,TRY1,Decoy,0,-7.42961,-5.93,-3.04,-5.400940745674017
CCSCCNC(=O)[C@@H]1CN(C(=O)c2ccccc2OC(C)=O)CC12CC[NH2+]CC2,C39656299_decoy,TRY1,Decoy,0,-6.6678,-4.78,-1.64,-5.382038161182745
CC1(C)OC[C@H](CNC(=O)[C@H]2CN(C(=O)c3cc(Cl)ccc3F)CC23CC[NH2+]CC3)O1,C39659506_decoy,TRY1,Decoy,0,-8.52452,-7.1,-1.0,-5.959578871917119
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)N[C@@H]3CCSC3=O)C3(CC[NH2+]CC3)C2)c1C,C39661236_decoy,TRY1,Decoy,0,-8.53909,-5.8,-1.86,-5.710531060450419
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)N[C@H]3CCSC3=O)C3(CC[NH2+]CC3)C2)c1C,C39661238_decoy,TRY1,Decoy,0,-8.17851,-5.77,-1.96,-5.794549003574861
O=C(N[C@@H]1CCSC1=O)[C@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39661292_decoy,TRY1,Decoy,0,-7.68701,-5.99,-0.88,-5.3329352618990935
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@@H]3CCSC3=O)C3(CC[NH2+]CC3)C2)cc1Cl,C39661365_decoy,TRY1,Decoy,0,-8.74821,-5.13,-1.91,-5.365936223533969
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCS)C2(CC[NH2+]CC2)C1,C39662018_decoy,TRY1,Decoy,0,-11.1519,-4.69,-2.23,-6.683505343046472
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)N[C@H](C#N)c3ccccc3)C3(CC[NH2+]CC3)C2)c1C,C39662440_decoy,TRY1,Decoy,0,-8.29672,-8.28,-3.27,-8.89213309594064
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@H](C#N)c3ccccc3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39662532_decoy,TRY1,Decoy,0,-8.78122,-6.3,-2.15,-5.527474558422805
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NC[C@@H](C)Oc2cccnc2)C2(CC[NH2+]CC2)C1,C39668665_decoy,TRY1,Decoy,0,-8.21877,-8.2,-0.7,-7.849723265877953
CC(C)(CNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2)N1CCOCC1,C39669652_decoy,TRY1,Decoy,0,-9.33917,-7.64,-2.49,-6.8584229231224345
Cc1cc(C)n(CCCNC(=O)[C@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)n1,C39671768_decoy,TRY1,Decoy,0,-8.8001,-5.83,-1.69,-5.402143874794473
CCC[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cnc3c(c(C)nn3C)c2Cl)CC12CC[NH2+]CC2,C39673877_decoy,TRY1,Decoy,0,-8.53151,-5.72,-3.08,-5.700143427983035
CC1=C([C@H](C)NC(=O)[C@H]2CN(C(=O)c3ccccc3C)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674150_decoy,TRY1,Decoy,0,-7.39931,-4.88,-2.45,-4.665671258642993
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cccnc3Cl)CC23CC[NH2+]CC3)[C@H](C)N=N1,C39674279_decoy,TRY1,Decoy,0,-7.4625,-6.02,-3.51,-5.389436664643569
CC1=C([C@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(F)c(C)c3)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674358_decoy,TRY1,Decoy,0,-7.59309,-7.08,-0.66,-6.92153162792236
CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)NCc3sccc3C)C3(CC[NH2+]CC3)C2)CC1,C39677235_decoy,TRY1,Decoy,0,-9.12357,-5.34,-1.23,-5.930724978243141
CN(C)C(=O)CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39680685_decoy,TRY1,Decoy,0,-8.96023,-6.11,-1.22,-5.850895358467149
CCOc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2ccncc2)C2(CC[NH2+]CC2)C1,C39680945_decoy,TRY1,Decoy,0,-7.30355,-7.6,-2.36,-6.594870289237059
Cc1cc(C(=O)N2C[C@H](C(=O)NCCOc3ccccc3Cl)C3(CC[NH2+]CC3)C2)nn1C,C39681411_decoy,TRY1,Decoy,0,-8.4066,-5.78,-1.51,-5.697558882376407
CC(C)C(=O)N1CCC(NC(=O)[C@H]2CN(C(=O)[C@@H]3CC=CCC3)CC23CC[NH2+]CC3)CC1,C39686101_decoy,TRY1,Decoy,0,-8.96751,-7.72,-1.39,-7.147352497329012
CSCCC(=O)N1C[C@@H](C(=O)NC2CCN(C(=O)CC(C)C)CC2)C2(CC[NH2+]CC2)C1,C39686264_decoy,TRY1,Decoy,0,-8.96932,-6.29,-0.84,-6.980939117445363
O=C(NC1CCN(c2ncccc2Cl)CC1)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C39687741_decoy,TRY1,Decoy,0,-9.17899,-7.08,-2.01,-6.191980861785676
O=C(NC1CCN(c2ncccc2Cl)CC1)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39687867_decoy,TRY1,Decoy,0,-9.76565,-6.49,-2.9,-6.232119303096632
C=C(C)CNC(=O)[C@H]1CN(C(=O)c2c(Br)c(C)nn2CC)CC12CC[NH2+]CC2,C39690970_decoy,TRY1,Decoy,0,-8.24749,-6.18,-2.56,-5.693538754018405
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1C[C@H](C(=O)NCC#N)C2(CC[NH2+]CC2)C1,C39693700_decoy,TRY1,Decoy,0,-7.88937,-4.98,-2.12,-5.643474090262468
O=C(NCCn1cccn1)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39694635_decoy,TRY1,Decoy,0,-9.46269,-9.26,-1.09,-8.188605372367567
Cc1cc(C)cc(CNC(=O)[C@@H]2CN(C(=O)c3c(C)noc3C)CC23CC[NH2+]CC3)c1,C39694904_decoy,TRY1,Decoy,0,-8.43643,-6.15,-4.03,-6.133117633475099
CCc1ccc([C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(N4CCOCC4)nc3)CC23CC[NH2+]CC3)cc1,C39696231_decoy,TRY1,Decoy,0,-9.05895,-7.83,-2.2,-6.96889773358133
CN1CCO[C@@H](CNC(=O)[C@@H]2CN(C(=O)c3cc(F)cc(F)c3)CC23CC[NH2+]CC3)C1,C39696665_decoy,TRY1,Decoy,0,-8.76583,-5.68,-1.79,-5.309745894657184
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NC[C@@H]3CN(C)CCO3)C3(CC[NH2+]CC3)C2)c1F,C39696736_decoy,TRY1,Decoy,0,-9.27256,-7.69,-1.29,-6.533408410875063
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@@H]3CN(C)CCO3)C3(CC[NH2+]CC3)C2)c(C)c1,C39696854_decoy,TRY1,Decoy,0,-8.06249,-5.64,-1.43,-5.348522899605885
Cc1cc2c(c(=O)n1CC[NH+](C)C)[C@@]1(C(=O)N(CC(C)C)c3ccccc31)C(C#N)=C(N)O2,C39919005_decoy,TRY1,Decoy,0,-6.37747,-5.59,-2.78,-5.231097989694736
Cn1cccc1[C@H](CNC(=O)C(=O)Nc1cc2c3c(c1)CCN3C(=O)CC2)[NH+]1CCCC1,C49512838_decoy,TRY1,Decoy,0,-9.17466,-5.79,-1.88,-5.13684942068795
COCCCN1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C63270485_decoy,TRY1,Decoy,0,-8.18543,-6.85,-0.73,-5.911291588698792
NS(=O)(=O)c1ccc(CC[NH2+][C@@H]2CC(=O)N(c3ccc(I)cc3)C2=O)cc1,C06065963_decoy,TRY1,Decoy,0,-9.39497,-5.55,-2.91,-5.846121632872638
N#Cc1ccc(S(=O)(=O)N2CC[NH+](CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)cc1,C08944026_decoy,TRY1,Decoy,0,-8.56392,-7.44,-1.3,-5.578071171012696
NC(=O)c1ccsc1NC(=O)C[NH+]1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1,C09222802_decoy,TRY1,Decoy,0,-9.12081,-7.43,-0.78,-7.558207368892523
CC(C)[NH+]1CCc2c(sc(NC(=O)CCS(=O)(=O)c3ccc(F)cc3)c2C(N)=O)C1,C09629994_decoy,TRY1,Decoy,0,-8.37393,-7.77,-2.49,-6.988291727971477
CC(=O)c1ccc(N2CC[NH+]([C@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)c(F)c1,C09833514_decoy,TRY1,Decoy,0,-8.7917,-8.67,-3.71,-6.225143718647057
CSc1cccc(NC(=O)N[C@H]2C[C@H]3C(=O)NC[C@@H](CCC(=O)N4CCOCC4)[NH+]3C2)c1,C12530530_decoy,TRY1,Decoy,0,-8.96148,-5.03,-2.96,-5.889098776745789
NC(=O)C1(Nc2ccc(F)cc2)CC[NH+]([C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)CC1,C10078905_decoy,TRY1,Decoy,0,-7.99232,-7.22,-0.75,-5.353243346868339
COCCN(C(=O)C[NH+](C)Cc1ccc(Cl)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13040451_decoy,TRY1,Decoy,0,-9.24195,-5.99,-3.29,-6.753658435295312
CCc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(C(=O)C(=O)N3CCOCC3)CC2)n1,C09117650_decoy,TRY1,Decoy,0,-7.68072,-7.1,-4.2,-5.8514437267347965
NS(=O)(=O)c1ccc(CCN2C(=O)CC[C@@H]2CC[NH2+]CCOc2ccc(F)cc2)cc1,C14976637_decoy,TRY1,Decoy,0,-7.9901,-7.34,-3.71,-6.168829210671734
Nc1nc(C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)nc(Nc2ccc3c(c2)OCCO3)n1,C19899241_decoy,TRY1,Decoy,0,-9.56073,-6.88,-2.53,-5.858968660331844
CC[C@@H](C)NC(=O)CSc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccc(Br)cc1,C20758600_decoy,TRY1,Decoy,0,-9.00363,-7.49,-1.32,-9.98109432784345
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C21324743_decoy,TRY1,Decoy,0,-9.40367,-6.21,-4.39,-5.273074675354205
C[C@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)C1,C22797992_decoy,TRY1,Decoy,0,-10.3293,-5.89,-2.51,-7.184156288483954
CNC(=O)NC(=O)[C@@H](C)N1CC[NH+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1,C23469853_decoy,TRY1,Decoy,0,-7.59557,-7.22,-4.33,-5.665340006006799
CNC(=O)NC(=O)[C@H](C)N1CC[NH+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1,C23469856_decoy,TRY1,Decoy,0,-8.73271,-7.24,-2.33,-5.889956121025793
CCOc1ccc(CC(=O)N[C@H](CCSC)C(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)cc1,C13570619_decoy,TRY1,Decoy,0,-9.4307,-5.65,-1.59,-5.986813508989539
CSCC[C@@H](NC(=O)COc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C24987154_decoy,TRY1,Decoy,0,-10.5508,-7.28,-2.22,-9.88962574577894
C[C@@H](O)CN(C[C@@H](C)O)C(=O)c1ccc(-c2ccc3c(c2)[C@H](O)CC2(CC[NH+](C)CC2)O3)cc1,C39227625_decoy,TRY1,Decoy,0,-8.83084,-6.11,-2.54,-5.940767177191345
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)NCCCO)C2(CC[NH2+]CC2)C1,C39605468_decoy,TRY1,Decoy,0,-7.70561,-6.12,-1.28,-5.749569175374204
O=C(NCCNc1ccccc1)[C@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39655576_decoy,TRY1,Decoy,0,-10.2421,-6.33,-1.89,-6.354743010788698
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cccnc2Oc2ccc(C)cc2)CC12CC[NH2+]CC2,C39683957_decoy,TRY1,Decoy,0,-8.42447,-7.38,-2.42,-6.2262395636806405
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccnc2Oc2ccc(C)cc2)CC12CC[NH2+]CC2,C39683958_decoy,TRY1,Decoy,0,-8.71177,-7.26,-2.21,-6.177727048485685
Cc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685699_decoy,TRY1,Decoy,0,-8.46019,-6.74,-4.18,-6.966354252234375
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c1F,C39685800_decoy,TRY1,Decoy,0,-8.67902,-7.8,-1.34,-8.075833430726163
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685895_decoy,TRY1,Decoy,0,-8.17528,-6.36,-2.14,-6.108728445546944
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)nn1C,C39685911_decoy,TRY1,Decoy,0,-9.34474,-7.08,-1.16,-6.887602616084507
CCCCN1C(=O)[C@@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@@H](O)c2ccccc21,C39142926_decoy,TRY1,Decoy,0,-8.4886,-8.2,-1.57,-8.0443109292134
CCCCN1C(=O)[C@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@@H](O)c2ccccc21,C39142928_decoy,TRY1,Decoy,0,-8.27311,-7.73,-1.96,-7.584558470292607
CCCCN1C(=O)[C@H](C(=O)N/N=C(\C)[C@H]2C(=O)[NH+]=c3ccccc3=C2O)[C@H](O)c2ccccc21,C39142929_decoy,TRY1,Decoy,0,-8.57993,-8.13,-2.23,-9.293258621380929
CC1CCC2(CC1)NC(=O)N(NC(=O)CS[C@H]1NN=C(C3=c4ccccc4=[NH+]C3)N1C1CC1)C2=O,C39726916_decoy,TRY1,Decoy,0,-8.23937,-9.26,-2.54,-6.7927247226983365
COC(=O)c1c(NC(=O)c2cc3c(=O)n4cccc(C)c4nc3[n+](CCO)c2N)sc2c1CCCC2,C39841151_decoy,TRY1,Decoy,0,-9.73865,-6.82,-4.55,-6.888010045841089
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])c1ccc(Br)cc1,C40657923_decoy,TRY1,Decoy,0,-7.74252,-5.65,-1.67,-6.000362278488407
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713651_decoy,TRY1,Decoy,0,-7.88672,-7.39,-1.72,-6.24815080043991
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1OC,C44713695_decoy,TRY1,Decoy,0,-8.15509,-6.99,-2.24,-6.559030184669832
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C44713831_decoy,TRY1,Decoy,0,-7.53173,-7.41,-1.0,-5.690900649093294
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1C,C44713960_decoy,TRY1,Decoy,0,-8.94257,-8.1,-3.79,-6.518238142214875
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C44714066_decoy,TRY1,Decoy,0,-8.48067,-6.57,-4.28,-6.578439513473076
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C44714070_decoy,TRY1,Decoy,0,-9.78022,-6.83,-3.14,-6.412617711425254
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cccc(N(C)C)c2)CC12CC[NH2+]CC2,C44714548_decoy,TRY1,Decoy,0,-9.03592,-5.3,-3.22,-5.250746879349987
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1,C15524118_decoy,TRY1,Decoy,0,-8.63003,-7.58,-2.71,-6.160576850337127
C[C@H]([NH2+]CC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)c1ccc(S(N)(=O)=O)cc1,C49605872_decoy,TRY1,Decoy,0,-8.56031,-7.09,-3.1,-6.952191030251185
CNC(=O)[C@H]1Cc2c(Oc3ccc(/C=C/C(=O)NCCc4c[nH+]c[nH]4)cc3)cncc2S1,C52604335_decoy,TRY1,Decoy,0,-9.07025,-5.52,-2.82,-7.129070830704924
COc1cc(OC)cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c1,C39695703_decoy,TRY1,Decoy,0,-8.00557,-6.85,-1.45,-5.916723278993479
COc1cc(OC)cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c1,C44737032_decoy,TRY1,Decoy,0,-8.88481,-8.33,-1.62,-7.541490971449162
COCCn1c(N)c(C(=O)CN2CCC[NH+](Cc3ccc(Cl)cc3)CC2)c(=O)[nH]c1=O,C59394115_decoy,TRY1,Decoy,0,-6.45041,-5.09,-2.77,-4.681929946642676
C=CCNC(=O)NC(=O)COC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1cccs1,C63122540_decoy,TRY1,Decoy,0,-9.25743,-6.24,-2.24,-6.476936314717258
COc1ccc(N2C(=O)[C@@H]3[C@@H](c4ccccc4O)[NH2+][C@@](CC4=c5ccccc5=[NH+]C4)(C(=O)[O-])[C@@H]3C2=O)cc1,C63472991_decoy,TRY1,Decoy,0,-8.42785,-8.4,-2.74,-6.887443615373475
Cc1ccc(S(=O)(=O)N[C@@H](C(C)C)[C@H]2[NH+]=C(c3ccc4c(c3)[nH]c(=O)c(=O)n4C)NO2)cc1,C64890539_decoy,TRY1,Decoy,0,-7.97575,-7.67,-2.96,-5.741815651171624
CC(C)[C@H](NS(=O)(=O)c1ccccc1)[C@@H]1[NH+]=C(c2ccc3c(c2)[nH]c(=O)c(=O)n3C)NO1,C64890545_decoy,TRY1,Decoy,0,-9.43369,-7.86,-3.02,-7.154528077191002
C=C([NH2+][C@@H](Cc1c[nH]c2ccccc12)C(=O)OC)C1C(=O)NC(=O)NC1=O,C04651643_decoy,TRY1,Decoy,0,-7.86931,-6.91,-1.46,-7.326500483175048
C=C([NH2+][C@H](Cc1c[nH]c2ccccc12)C(=O)OC)C1C(=O)NC(=O)NC1=O,C06088470_decoy,TRY1,Decoy,0,-7.39346,-5.46,-1.69,-4.996284078985533
CC[NH+](CC)Cc1c(C(=O)N/N=C(\C)c2ccc(O)c(OC)c2)nnn1-c1nonc1N,C12411656_decoy,TRY1,Decoy,0,-9.24914,-7.62,-2.93,-7.562181707647524
C[NH+](C)CCNC(=O)C[C@@H]1O[C@H](CNC(=O)c2ccc3c(c2)OCO3)[C@@H](O)[C@@H]1O,C12603665_decoy,TRY1,Decoy,0,-7.64457,-6.83,-2.29,-5.755296953738952
CCCn1c(N)c(C(=O)C[NH+](CC)CC(=O)NC(C)(C)C)c(=O)[nH]c1=O,C16560334_decoy,TRY1,Decoy,0,-7.06415,-5.56,-1.27,-5.175512574176684
COCCNC(=O)C[NH+](C)Cc1nc(N)nc(Nc2ccccc2OC)n1,C21672768_decoy,TRY1,Decoy,0,-6.5305,-5.3,-1.21,-5.956443421183649
CC[NH+](CC(=O)Nc1c(F)cccc1F)CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C32850933_decoy,TRY1,Decoy,0,-7.50732,-7.31,-2.46,-6.732904655076614
CSCC[C@@H](NC(N)=O)C(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1C,C32976378_decoy,TRY1,Decoy,0,-7.71157,-6.57,-1.64,-5.975350057496975
Cc1cc(C)nc(N/C(=N/C(=O)CS[C@H]2N[NH+]=C(N)N2)NCCc2c[nH]c3ccc(F)cc23)n1,C39355718_decoy,TRY1,Decoy,0,-10.5337,-8.13,-2.47,-7.961267231200487
O=S(=O)(Oc1ccccc1)c1ccc([C@@H](CNO)N2CC[NH2+][C@H](O)C2)cc1,C39534297_decoy,TRY1,Decoy,0,-8.15167,-5.34,-2.45,-5.531249298519487
CC(C)[C@H]([NH3+])C(=O)N[C@@H](CSC(C)(C)C)C(=O)N[C@H](C(N)=O)[C@@H](C)O,C39934115_decoy,TRY1,Decoy,0,-9.18684,-6.28,-0.98,-8.094838549052412
CC(C)[C@H]([NH3+])C(=O)N[C@@H](CSC(C)(C)C)C(=O)N[C@H](C(N)=O)[C@H](C)O,C22112640_decoy,TRY1,Decoy,0,-9.55711,-4.56,-4.0,-5.641151962802488
Nc1c(NCCCn2cc[nH+]c2)ncnc1NNC(=O)Cc1ccccc1,C40795193_decoy,TRY1,Decoy,0,-6.34346,-5.59,-1.16,-4.92511773384081
C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41791925_decoy,TRY1,Decoy,0,-8.18261,-6.73,-2.38,-5.905412561514319
COCC[NH+](C)CCCNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1,C41923417_decoy,TRY1,Decoy,0,-9.38337,-5.57,-4.31,-7.763591347220292
COCC[NH+](C)CCCNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1,C41923421_decoy,TRY1,Decoy,0,-9.05527,-6.43,-2.7,-7.679629172381115
COC(=O)[C@H](CCC/N=C(\N)N[N+](=O)[O-])NC(=O)c1coc([C@H]2CCC[NH2+]C2)n1,C43216303_decoy,TRY1,Decoy,0,-8.80363,-5.57,-3.25,-6.614033289592277
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)NCCCN2CCCC2=O)co1,C43217355_decoy,TRY1,Decoy,0,-8.19315,-7.8,-1.64,-7.598939835450689
Cc1ccccc1[C@H]1[NH2+][C@](CO)(C(=O)[O-])[C@@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@@H]12,C33913960_decoy,TRY1,Decoy,0,-6.4908,-6.81,-0.82,-5.124047244744239
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2nnc(NCc3ccc(Cl)cc3)o2)co1,C44163263_decoy,TRY1,Decoy,0,-10.3947,-5.83,-2.08,-5.923270287579579
CCCCN/C(S)=C(/C(=O)c1ccc(O)c(C(N)=O)c1)[n+]1cccc(O)c1,C27323556_decoy,TRY1,Decoy,0,-9.86577,-7.47,-0.55,-10.703033448396305
O=C(C[NH+](CC(=O)NC(=O)NC1CC1)Cc1ccco1)NC(=O)NC1CC1,C47549092_decoy,TRY1,Decoy,0,-7.5207,-7.11,-4.33,-8.281007179280426
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccco1,C48732852_decoy,TRY1,Decoy,0,-10.0515,-7.2,-0.54,-7.073716947888114
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1ccco1,C48732855_decoy,TRY1,Decoy,0,-10.0057,-5.76,-2.0,-6.1233220156585535
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)c1cccs1,C48743093_decoy,TRY1,Decoy,0,-8.08768,-7.1,-2.52,-6.458755952280205
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)c1cccs1,C48743096_decoy,TRY1,Decoy,0,-9.84828,-5.85,-0.2,-8.635640063721745
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1cccs1,C48743385_decoy,TRY1,Decoy,0,-10.3794,-6.32,-2.83,-8.97280337090674
NC(=O)c1cc(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)ccc1F,C48767888_decoy,TRY1,Decoy,0,-8.90555,-7.77,-0.69,-8.571680021784777
CCCCCC[NH+](CCO)CC(=O)c1c(N)n(CCOC)c(=O)[nH]c1=O,C52995703_decoy,TRY1,Decoy,0,-6.38582,-5.31,-2.82,-4.945312807120447
CCn1c(N)c(C(=O)C[NH+](C)CC(=O)Nc2c(C)cccc2C)c(=O)[nH]c1=O,C60993385_decoy,TRY1,Decoy,0,-6.72699,-7.54,-0.99,-7.50417815213574
CC(C)C(=O)NC1CC[NH+](CC(=O)Nc2ccccc2SCC(N)=O)CC1,C61023420_decoy,TRY1,Decoy,0,-7.82814,-6.91,-2.34,-7.620967234743041
C[C@@H](O)[C@@H](NC(=O)C1CCN(C(=O)[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)CC1)C(=O)[O-],C63362794_decoy,TRY1,Decoy,0,-8.19363,-5.8,-3.96,-5.381073061917788
CC[NH+](CCCC(=O)NC(=O)NC)CC(=O)Nc1ccc(NC(C)=O)cc1,C63517266_decoy,TRY1,Decoy,0,-6.43299,-6.16,-3.6,-5.385533439541088
O=C(NCCNC(=O)c1ccc(O)cc1)NC1CC[NH+](CC(F)F)CC1,C64255653_decoy,TRY1,Decoy,0,-7.30847,-8.05,-1.99,-6.451654658526201
CSCC[C@@H](NC(N)=O)C(=O)Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1,C54135746_decoy,TRY1,Decoy,0,-9.77463,-7.6,-3.29,-6.880144825668459
CCCNC(=O)C[NH+]1CCC(NC(=O)N[C@@H](C)C(=O)NCc2ccco2)CC1,C65989228_decoy,TRY1,Decoy,0,-7.02972,-5.95,-3.72,-4.643626046352045
COc1cccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)c1OC[C@@H]1CCCO1,C66115437_decoy,TRY1,Decoy,0,-7.63321,-7.0,-1.36,-7.118638204506253
COCCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115439_decoy,TRY1,Decoy,0,-7.88437,-4.52,-1.91,-5.454866215676167
COCCOc1c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cccc1OC,C66115440_decoy,TRY1,Decoy,0,-7.26598,-4.84,-0.78,-5.760268992472509
COc1cc(C[NH2+]C[C@@H](O)COCC(C)C)cc(Cl)c1OCC(N)=O,C67247108_decoy,TRY1,Decoy,0,-8.51988,-5.74,-1.8,-5.736302150940802
COc1cc(C[NH2+]C[C@H](O)COCC(C)C)cc(Cl)c1OCC(N)=O,C67247109_decoy,TRY1,Decoy,0,-8.50135,-6.29,-1.67,-7.746048152126289
C[NH+](CCNC(=O)C(=O)Nc1ccccc1CC(N)=O)Cc1ccccc1,C67380046_decoy,TRY1,Decoy,0,-6.98542,-6.95,-4.73,-5.564554012560738
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2C)C1,C67393206_decoy,TRY1,Decoy,0,-8.96013,-5.66,-3.13,-6.18061660882133
CCC[NH+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2C)C1,C67393207_decoy,TRY1,Decoy,0,-8.78618,-5.36,-3.32,-6.139901596358077
Cc1cc(OCC(N)=O)ccc1NC(=O)C(=O)N[C@@H](C)C[NH+]1CCC[C@H](C)C1,C67397649_decoy,TRY1,Decoy,0,-9.46085,-6.95,-1.67,-6.78015859706549
Cc1ccc(NC(=O)C(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1C(N)=O,C67491460_decoy,TRY1,Decoy,0,-9.41664,-6.67,-0.72,-8.251131573980622
Cc1ccc(NC(=O)C(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1C(N)=O,C67491461_decoy,TRY1,Decoy,0,-9.28745,-6.46,-2.25,-7.15025505515446
Cc1c(C)c(S(=O)(=O)NC(=[NH2+])NCCC[C@@H]([NH3+])C(=O)[O-])c(C)c2c1OC(C)(C)C2,C04899642_decoy,TRY1,Decoy,0,-7.11016,-5.28,-3.16,-4.724035365903465
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3ccc4c(c3)OCCO4)n2)s1,C08993364_decoy,TRY1,Decoy,0,-9.7801,-8.04,-1.31,-6.785735776382193
C[C@H](SCc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C(=O)NC1CC[NH+](CC(N)=O)CC1,C10958865_decoy,TRY1,Decoy,0,-9.26263,-6.24,-1.98,-5.685773328643185
C[C@@H](SCc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C(=O)NC1CC[NH+](CC(N)=O)CC1,C10958871_decoy,TRY1,Decoy,0,-9.16763,-7.4,-1.42,-6.684715135386549
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(CC[NH+]2CCOCC2)C(=O)c2snc(C(N)=O)c2N)cc1,C12476795_decoy,TRY1,Decoy,0,-8.01785,-7.17,-1.98,-7.69640610407346
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(CC[NH+]2CCOCC2)C(=O)c2snc(C(N)=O)c2N)cc1,C12476800_decoy,TRY1,Decoy,0,-8.7524,-7.4,-1.49,-9.804431571764978
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccc(F)cc3F)C[NH+]12)NCc1cccs1,C12530503_decoy,TRY1,Decoy,0,-8.54394,-6.31,-4.24,-6.313899637509947
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)CC(=O)Nc2cc(Cl)ccc2OC)c(=O)[nH]c1=O,C15441825_decoy,TRY1,Decoy,0,-8.17912,-5.59,-2.17,-5.956938146858171
CCOc1cc(/C=N/[NH+]=C(\N)c2nonc2N)ccc1OCc1ccc(F)cc1,C13841724_decoy,TRY1,Decoy,0,-8.56967,-7.35,-2.89,-7.241580149022061
CC1(C)CC(NC(=O)c2nc(COc3ccc(CC(N)=O)cc3)no2)CC(C)(C)[NH2+]1,C20723887_decoy,TRY1,Decoy,0,-7.91571,-8.26,-1.69,-7.42770888181255
CCOc1ccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1OCC,C24283998_decoy,TRY1,Decoy,0,-10.4166,-5.46,-2.37,-6.95199565650981
CNC(=O)c1ccc(C[NH+](CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)C2CC2)cc1,C25194211_decoy,TRY1,Decoy,0,-7.44481,-7.68,-3.99,-6.585777765293836
Cc1ccc(S(=O)(=O)NCC(=O)N/N=C/c2cn(C[C@@H](O)C[NH2+]C(C)(C)CO)c3ccccc23)cc1,C28295705_decoy,TRY1,Decoy,0,-9.1881,-6.91,-3.85,-7.211721537048616
Cc1ccc(S(=O)(=O)NCC(=O)N/N=C/c2cn(C[C@H](O)C[NH2+]C(C)(C)CO)c3ccccc23)cc1,C28295707_decoy,TRY1,Decoy,0,-9.70374,-6.67,-1.75,-9.594632221257802
CCOC(=O)C1=C(CS/C(N)=[NH+]/CCOC)NC(=O)N[C@@H]1c1ccccc1,C30025949_decoy,TRY1,Decoy,0,-6.40031,-5.98,-2.23,-7.771237784610208
CCOC(=O)C1=C(CS/C(N)=[NH+]/CCOC)NC(=O)N[C@H]1c1ccccc1,C30025950_decoy,TRY1,Decoy,0,-7.5182,-5.13,-2.56,-5.400612255890052
COC(=O)c1cc(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)cc(C(=O)OC)c1,C40705683_decoy,TRY1,Decoy,0,-8.31918,-6.53,-1.97,-6.300064341249558
COC(=O)c1cc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc(C(=O)OC)c1,C40705922_decoy,TRY1,Decoy,0,-8.0606,-6.19,-3.89,-6.380880345576103
Nc1c(NCC[NH+]2CCCCC2)ncnc1NNC(=O)c1ccccc1Br,C40756359_decoy,TRY1,Decoy,0,-9.77853,-7.1,-3.61,-6.821626039135668
Cc1ccc2c(Nc3ncnc(NCCCN4CCOCC4)c3N)cccc2[nH+]1,C40756812_decoy,TRY1,Decoy,0,-8.55748,-7.25,-1.48,-8.341114254218272
CC1(C)CC(Nc2ncnc(NNC(=O)COc3ccccc3)c2N)CC(C)(C)[NH2+]1,C40760840_decoy,TRY1,Decoy,0,-6.96398,-5.94,-3.67,-4.993662403730846
COc1ccc(C(=O)NNc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40793667_decoy,TRY1,Decoy,0,-7.41734,-6.77,-2.82,-5.893862828402121
Cc1c(NC(=O)C(=O)NC[C@@H](C(C)C)[NH+]2CCCCCC2)cccc1C(N)=O,C41328664_decoy,TRY1,Decoy,0,-8.77971,-6.95,-2.41,-6.5290755774773634
Cc1c(NC(=O)C(=O)NC[C@H](C(C)C)[NH+]2CCCCCC2)cccc1C(N)=O,C41328668_decoy,TRY1,Decoy,0,-8.4614,-6.37,-3.68,-6.15022380462958
C=CC[NH+](CC=C)[C@@H](CNC(=O)C(=O)Nc1cccc(C(N)=O)c1C)C(C)C,C41856179_decoy,TRY1,Decoy,0,-8.51522,-6.17,-2.58,-8.970242028194141
C=CC[NH+](CC=C)[C@H](CNC(=O)C(=O)Nc1cccc(C(N)=O)c1C)C(C)C,C41856181_decoy,TRY1,Decoy,0,-8.36244,-5.71,-3.18,-6.212929496822696
COC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(C[C@H]([NH3+])CO)c2O)c(C)c1O,C44463971_decoy,TRY1,Decoy,0,-10.543,-7.4,-3.11,-8.67774325148583
COC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(C[C@@H]([NH3+])CO)c2O)c(C)c1O,C44463972_decoy,TRY1,Decoy,0,-9.79016,-7.23,-4.0,-10.042922808806166
CC1CC[NH+](Cc2ccccc2CNC(=O)NNC(=O)C(=O)NC2CC2)CC1,C45777633_decoy,TRY1,Decoy,0,-7.54281,-5.8,-2.12,-5.378318361501849
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC1CC[NH+](CC(N)=O)CC1,C45890821_decoy,TRY1,Decoy,0,-8.35716,-7.17,-1.51,-5.947028719420684
CC[NH+](CC)Cc1ccccc1CNC(=O)C(=O)Nc1sccc1C(N)=O,C47967365_decoy,TRY1,Decoy,0,-8.15524,-5.06,-2.46,-6.120715829651855
COc1ccccc1[C@@H](CNC(=O)NNC(=O)C(=O)NC1CC1)[NH+]1CCCC1,C49790314_decoy,TRY1,Decoy,0,-8.08595,-5.59,-4.3,-5.79030890914161
COc1ccccc1[C@H](CNC(=O)NNC(=O)C(=O)NC1CC1)[NH+]1CCCC1,C49790315_decoy,TRY1,Decoy,0,-7.9962,-5.3,-3.01,-5.581383923670231
CSCC[C@H](NC(N)=O)C(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1,C41399772_decoy,TRY1,Decoy,0,-7.76982,-6.05,-1.94,-5.898958823502535
CSCC[C@@H](NC(N)=O)C(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1,C41399778_decoy,TRY1,Decoy,0,-8.02508,-5.56,-1.4,-6.954836559007405
NC(=O)N[C@@H](CC(=O)NCCC1=c2ccccc2=[NH+]C1)c1cccc(Br)c1,C63111963_decoy,TRY1,Decoy,0,-9.43384,-7.81,-3.13,-6.565141644791304
NC(=O)N[C@H](CC(=O)NCCC1=c2ccccc2=[NH+]C1)c1cccc(Br)c1,C63111964_decoy,TRY1,Decoy,0,-9.01029,-8.21,-1.42,-8.00477701933206
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1ccc(C(N)=O)cc1,C39935188_decoy,TRY1,Decoy,0,-9.58982,-6.53,-2.31,-6.7399071954529886
C[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1ccc(C(N)=O)cc1,C39935189_decoy,TRY1,Decoy,0,-9.14937,-5.87,-4.07,-6.969666710353802
C[C@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1ccc(C(N)=O)cc1,C39935190_decoy,TRY1,Decoy,0,-9.55126,-8.8,-3.36,-11.583313896829804
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1ccc(C(N)=O)cc1,C39935191_decoy,TRY1,Decoy,0,-9.36225,-8.9,-1.71,-9.199368066564062
C[NH+](C)CC(C)(C)CNC(=O)C1CCN(C(=O)CCCCNC(N)=O)CC1,C63802342_decoy,TRY1,Decoy,0,-6.64254,-6.68,-2.87,-6.29791186510573
O=C(NNC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1ccccc1Cl)C(=O)NC1CC1,C64343475_decoy,TRY1,Decoy,0,-9.2795,-8.46,-3.23,-7.246973232835513
Cc1ccc(C)c(N2N[NH2+]N[C@@H]2SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c1,C64684367_decoy,TRY1,Decoy,0,-8.50528,-7.78,-1.45,-6.3438904274680565
CC[NH+](CC)[C@H](CNC(=O)Nc1ccccc1SCC(N)=O)c1ccco1,C65408651_decoy,TRY1,Decoy,0,-7.57234,-5.55,-1.54,-5.494256158568543
N/C(NCCCNC(=O)c1ccc(Br)cc1)=[NH+]/C[C@@H]1CCCO1,C66246164_decoy,TRY1,Decoy,0,-8.65793,-4.66,-1.75,-5.422092171052953
N/C(NCCCNC(=O)c1ccc(Br)cc1)=[NH+]/C[C@H]1CCCO1,C66246165_decoy,TRY1,Decoy,0,-8.98035,-5.06,-1.39,-5.880332014809838
CCOC(=O)C1=C(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)NC(=O)N[C@@H]1c1ccc(OC)cc1,C67204987_decoy,TRY1,Decoy,0,-8.16256,-6.05,-2.08,-6.399713774141992
CCOC(=O)C1=C(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)NC(=O)N[C@H]1c1ccc(OC)cc1,C67204988_decoy,TRY1,Decoy,0,-8.37048,-6.93,-2.92,-6.110085069120053
CC(=O)NCCNC(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C67308472_decoy,TRY1,Decoy,0,-7.53579,-6.41,-2.14,-5.593710414064392
Nc1cc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=S)[nH]1,C03775763_decoy,TRY1,Decoy,0,-6.20295,-5.13,-2.25,-3.7642554446523984
CC[C@@H](c1ccc(O)c(N)c1)[C@@H](CC)c1ccc(O)c(N)c1,C01712503_decoy,TRY1,Decoy,0,-7.24076,-7.17,-4.59,-8.623265786556615
NC(=S)N/N=C1/C[C@H](NNC(N)=S)[C@H]2CO[C@@H]1O2,C04694201_decoy,TRY1,Decoy,0,-7.95561,-6.21,-0.99,-8.9048119743632
NNc1ccc(Br)cc1-c1nc(N)nc(N)n1,C01710624_decoy,TRY1,Decoy,0,-6.92647,-7.14,-0.86,-6.900127750313764
Cc1ccc(Nc2nnc([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)s2)cc1,C05330830_decoy,TRY1,Decoy,0,-8.33913,-6.29,-2.25,-5.978872959727308
CCCCNC(=S)N[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C05706919_decoy,TRY1,Decoy,0,-5.58947,-4.53,-1.62,-3.950051094669384
Nc1ccc(N(c2ccc(N)cc2)c2ccc(N)cc2)cc1,C05420824_decoy,TRY1,Decoy,0,-6.41973,-5.46,-0.48,-4.604632964851242
CCNC(=S)NNC(=O)C(=O)NNC(=S)NCC,C03231827_decoy,TRY1,Decoy,0,-7.70473,-5.05,-3.98,-5.270632309795149
CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12318187_decoy,TRY1,Decoy,0,-5.99662,-7.7,-1.15,-7.552550681360749
Nc1ncnc2c1[nH]c(=S)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C06277170_decoy,TRY1,Decoy,0,-5.99344,-7.84,0.05,-10.791515547628752
C[C@H]1O[C@@H](n2cc(C(N)=O)c3c(N)ncnc32)[C@@H](O)[C@@H]1O,C05390012_decoy,TRY1,Decoy,0,-6.13467,-7.15,-1.29,-6.298532884965876
C[C@@H]1O[C@@H](n2cc(C(N)=O)c3c(N)ncnc32)[C@@H](O)[C@@H]1O,C05390014_decoy,TRY1,Decoy,0,-6.5675,-5.15,-0.39,-3.939043968837856
Nc1ncnc2[nH]c(S[C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)nc12,C16931800_decoy,TRY1,Decoy,0,-7.765,-7.21,-0.73,-7.74023230362664
O=[N+]([O-])c1ccc(N/N=C\[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)cc1,C17353046_decoy,TRY1,Decoy,0,-6.83821,-7.61,-1.61,-7.026285017561198
CC(C)Cc1c(C#N)c(N)nc2sc(C(N)=O)c(N)c12,C28296530_decoy,TRY1,Decoy,0,-7.51108,-7.31,-0.05,-16.506261857404695
CC[C@H](c1ccc(O)c(N)c1)[C@@H](CC)c1ccc(O)c(N)c1,C17145735_decoy,TRY1,Decoy,0,-8.03184,-6.97,-0.75,-9.184845551269138
Cn1c(N)nc2c([nH]c(=O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1=O,C16919964_decoy,TRY1,Decoy,0,-5.63069,-7.57,-1.98,-6.057506263992416
CN(C)c1nc(N)nc(CSc2nc(N)cc(N)n2)n1,C31820230_decoy,TRY1,Decoy,0,-8.76582,-7.04,-0.9,-10.4452338862311
COc1nc2c(nc(N)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=O)n1C,C17194148_decoy,TRY1,Decoy,0,-6.15585,-4.58,-2.65,-3.55166787919033
CNC(=S)NNC(=O)CCC(=O)NNC(=S)NC,C05412948_decoy,TRY1,Decoy,0,-9.20605,-4.94,-3.09,-6.977697700011178
CO[C@H]1[C@H](O)[C@H](CO)O[C@@H]1n1cnc2c(N)nc(N)nc21,C34350985_decoy,TRY1,Decoy,0,-6.54218,-7.71,-0.56,-9.354335929406387
CO[C@H]1[C@@H](O)[C@H](CO)O[C@@H]1n1cnc2c(N)nc(N)nc21,C34350988_decoy,TRY1,Decoy,0,-6.56798,-6.96,-0.61,-7.704743048307509
Nc1ncnc2c1[nH]c(=S)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C04823533_decoy,TRY1,Decoy,0,-5.89129,-7.72,-1.38,-7.549574586603131
C=CCn1c(=O)n([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c21,C27108671_decoy,TRY1,Decoy,0,-5.53242,-6.6,-1.39,-5.795948063010468
C=CCn1c(=O)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c21,C27108668_decoy,TRY1,Decoy,0,-6.34745,-5.49,-0.63,-4.462407286277404
C[C@@H]1CC(=O)c2c(cc3c(-c4c(O)cc(O)c5c(O)c6c(cc45)O[C@@H](C)CC6=O)c(O)cc(O)c3c2O)O1,C13660214_decoy,TRY1,Decoy,0,-9.23085,-6.84,-3.71,-5.069704531357345
[H]/N=C(\N)N/C(N)=N/c1c(F)cc(F)cc1Br,C24817638_decoy,TRY1,Decoy,0,-8.58363,-5.06,-0.59,-4.626383097842133
Nc1ccc(O)c2c1C(=O)[C@@H]1C(NCO)=CC=C(O)[C@H]1C2=O,C38655966_decoy,TRY1,Decoy,0,-7.3324,-6.69,-1.0,-6.112501329694296
NNc1ncnc(Nc2ccccc2Br)c1N,C40781411_decoy,TRY1,Decoy,0,-7.20687,-7.39,-0.75,-8.751695922318268
NNc1ncnc(Nc2cccc(Br)c2)c1N,C40783871_decoy,TRY1,Decoy,0,-7.29589,-6.98,-0.83,-8.374113378203626
Nc1cc(N)nc(Sc2cc3c(cc2N)OCCO3)n1,C41023272_decoy,TRY1,Decoy,0,-8.1114,-7.97,-1.43,-8.747915436504265
Nc1cc(N)nc(Sc2cc3c(cc2N)NC(=O)CC3)n1,C41023347_decoy,TRY1,Decoy,0,-8.38698,-7.42,-0.44,-10.167060787775329
Nc1cc(=O)[nH]c(Sc2cc3nc[nH]c(=O)c3cc2N)n1,C41027111_decoy,TRY1,Decoy,0,-7.84547,-7.79,-1.42,-6.818214748889064
COC1C2=CC(O)C=C1CC1=C[C@@H](O)C=C(CC3=CC(O)C=C(CC4=C[C@@H](O)C=C(C2)[C@@H]4O)C3O)[C@H]1O,C44790380_decoy,TRY1,Decoy,0,-9.55678,-6.07,-2.05,-4.330405612126817
COC1C2=CC(O)C=C1CC1=C[C@@H](O)C=C(CC3=CC(O)C=C(CC4=C[C@H](O)C=C(C2)[C@@H]4O)C3O)[C@H]1O,C44790383_decoy,TRY1,Decoy,0,-8.59736,-6.29,-2.19,-4.881621578892046
CCOCCCNC(=S)NNC(=O)CCNC(N)=O,C49046107_decoy,TRY1,Decoy,0,-7.04567,-4.71,-3.79,-4.974834409883739
C[C@@H]1CC[C@H](C(N)=O)CN1c1cc(C(N)=O)c(N)cc1F,C50032539_decoy,TRY1,Decoy,0,-7.45367,-7.65,-1.05,-8.361352103378701
C[C@@H]1CC[C@@H](C(N)=O)CN1c1cc(C(N)=O)c(N)cc1F,C50032545_decoy,TRY1,Decoy,0,-7.38211,-7.43,-0.74,-7.845261011985236
CC(C)c1[nH]nc(C(=O)NCCCS(N)(=O)=O)c1N,C50321665_decoy,TRY1,Decoy,0,-7.53343,-5.52,-1.82,-5.42796703900917
NC(=O)C1CCC(NC(=O)c2[nH]nc(C3CC3)c2N)CC1,C50324376_decoy,TRY1,Decoy,0,-7.86114,-5.98,-2.26,-4.796905434100421
Nc1cc(N)nc(SCc2ccc(N)c([N+](=O)[O-])c2)n1,C50839429_decoy,TRY1,Decoy,0,-6.07924,-7.15,-2.02,-5.919437041699459
Nc1ccc(/N=N/c2ccc(S(N)(=O)=O)cc2)c(N)c1,C04097405_decoy,TRY1,Decoy,0,-7.50934,-7.94,-1.25,-8.76136042365279
CC1=C(C(N)=O)[C@H](c2ccc(C)s2)C(C(N)=O)=C(N)O1,C58949571_decoy,TRY1,Decoy,0,-7.01374,-4.89,-2.28,-5.467852939439618
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@H]1c1ccc([N+](=O)[O-])o1,C58950383_decoy,TRY1,Decoy,0,-5.25565,-6.0,-0.83,-4.160705177131926
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@@H]1c1ccc([N+](=O)[O-])o1,C58950385_decoy,TRY1,Decoy,0,-6.00704,-5.66,-1.49,-4.64603251475669
Nc1nc2c(ncn2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=S)[nH]1,C13597437_decoy,TRY1,Decoy,0,-7.80147,-4.61,-1.14,-3.948873272455452
NNc1ccc(Cl)c(CSc2nc(N)cc(N)n2)n1,C61640228_decoy,TRY1,Decoy,0,-8.39246,-6.52,-3.89,-7.725177890315359
NNc1ccc(Cl)c(CSc2nc(N)cc(=O)[nH]2)n1,C61640245_decoy,TRY1,Decoy,0,-8.26681,-6.32,-1.28,-7.973949209396733
NC(=O)CN(CC(N)=O)c1cc2c(cc1N)NC(=O)CC2,C61807629_decoy,TRY1,Decoy,0,-7.10134,-6.14,-1.43,-7.225591552965819
C=CCn1c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c2nc(N)[nH]c(=O)c21,C11680992_decoy,TRY1,Decoy,0,-5.63415,-6.46,-1.44,-6.834824541218323
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)c4ccco4)nc3[C@@H](CC(=O)N3CCC(C(N)=O)CC3)[C@]2(C)CC[C@H]1O,C04222435_decoy,TRY1,Decoy,0,-9.9925,-6.81,-1.45,-7.652856236936994
COc1cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc(OC)c1O,C01781726_decoy,TRY1,Decoy,0,-8.16198,-8.03,-3.62,-7.232161062673104
CC(C)C[C@H](NC(N)=O)C(=O)OCC(=O)c1c(N)n(C)c(=O)n(C)c1=O,C03370361_decoy,TRY1,Decoy,0,-6.74759,-6.95,-1.61,-5.951777936888701
Nc1nc(SCc2ccccc2[N+](=O)[O-])c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04720761_decoy,TRY1,Decoy,0,-5.58336,-6.39,-1.75,-4.415071648442006
CCOC(=O)CNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O,C05104502_decoy,TRY1,Decoy,0,-7.04398,-7.68,-1.86,-11.557624445509658
C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)n1N)C(=O)NC(N)=O,C03366481_decoy,TRY1,Decoy,0,-6.19408,-7.8,-3.28,-5.622738501156208
Cc1cccc(C)c1NC(=O)CN(/N=N/c1nonc1N)c1nonc1N,C08442581_decoy,TRY1,Decoy,0,-6.86187,-8.2,-1.63,-8.074586203503817
COCCNC(=O)c1c(N)n(/N=C/c2ccc(O)c(O)c2)c2nc3ccccc3nc12,C02249587_decoy,TRY1,Decoy,0,-8.38409,-6.03,-1.11,-6.661884657972402
COc1ccc(OC[C@H](O)Cn2c(NN)nc3c2c(=O)[nH]c(=O)n3C)cc1,C00627238_decoy,TRY1,Decoy,0,-8.18194,-6.59,-1.15,-6.484343539478215
Cc1occc1C(=O)NNC(=O)CCC(=O)Nc1sccc1C(N)=O,C12994041_decoy,TRY1,Decoy,0,-8.97064,-7.24,-1.97,-7.353884444691306
COc1ccc(OC[C@@H](O)Cn2c(NN)nc3c2c(=O)[nH]c(=O)n3C)cc1,C13230627_decoy,TRY1,Decoy,0,-7.65491,-7.21,-3.09,-7.932320702438924
O=C1C(Cl)=C(/N=C/[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C(=O)c2ccccc21,C04864450_decoy,TRY1,Decoy,0,-8.3286,-5.37,-3.02,-5.385948050165776
O=C1C(Cl)=C(/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)c2ccccc21,C04864452_decoy,TRY1,Decoy,0,-7.85495,-5.74,-2.22,-5.380526227064863
Nc1nc(SCc2ccccc2[N+](=O)[O-])c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c2n1,C01681630_decoy,TRY1,Decoy,0,-5.27753,-6.86,-2.15,-5.0354770082234985
COc1ccc(N2C(=O)NC(=O)/C(=C/NC(CO)(CO)CO)C2=O)cc1,C05558825_decoy,TRY1,Decoy,0,-7.28124,-6.49,-2.14,-5.509612973867609
Cc1nnc(CN2CCN(C(=O)CSc3nnc(NN)n3N)CC2)o1,C20922363_decoy,TRY1,Decoy,0,-7.34148,-7.64,-2.22,-7.115690623747319
CCc1nnc(CN2CCN(C(=O)CSc3nnc(NN)n3N)CC2)o1,C20922369_decoy,TRY1,Decoy,0,-7.96096,-7.72,-0.74,-7.016469399985718
C[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)NC(N)=O,C22408352_decoy,TRY1,Decoy,0,-9.42593,-6.86,-1.61,-8.098181261199443
COc1ccc(-c2nnc(S[C@H](C(=O)NC(N)=O)C(C)C)n2N)cc1,C22574061_decoy,TRY1,Decoy,0,-7.22858,-7.22,-1.49,-5.896459031131259
CCOc1ccc(NC(=O)[C@H]2CC(=O)Nc3nc(N4CCC(C(N)=O)CC4)[nH]c(=O)c32)cc1,C22610422_decoy,TRY1,Decoy,0,-8.27519,-8.24,-3.09,-6.312569335543344
C[C@H](Sc1nnc(CCC(N)=O)n1Cc1ccco1)C(=O)NC(N)=O,C23369833_decoy,TRY1,Decoy,0,-7.11261,-7.2,-1.92,-10.026092635603272
C[C@@H](NC(N)=O)C(=O)NNC(=O)CSc1cc(Cl)ccc1Cl,C25386485_decoy,TRY1,Decoy,0,-8.6882,-7.27,-3.09,-7.71053052607725
Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1ccc(OCC(N)=O)cc1,C02541990_decoy,TRY1,Decoy,0,-8.16271,-8.04,-2.86,-7.33431412517757
C[C@H](Nc1ccc(OCC(N)=O)cc1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C28359610_decoy,TRY1,Decoy,0,-7.12296,-6.0,-2.82,-5.401191321898052
C=CCNC(=O)Nc1ccc(NC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)cc1,C29204810_decoy,TRY1,Decoy,0,-6.9309,-6.58,-1.43,-7.930878706016854
CC1=C(CC[C@H](C)O)C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1,C31168500_decoy,TRY1,Decoy,0,-8.26072,-6.45,-3.54,-5.571661101220028
[NH3+]CCCC[C@]1(C(=O)[O-])[NH2+][C@H](c2cc(Cl)ccc2O)[C@@H]2C(=O)N=C([O-])[C@H]21,C34387435_decoy,TRY1,Decoy,0,-8.46452,-5.89,-1.91,-7.610229487103491
COc1cc(/C=C\CO)cc(OC)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C36046230_decoy,TRY1,Decoy,0,-6.74059,-5.28,-1.59,-5.102964974062403
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)CO)C(C)(C)C,C36590532_decoy,TRY1,Decoy,0,-7.06175,-4.88,-1.59,-5.347898352002115
CCCn1c(N)c(C(=O)CSc2nc(N)cc(=O)[nH]2)c(=O)n(C)c1=O,C16045938_decoy,TRY1,Decoy,0,-7.2637,-6.98,-1.67,-6.941634208795812
CSC1=N[C@H](N/C(C)=C(/CCO)C(=O)N2NC(SC)=N[C@H]2N)N=N1,C38783406_decoy,TRY1,Decoy,0,-8.8178,-4.58,-2.37,-5.519384856821225
C[C@@H]1C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@@H]1CC[C@@H](C)O,C39560287_decoy,TRY1,Decoy,0,-7.80871,-6.86,-3.4,-6.32176305151787
C[C@@H]1C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC(C)(C)[C@@H]1CC[C@@H](C)O,C39560289_decoy,TRY1,Decoy,0,-7.20048,-6.01,-2.35,-5.057440122352182
NC(=O)C(NC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(N)=O,C42788866_decoy,TRY1,Decoy,0,-8.35842,-7.32,-3.06,-6.68766276977729
O=C(NCCNC(=O)C1CC1)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42893946_decoy,TRY1,Decoy,0,-7.29755,-6.39,-3.1,-5.513125855662745
O=C(NCCNC(=O)C1CC1)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42893950_decoy,TRY1,Decoy,0,-7.48208,-7.03,-3.62,-7.281688233181097
O=C(NCCNC(=O)C1CC1)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42893953_decoy,TRY1,Decoy,0,-7.08628,-6.31,-1.63,-5.420184461494606
O=C([O-])[C@@H]1Cc2c([nH]c3ccccc23)[C@H](CCC[C@H]2[NH2+][C@@H](C(=O)[O-])Cc3c2[nH]c2ccccc32)[NH2+]1,C35182975_decoy,TRY1,Decoy,0,-8.29376,-8.36,-3.49,-6.217730346656131
Nc1cc(Br)ccc1S(=O)(=O)NCCCS(N)(=O)=O,C45068128_decoy,TRY1,Decoy,0,-8.70954,-4.41,-1.23,-5.271981517421826
CC1=C(CC[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)C[C@@H](O)C1,C49181271_decoy,TRY1,Decoy,0,-6.7891,-6.73,-2.85,-5.0056654645918535
CCCCn1c(N)c(N(C)CC(=O)N[C@@H]2CCCCNC2=O)c(=O)[nH]c1=O,C52362701_decoy,TRY1,Decoy,0,-6.89034,-7.54,-2.58,-7.469774363798673
CCC(Nc1ccccc1SCC(N)=O)=C1C(=O)NC(=S)NC1=O,C09770206_decoy,TRY1,Decoy,0,-8.80614,-6.87,-1.37,-7.39689736724211
NC(=O)NC(=O)CCCSc1nnc(COc2ccc(F)cc2)n1N,C60340322_decoy,TRY1,Decoy,0,-7.7118,-7.96,-2.86,-6.923581507000403
CSCC[C@@H](NC(N)=O)C(=O)NNC(=O)c1cc(Br)c[nH]1,C61441967_decoy,TRY1,Decoy,0,-8.26478,-4.18,-1.95,-5.18466588662889
NC(=O)CN(CC(N)=O)S(=O)(=O)c1cc(Br)ccc1N,C61807298_decoy,TRY1,Decoy,0,-6.9203,-6.33,-2.22,-7.458036371392244
Cc1nc2c(C(N)=O)ncn2c(C)c1CCC(=O)NNC(=O)NCC(C)C,C65180494_decoy,TRY1,Decoy,0,-8.30499,-7.63,-3.61,-7.945475172197931
NC(=O)C(NC(=O)NCC1(c2cccc(Cl)c2)CCOCC1)C(N)=O,C54818208_decoy,TRY1,Decoy,0,-9.18646,-5.67,-3.14,-7.843476311485433
C[C@H](NC(=S)NNC(=O)CNC(N)=O)c1ccc(Cl)cc1Cl,C66122361_decoy,TRY1,Decoy,0,-8.35527,-6.74,-3.67,-6.887098068355984
C#Cc1cccc(NC(=S)NNC(=O)C[C@H](NC(N)=O)c2ccccc2C)c1,C67196369_decoy,TRY1,Decoy,0,-7.7437,-6.21,-2.79,-5.588366197885034
C#Cc1cccc(NC(=S)NNC(=O)C[C@H](NC(N)=O)c2cccs2)c1,C67196788_decoy,TRY1,Decoy,0,-9.3309,-6.47,-1.77,-7.892742275765776
OC[C@@H]1O[C@H](Oc2cccc(Cl)c2)[C@@H](O)[C@H](O)[C@@H]1O,C00485478_decoy,TRY1,Decoy,0,-6.68038,-4.64,-2.53,-3.848935861252006
OC[C@@H]1O[C@H](Oc2ccc(Cl)cc2)[C@H](O)[C@H](O)[C@@H]1O,C04010946_decoy,TRY1,Decoy,0,-5.25991,-4.55,-0.02,-3.448061096335614
OC[C@@H](O)[C@@H](O)[C@@H](O)c1cnc2ccccc2n1,C02572932_decoy,TRY1,Decoy,0,-6.46991,-4.83,-0.57,-4.197921599300653
Cc1ccc([C@@]2(CO)OC[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C04991078_decoy,TRY1,Decoy,0,-5.76901,-4.73,-0.87,-3.604393227238736
OC[C@H]1O[C@@H](Oc2cccc(Cl)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C16039840_decoy,TRY1,Decoy,0,-7.06085,-5.96,-2.05,-4.92610114464054
N/C(=N\O)c1ccccc1Sc1nccc(=O)[nH]1,C20483934_decoy,TRY1,Decoy,0,-6.99743,-5.69,-0.75,-4.822309666269347
NC1=C(F)CN([C@@H]2CS[C@H](CO)O2)C(=O)N1,C21992674_decoy,TRY1,Decoy,0,-7.48147,-4.65,0.4,-4.227862964573611
Cc1[nH+]cc(CO)c([C@@H]2NCCc3[nH]cnc32)c1[O-],C00973502_decoy,TRY1,Decoy,0,-6.49864,-5.11,-1.72,-3.706867892524484
Cc1ccc2[nH]cc(NC(=O)NCCO)c(=O)c2c1,C13565931_decoy,TRY1,Decoy,0,-6.80637,-5.24,-1.39,-4.0139245473845975
O=C(NCCO)Nc1c[nH]c2c(Cl)cccc2c1=O,C13565987_decoy,TRY1,Decoy,0,-7.57215,-5.75,-1.21,-5.096676169845341
[NH3+][N-]S(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2,C35431154_decoy,TRY1,Decoy,0,-6.71113,-5.62,-0.12,-4.14219229104414
Nc1ccc(F)c(S(=O)(=O)Nc2cn[nH]c2)c1,C35763487_decoy,TRY1,Decoy,0,-6.9693,-4.55,-1.48,-4.594918284253075
CC(=O)NCCNc1cc2c(cc1N)OCCO2,C36746316_decoy,TRY1,Decoy,0,-6.44179,-4.37,-1.25,-3.644028519229802
O=C([O-])c1ccc(F)c(NC(=O)[C@@H]2C[C@@H](O)C[NH2+]2)c1,C37043392_decoy,TRY1,Decoy,0,-7.18921,-5.76,-2.15,-6.07588545059215
Nc1cc(F)c(S(=O)(=O)NCCCO)c(F)c1,C37928390_decoy,TRY1,Decoy,0,-6.12795,-6.81,-1.62,-7.496172427386163
CN(c1cc(N)cc(S(N)(=O)=O)c1)C1CCOCC1,C37934294_decoy,TRY1,Decoy,0,-7.83111,-5.22,-1.74,-4.665076458972088
C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(N)cn1C1CC1,C40330502_decoy,TRY1,Decoy,0,-7.04793,-5.24,-1.64,-4.90357998476943
Cc1n[nH]c(C)c1S(=O)(=O)N[C@@H](C)C(N)=S,C40362631_decoy,TRY1,Decoy,0,-6.34611,-4.23,-2.33,-4.036215172266008
CC1CCC(NC(=O)[C@](C)([NH3+])C2CC2)(C(=O)[O-])CC1,C40481566_decoy,TRY1,Decoy,0,-6.59968,-6.0,-1.09,-6.636829701354427
CC1CCC(NC(=O)C2([NH3+])CCCC2)(C(=O)[O-])CC1,C40481568_decoy,TRY1,Decoy,0,-6.94961,-3.7,-0.0,-3.6467288354354728
CC(C)(C)[C@@H](NC(=O)C1([NH3+])CCCCC1)C(=O)[O-],C40482104_decoy,TRY1,Decoy,0,-6.96769,-4.06,-1.55,-4.447525306838825
Cc1cc(C)c(/C(N)=N/O)c(SCCO)n1,C40515912_decoy,TRY1,Decoy,0,-7.00771,-3.82,-0.42,-3.8760727555141736
Nc1ccc(N(CCO)CCO)c2ncccc12,C40694594_decoy,TRY1,Decoy,0,-6.55078,-4.75,-1.15,-4.237703393898097
Nc1ccc(F)c(S(=O)(=O)NCc2cc[nH]n2)c1,C41013933_decoy,TRY1,Decoy,0,-6.01169,-6.53,-1.11,-6.331182002234224
CNC(=O)NC(=O)[C@H](C)[S@+]([O-])c1c(F)cc(N)cc1F,C42198789_decoy,TRY1,Decoy,0,-6.72205,-7.34,-0.86,-9.789363607748344
O=C(NC[C@H](O)C(F)(F)F)NC1CCC(O)CC1,C42961392_decoy,TRY1,Decoy,0,-6.73133,-4.67,-1.02,-4.4286456195181625
Cc1ccc(/C(N)=N/O)c(N(CCO)C(C)C)n1,C43400021_decoy,TRY1,Decoy,0,-6.90146,-4.4,-2.13,-4.6940266922466725
N/C(=N/O)C1(C(=O)N2CCC[C@H](CO)C2)CCCC1,C44785367_decoy,TRY1,Decoy,0,-6.16915,-5.34,-1.05,-4.720451967182176
CCC[C@@H](C(=O)N1C[C@H](C(N)=O)CC[C@@H]1C)C(N)=S,C44858774_decoy,TRY1,Decoy,0,-6.92012,-5.4,-1.88,-5.233564238711414
C[C@@H]1CN(C(=O)c2ccc(N)cc2N)CC(C)(C)O1,C45661385_decoy,TRY1,Decoy,0,-6.69715,-4.79,-0.61,-3.8935235183036094
C[C@H]1CN(C(=O)c2cc(N)cc(N)c2)CC(C)(C)O1,C45661394_decoy,TRY1,Decoy,0,-7.06315,-7.69,-0.44,-10.930416511857246
CCC[C@@H]1CC2=C([C@H](OC)O1)[C@@H](O)[C@H](O)[C@H](O)[C@@H]2O,C49181978_decoy,TRY1,Decoy,0,-7.50813,-5.36,-0.51,-4.971098865708562
C[C@@H](NC(=O)c1[nH]nc(C2CC2)c1N)[C@@H]1CCCO1,C50323767_decoy,TRY1,Decoy,0,-6.97219,-5.02,-0.32,-4.595243409454883
NNc1ccccc1C(=O)N[C@@H]1CCS(=O)(=O)C1,C51088972_decoy,TRY1,Decoy,0,-7.14548,-5.29,-0.21,-4.990970054699791
Cc1n[nH]c(SC[C@@H](O)c2ccc(N)cc2)n1,C51325703_decoy,TRY1,Decoy,0,-7.0078,-6.77,0.2,-8.499018277362422
Cc1ccc(/C(N)=N/O)c(N2CCN(CCO)CC2)c1,C51579013_decoy,TRY1,Decoy,0,-7.19715,-6.2,-0.75,-6.953852572572227
Cc1cc(C(=O)NC[C@H](C)/C(N)=N/O)c(C)o1,C54155351_decoy,TRY1,Decoy,0,-6.26018,-6.74,-3.11,-6.060496953457752
CCNC(=O)CNc1nccnc1C(N)=S,C54397403_decoy,TRY1,Decoy,0,-7.21077,-4.44,-0.07,-4.944011276309504
CC(C)N(CC(N)=O)c1nccnc1C(N)=S,C54397970_decoy,TRY1,Decoy,0,-6.03157,-3.01,-1.78,-4.52117730928382
Cc1ccc(C(=O)NC[C@H](O)c2ccc(N)cc2)c(C)n1,C55330021_decoy,TRY1,Decoy,0,-6.69877,-7.57,-0.66,-8.930291953937632
CC(=O)C1=C(C)OC(N)=C(C(N)=O)[C@H]1c1ccc(C)o1,C58949128_decoy,TRY1,Decoy,0,-5.97497,-4.69,-1.19,-4.350702490787349
CC(C)(C)[C@@H]1C[C@@](O)(CC[NH3+])CCN1C(=O)[O-],C59269019_decoy,TRY1,Decoy,0,-6.93019,-4.15,-2.72,-3.978226878338461
NC(=O)CN[C@H]1C(=O)Nc2ccc(Br)cc21,C22218152_decoy,TRY1,Decoy,0,-6.74276,-4.21,-1.17,-3.9509802448661047
Cc1cc(C#N)ccc1N(CC(N)=O)CC(N)=O,C61808907_decoy,TRY1,Decoy,0,-5.9481,-5.37,-1.73,-6.4977647545594
CC(C)(CC(=O)[O-])C[C@@H]([NH3+])c1ccc2c(c1)CCC(=O)N2,C61825077_decoy,TRY1,Decoy,0,-6.78137,-6.84,-1.74,-7.284101740016262
OC[C@@H](O)[C@@H]1O[C@H](c2ccccc2)O[C@H](CO)[C@@H]1O,C04743051_decoy,TRY1,Decoy,0,-6.63197,-5.34,-1.84,-4.808669452768579
Cc1ccc2nc(SCC[C@H]([NH3+])C(=O)[O-])[nH]c2c1,C62604514_decoy,TRY1,Decoy,0,-6.34694,-5.32,-0.72,-4.57628442972929
CC[C@]1(C(=O)[O-])CCCN(C(=O)NCC[NH3+])C1,C62874472_decoy,TRY1,Decoy,0,-6.97478,-4.14,-1.49,-4.525997645001649
C[C@]([NH3+])(C(=O)Nc1cncc(C(=O)[O-])c1)C1CC1,C62947185_decoy,TRY1,Decoy,0,-7.77691,-4.34,-1.76,-4.517591192035212
C[C@@H](CO)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O,C66402749_decoy,TRY1,Decoy,0,-5.03204,-3.82,-2.05,-3.192530975850804
O=c1c(O)cc([C@H]2Oc3cc(O)cc(O)c3C[C@H]2O)cc2c([C@H]3Oc4cc(O)cc(O)c4C[C@H]3O)cc(O)c(O)c12,C03978446_decoy,TRY1,Decoy,0,-12.6793,-8.96,-4.24,-7.68117254795133
C=C1c2c(Cl)ccc(O)c2C(O)=C2C(=O)[C@]3(O)C(O)=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]12,C04149268_decoy,TRY1,Decoy,0,-8.34099,-7.52,-2.87,-5.780385028196266
C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C04349550_decoy,TRY1,Decoy,0,-8.35556,-9.74,-2.63,-7.7166701484086495
C[C@@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@H]1O,C04692014_decoy,TRY1,Decoy,0,-9.25142,-9.15,-3.93,-7.940720583552647
C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@@]5(O)[C@@H]4CC[C@]3(O)C2)[C@@H](O)[C@@H](O)[C@H]1O,C08214790_decoy,TRY1,Decoy,0,-8.26794,-8.2,-2.01,-5.627876312787821
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@@]1(C)O)[C@]2(C)O,C08444184_decoy,TRY1,Decoy,0,-9.11706,-7.67,-2.55,-7.4079665333818046
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@]1(C)O)[C@]2(C)O,C08444186_decoy,TRY1,Decoy,0,-8.721,-6.8,-2.48,-5.6975400292568334
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@]1(C)O)[C@@]2(C)O,C00969648_decoy,TRY1,Decoy,0,-7.34633,-7.31,-2.75,-5.976699116385962
C[C@H]1O[C@@H](O[C@H]2C(=O)c3c(O)cc(O)cc3O[C@@H]2c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C08952753_decoy,TRY1,Decoy,0,-8.70709,-8.1,-3.18,-7.210612891639442
C[C@@]1(O[C@@]2(C)[C@@](C)(O)[C@@](C)(O)[C@H](O)O[C@@]2(C)CO)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09915714_decoy,TRY1,Decoy,0,-5.4013,-6.37,-4.18,-4.490602549047463
C[C@@]1(OC[C@]2(C)O[C@@H](O)[C@](C)(O)[C@](C)(O)[C@]2(C)O)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970470_decoy,TRY1,Decoy,0,-5.72267,-6.95,-2.8,-4.978573333190225
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@H](O)[C@H]3C[C@H]12,C11592648_decoy,TRY1,Decoy,0,-8.08564,-6.83,-3.69,-5.393546767932526
C[C@H]1O[C@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@@H]1O,C12153442_decoy,TRY1,Decoy,0,-7.04809,-9.13,-1.42,-7.824853683117098
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]12,C08034268_decoy,TRY1,Decoy,0,-7.87192,-5.79,-3.35,-4.232799856668185
Nc1ncnc2c1[nH]/c(=N\N=C/c1ccc(Br)cc1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01901765_decoy,TRY1,Decoy,0,-6.53526,-6.98,-2.65,-6.7043342366274175
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@H]2CO)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C15169013_decoy,TRY1,Decoy,0,-9.03513,-5.81,-3.53,-5.922107550446346
O=c1c(O[C@@]2(O)[C@H](CO)O[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C15222658_decoy,TRY1,Decoy,0,-9.25434,-9.61,-1.12,-8.422816337438174
COc1cc(O)c2c(=O)cc(C3(O)C=CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C=C3)oc2c1,C31155532_decoy,TRY1,Decoy,0,-7.72265,-8.26,-2.39,-5.481182509598672
O=C1c2c(cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2O)O[C@H](c2ccc(O)c(O)c2)[C@H]1O,C31159745_decoy,TRY1,Decoy,0,-8.95662,-6.16,-1.67,-5.80617330095734
COc1cc(O)c2c(=O)c(O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)c(-c3ccc(O)c(O)c3)oc2c1O,C31164099_decoy,TRY1,Decoy,0,-8.65807,-6.84,-3.49,-5.823703515741672
Nc1nc(N)c(/N=N/c2c(Br)cc(S(N)(=O)=O)cc2Br)c(N)n1,C17426413_decoy,TRY1,Decoy,0,-8.00699,-6.33,-1.14,-10.442577078261008
C[C@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc4ccc(=O)oc4c3)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C35271485_decoy,TRY1,Decoy,0,-6.67945,-7.23,-2.98,-5.3298103398667385
Cc1cc(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)c2c3c(c(O)cc2c1)C(=O)c1c(O)cccc1[C@H]3O,C35458387_decoy,TRY1,Decoy,0,-8.25847,-6.58,-1.99,-5.483483464289387
Cc1cc(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)c2c3c(c(O)cc2c1)C(=O)c1c(O)cccc1[C@@H]3O,C35458390_decoy,TRY1,Decoy,0,-8.68822,-6.79,-2.4,-5.724733641625068
C[C@H]1O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@H]1O,C04349549_decoy,TRY1,Decoy,0,-9.26385,-9.43,-2.31,-7.900735105110118
COC(=O)c1cc(O)c(O)c(O)c1-c1c(O)c(O)c2oc(=O)c3cc(O)c(O)c4oc(=O)c1c2c43,C15216595_decoy,TRY1,Decoy,0,-9.15834,-7.35,-2.47,-6.433524216937462
CC(=O)O[C@H]1[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@@H](CO)[C@@H](O)[C@@H]1O,C35455067_decoy,TRY1,Decoy,0,-8.02865,-8.44,-2.6,-8.151004273281748
COc1c(O)cc2c(c1O)C(=O)O[C@H](C)[C@H](O)c1c(O)c(O)c(OC)c(O)c1C(=O)O[C@@H](C)[C@H]2O,C31163491_decoy,TRY1,Decoy,0,-9.15585,-6.58,-1.93,-5.291572140077263
COc1c(O)cc2c(c1O)C(=O)O[C@H](C)[C@H](O)c1c(O)c(O)c(OC)c(O)c1C(=O)O[C@H](C)[C@@H]2O,C31163479_decoy,TRY1,Decoy,0,-9.08101,-6.53,-1.17,-5.42307239508864
C[C@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)COC(=O)C1,C31167126_decoy,TRY1,Decoy,0,-9.17127,-9.52,-2.89,-8.705044687018745
COc1c(O)cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1O,C31158282_decoy,TRY1,Decoy,0,-9.64904,-9.16,-1.46,-8.248061624370314
N#C/C(=C\c1cc(O)c(O)c(O)c1)C(=O)NCCCCCNC(=O)/C(C#N)=C/c1cc(O)c(O)c(O)c1,C05538361_decoy,TRY1,Decoy,0,-10.0953,-7.0,-5.03,-7.695353996516012
O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12,C03973253_decoy,TRY1,Decoy,0,-8.79076,-9.48,-2.46,-7.984367799441628
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@]1(C)O)[C@@]2(C)O,C38197911_decoy,TRY1,Decoy,0,-7.38511,-7.22,-2.65,-5.967219668881797
N#C/C(=C\c1ccc(/C=C(\C#N)c2nn(CCO)c(N)c2C#N)cc1)c1nn(CCO)c(N)c1C#N,C08442622_decoy,TRY1,Decoy,0,-8.34857,-7.05,-3.27,-7.2769813920731155
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@@]1(C)O)[C@]2(C)O,C39210322_decoy,TRY1,Decoy,0,-8.88905,-6.06,-3.83,-5.552604458388565
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCN1C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@]1(C)O)[C@]2(C)O,C12402173_decoy,TRY1,Decoy,0,-7.80438,-6.58,-2.38,-5.974224954088795
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@H](OCCCCC3CCCCC3)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43193644_decoy,TRY1,Decoy,0,-8.20991,-5.4,-2.84,-5.450575048392472
C[C@@H]1O[C@@H](Nc2ccc(-c3ccc(N[C@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]4O)cc3)cc2)[C@@H](O)[C@@H](O)[C@H]1O,C03995729_decoy,TRY1,Decoy,0,-6.02301,-6.91,-2.62,-4.479410743846966
C[C@@H]1O[C@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O,C43465458_decoy,TRY1,Decoy,0,-8.06641,-9.65,-1.9,-7.878603247655996
CC(=O)OC[C@@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O,C43465462_decoy,TRY1,Decoy,0,-9.88421,-8.47,-3.22,-8.561365972068337
O=c1c(O)c(-c2ccc(O[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)c2)oc2cc(O)cc(O)c12,C43465468_decoy,TRY1,Decoy,0,-8.18526,-7.54,-3.07,-5.618376393519517
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(OC)c1O,C43465469_decoy,TRY1,Decoy,0,-7.7256,-8.49,-2.66,-8.099672743760776
O=C(OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]12)c1ccc(O)cc1,C44166808_decoy,TRY1,Decoy,0,-8.96426,-8.25,-1.54,-7.8345864588397935
N#Cc1c(N)nc(S[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)c(C#N)c1-c1ccc(Br)cc1,C49070893_decoy,TRY1,Decoy,0,-6.43078,-5.95,-1.47,-4.348097084160266
COc1c(-c2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O)cc(O)c2c1=O,C49601560_decoy,TRY1,Decoy,0,-8.90816,-10.21,-1.2,-9.05502910391793
Cc1occc1-c1nc(N)c(OC[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)cc1-c1cc2c(C)n[nH]c2cn1,C52569918_decoy,TRY1,Decoy,0,-9.28495,-8.17,-2.85,-6.744182721830624
Nc1[nH]c(=S)[nH]c(=O)c1/N=N/c1c(Br)cc(S(N)(=O)=O)cc1Br,C13099280_decoy2,TRY1,Decoy,0,-8.21116,-5.2,,-4.476966517650734
CN(C)c1cc(N)c([O-])c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)/C(=C(/N)O)C(=O)[C@@]3(O)C(=O)[C@@H]1C2=O,C38339105_decoy,TRY1,Decoy,0,-7.79116,-7.58,-3.47,-6.660796796156181
CCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)n(CCC)c1=O,C04085428_decoy,TRY1,Decoy,0,-7.09144,-6.85,-2.24,-8.978780949407291
CC[C@@H](C)n1c(O)c([C@H]2c3[nH]c4ccccc4c3CC[NH+]2CC)c(=O)[nH]c1=O,C04090372_decoy,TRY1,Decoy,0,-6.96043,-5.36,-0.95,-4.6922870543909445
CCOc1ccc(-n2c(O)nc(O)c([C@@H]3[NH2+]CCc4ccccc43)c2=O)cc1,C08739251_decoy,TRY1,Decoy,0,-8.35269,-6.4,-0.39,-5.342615055952924
O=C(C[NH+]1CCC(c2c[nH]c3ccccc23)CC1)NC(=O)NCc1ccco1,C10140254_decoy,TRY1,Decoy,0,-7.0031,-7.88,-1.2,-5.897071769947334
Cc1ccc(-n2cc(C[NH2+]Cc3n[nH]c(=O)[nH]3)c(-c3ccc(F)cc3)n2)cc1,C12590882_decoy,TRY1,Decoy,0,-6.05363,-8.38,-3.11,-6.635617553252065
C/C=C1\C[NH+]2CC[C@H]1C[C@@H]2[C@@H](O)c1ccnc2ccc(OC[C@H](O)CO)cc12,C16968776_decoy,TRY1,Decoy,0,-7.50433,-6.17,-2.61,-5.164810298477808
CC[NH+](C)[C@@H]1c2ccccc2C2(CCN(c3ccc(C(N)=O)cn3)CC2)[C@H]1O,C23380261_decoy,TRY1,Decoy,0,-8.00882,-5.93,-4.66,-5.420977283338697
Cc1ccc(NC(=O)NC(=O)[C@H](C)[NH+]2CCN(c3ccc(O)cc3)CC2)cc1,C24239012_decoy,TRY1,Decoy,0,-7.0071,-8.3,-2.67,-8.801894778199006
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)no1,C29787368_decoy,TRY1,Decoy,0,-7.89925,-5.39,-1.09,-5.393909590055339
CC(C)Cn1c(N)c(C(=O)C[NH+](C)Cc2ccccc2Cl)c(=O)[nH]c1=O,C28935249_decoy,TRY1,Decoy,0,-7.21788,-6.55,-2.59,-5.724067911360228
C[C@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)CC(=O)Nc1sccc1C#N,C32542289_decoy,TRY1,Decoy,0,-9.06016,-6.61,-2.44,-8.674012509763626
CCC(=O)N[C@H](CCSC)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C24986677_decoy1,TRY1,Decoy,0,-9.7077,-4.08,,-5.365732275416232
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12,C08739212_decoy,TRY1,Decoy,0,-6.36296,-6.42,-1.31,-5.024622185622387
C=CC[NH+]1[C@@H](c2ccncc2)NN[C@H]1SCc1cc(=O)[nH]c(SC)n1,C39470495_decoy,TRY1,Decoy,0,-8.09958,-5.75,-1.57,-5.161414995393172
O=C(NCc1cc2ccccc2[nH]1)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39671519_decoy,TRY1,Decoy,0,-9.40229,-6.58,-1.27,-6.382265516266467
Nc1c(NCc2ccc(F)cc2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40799248_decoy,TRY1,Decoy,0,-7.18366,-5.9,-0.45,-4.782457823067135
Nc1c(NCCCn2cc[nH+]c2)ncnc1Sc1cccc2cccnc12,C40801557_decoy,TRY1,Decoy,0,-5.70619,-7.41,-1.52,-4.599368348980172
C[C@@]1(NNC(=O)NC[C@@H](c2ccccc2)[NH+]2CCCC2)CCS(=O)(=O)C1,C42814006_decoy,TRY1,Decoy,0,-8.85442,-6.74,-1.56,-6.267135002090739
C[C@@]1(NNC(=O)NC[C@H](c2ccccc2)[NH+]2CCCC2)CCS(=O)(=O)C1,C42814015_decoy,TRY1,Decoy,0,-7.44643,-5.82,-2.58,-4.834873940509484
[NH3+][C@@H](Cc1ccccc1)c1nc(-c2nnc(Nc3ccc(Cl)cc3)o2)co1,C44163168_decoy,TRY1,Decoy,0,-9.31428,-8.51,-0.78,-7.493337752582223
O=C(NCc1cc2ccccc2[nH]1)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C44713575_decoy,TRY1,Decoy,0,-8.55289,-6.22,-1.63,-5.245306654548555
C[C@@]1(NNC(=O)NCc2ccccc2C[NH+]2CCCC2)CCS(=O)(=O)C1,C45192072_decoy,TRY1,Decoy,0,-7.92013,-6.32,-2.33,-5.720359982711698
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C,C45819302_decoy,TRY1,Decoy,0,-7.98275,-6.06,-2.21,-5.94353311825783
C[C@@]1(NNC(=O)NCCC[NH+]2CCc3ccccc3C2)CCS(=O)(=O)C1,C46428703_decoy,TRY1,Decoy,0,-8.17142,-7.46,-2.72,-5.978364299671102
Cc1[nH+]ccn1CCCNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1,C47729287_decoy,TRY1,Decoy,0,-8.62679,-7.47,-2.98,-7.735951323317503
Cc1ccc(C(=O)NC2CC[NH+]([C@@H](C)C(=O)NC(=O)NC(C)C)CC2)s1,C51098669_decoy,TRY1,Decoy,0,-7.7858,-6.85,-2.97,-6.80592822507663
Cc1nc2sc([C@H](c3cccc(Br)c3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C09517407_decoy,TRY1,Decoy,0,-8.35949,-5.16,-2.15,-5.205698624916704
CC(C)NC(=O)C[NH+](C)[C@@H](C)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C38372373_decoy,TRY1,Decoy,0,-8.41303,-6.46,-3.39,-6.115661544308872
C[NH+](C)C1(CNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2F)CCCC1,C60499699_decoy,TRY1,Decoy,0,-9.83238,-6.5,-1.34,-7.053639325699457
C[C@@H]1CN(c2ccc(NC(=O)NC[C@@H](O)c3ccccc3F)c[nH+]2)C[C@H](C)O1,C61473563_decoy,TRY1,Decoy,0,-8.27984,-7.29,-0.33,-5.659889336150813
Cc1cc(C)c(CNC(=O)NCC2([NH+]3CCSCC3)CCCC2)c(=O)[nH]1,C61551979_decoy,TRY1,Decoy,0,-9.21673,-5.84,-1.77,-5.987476467121806
COc1cccc2c1=C[C@@H](C(=O)NCC(=O)N[C@@H]1Nc3ccccc3S1)[NH+]=2,C63294302_decoy,TRY1,Decoy,0,-7.25012,-7.27,-1.6,-5.961392136139522
COc1cccc2c1=C[C@H](C(=O)NCC(=O)N[C@@H]1Nc3ccccc3S1)[NH+]=2,C63294304_decoy,TRY1,Decoy,0,-7.89967,-7.49,-1.62,-5.600036666631277
COc1ccc(CCNC(=O)[C@@H]2N[C@@H](CC3=c4ccccc4=[NH+]C3)NO2)cc1,C63303025_decoy,TRY1,Decoy,0,-7.79337,-7.6,-2.23,-5.990350461171405
CCN1c2ccc(C(=O)NNC(=O)CC3=c4ccccc4=[NH+]C3)cc2N[C@H]1C,C63786983_decoy,TRY1,Decoy,0,-8.81311,-8.03,-1.75,-6.192518314848365
CC1=C(C(=O)Nc2ccc(NC(=O)CC3=c4ccccc4=[NH+]C3)cc2)CNO1,C64117355_decoy,TRY1,Decoy,0,-7.83812,-7.7,-2.74,-5.754790324116539
CCC(=O)N[C@H](CCSC)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C24986677_decoy2,TRY1,Decoy,0,-9.83953,-5.19,,-5.9608738043334375
O=C(/C=C1/CS[C@@H](Nc2ncccn2)N1)NCCC1=c2ccccc2=[NH+]C1,C64423243_decoy,TRY1,Decoy,0,-7.29397,-7.86,-2.43,-6.287035411434063
C[C@@H](NC(=O)Cc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C25077129_decoy,TRY1,Decoy,0,-8.96517,-6.43,-1.35,-5.5502107917538845
CSC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N[C@@H]1C[C@@H](CO)[NH+](C)C1)(C3)C2,C65387181_decoy,TRY1,Decoy,0,-8.70926,-4.95,-0.74,-5.810709190182413
O=C1NCCCC[C@@H]1NC(=O)C1(Oc2ccc3ncccc3c2)CC[NH2+]CC1,C65496021_decoy,TRY1,Decoy,0,-7.49317,-7.99,-0.64,-7.574120094882694
Cc1ccccc1[C@H]1NO[C@H](C[NH+]2CC=C(n3c(=O)[nH]c4ccccc43)CC2)N1,C65534899_decoy,TRY1,Decoy,0,-8.20055,-8.36,-2.33,-6.309058992917453
CCNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66390711_decoy,TRY1,Decoy,0,-7.93198,-7.44,-1.33,-6.280189785206494
COc1ccc(C2(C[NH2+][C@H](C)C(=O)NC(=O)NC(C)C)CCOCC2)cc1,C66392841_decoy,TRY1,Decoy,0,-7.6105,-6.68,-0.89,-6.510497787674489
NC(=O)C[NH+]1CCC[C@H](NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1,C66449404_decoy,TRY1,Decoy,0,-8.88105,-7.77,-4.55,-6.509647687786371
COc1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c2cccnc12,C67315993_decoy,TRY1,Decoy,0,-8.44159,-7.12,-1.06,-5.655556228539676
CCC(=O)N[C@@H](CCSC)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C20573284_decoy,TRY1,Decoy,0,-9.78985,-4.83,-1.49,-5.698907678709566
Cc1ccsc1C(=O)NNC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C67381560_decoy,TRY1,Decoy,0,-7.38875,-5.51,-2.97,-5.512912576416983
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)C1,C67393496_decoy,TRY1,Decoy,0,-9.92013,-6.7,-1.26,-6.721796728485979
CN(C)c1nc(N)nc(C[NH+]2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)n1,C67401216_decoy,TRY1,Decoy,0,-8.67176,-5.74,-1.66,-5.887266210075292
COCc1n[nH]c2c1C1(CC[NH+](Cc3ccccc3)CC1)C(C#N)=C(N)O2,C05130502_decoy,TRY1,Decoy,0,-5.65752,-6.57,-2.32,-3.975482500908925
[NH3+][C@H]1CCCC[C@@H]1/N=C/[C@@H]1C(=O)N=C(O)N(Cc2ccc(F)cc2)C1=O,C06448191_decoy,TRY1,Decoy,0,-7.79436,-7.59,-2.29,-8.03486649549898
Cc1cc(C[NH2+]C[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)[nH]n1,C11935360_decoy,TRY1,Decoy,0,-7.92433,-7.32,-2.96,-6.692714854833568
O=C1C(=O)N(CC[NH2+]CCO)[C@@H](c2cccnc2)/C1=C(/O)c1ccccc1,C06445924_decoy,TRY1,Decoy,0,-7.75294,-5.53,-1.39,-5.470656948994972
CCC[NH+]1CCc2c(sc(NC(=O)c3ccnn3CC)c2C(N)=O)C1,C13698707_decoy,TRY1,Decoy,0,-8.10862,-4.58,-3.55,-5.066201765573681
CCn1nc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](CC)C3)cc1C,C13702972_decoy,TRY1,Decoy,0,-7.95377,-6.16,-1.69,-5.379560459139147
O=C(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1[NH+]1CCc2ccccc2C1)c1ccco1,C20465212_decoy,TRY1,Decoy,0,-6.16329,-6.88,-0.95,-5.204324905628291
COC(=O)c1c(NC(=O)[C@H](C)[NH+]2CCC(C(N)=O)CC2)sc(C)c1C,C25524782_decoy,TRY1,Decoy,0,-8.29583,-4.36,-1.31,-5.094058905672465
Nc1c(C(=O)C[NH+]2CCC[C@@H](C(F)(F)F)C2)c(=O)[nH]c(=O)n1C1CC1,C27350493_decoy,TRY1,Decoy,0,-7.47747,-6.93,-0.59,-10.51979495129832
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39683818_decoy,TRY1,Decoy,0,-8.99096,-6.04,-1.38,-5.815219978769364
CC[NH+]1CCN(c2ccc(Cl)cc2NC(=O)C(=O)N[C@H](C)CO)CC1,C41382392_decoy,TRY1,Decoy,0,-7.88324,-4.98,-1.66,-5.357969030455159
C#Cc1cccc(NC(=O)C(=O)NC2CC[NH+](CC(=O)NCCC)CC2)c1,C41825826_decoy,TRY1,Decoy,0,-8.73918,-6.23,-1.83,-6.373437349967859
O=C(NCCCn1cc[nH+]c1)NNc1ncc(C(F)(F)F)cc1Cl,C42898213_decoy,TRY1,Decoy,0,-6.7096,-5.35,-1.83,-5.00668445992472
COC(=O)[C@H]([NH3+])Cc1cc(I)cc([N+](=O)[O-])c1O,C44335237_decoy,TRY1,Decoy,0,-8.12495,-5.61,-0.97,-5.51671796552395
C[NH+](CC(=O)Nc1cc(Cl)c(N)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1,C45565181_decoy,TRY1,Decoy,0,-8.47489,-5.8,-1.86,-5.924982513094176
C[C@H]1CCC[NH+]([C@@H](C)CNC(=O)NNC(=O)COc2ccccc2F)C1,C46368182_decoy,TRY1,Decoy,0,-8.1313,-6.55,-2.95,-5.873054520559555
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H](C)Cn3cc[nH+]c3)cc2C1,C47028946_decoy,TRY1,Decoy,0,-10.1124,-6.69,-2.73,-6.860949777558479
O=C(NCCCn1cc[nH+]c1)Nc1ccc(C(=O)NC2CC2)c(Cl)c1,C47588312_decoy,TRY1,Decoy,0,-6.98344,-5.44,-1.16,-4.213767136313176
O=C(NCCCn1cc[nH+]c1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1,C47727662_decoy,TRY1,Decoy,0,-7.33718,-5.34,-2.08,-5.0382672484951145
N#CCC[NH+]1CCC(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C49750117_decoy,TRY1,Decoy,0,-8.54478,-5.83,-2.36,-5.374366764091837
C[NH+](C)[C@H](CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cccc(F)c1,C49798232_decoy,TRY1,Decoy,0,-7.9969,-5.1,-3.11,-5.500437404340859
CC[NH+](CC)CCCNS(=O)(=O)c1cc(Br)cnc1N,C50640895_decoy,TRY1,Decoy,0,-7.92366,-5.02,-3.82,-5.407533114458749
C[C@@H](C(=O)NC(=O)NC1CCCCC1)[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51047578_decoy,TRY1,Decoy,0,-8.40035,-8.03,-3.44,-8.299552371217658
C[C@H]1CCC[C@](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)([NH+](C)C)C1,C52587706_decoy,TRY1,Decoy,0,-8.0763,-4.52,-2.26,-5.101325878888243
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNS(=O)(=O)c2cc(C(N)=O)n(C)c2)C1,C53688465_decoy,TRY1,Decoy,0,-7.37018,-6.19,-1.44,-5.7398369239758695
COc1cc(C(=O)N[C@@H]2CC[NH+](C3CC3)C2)cc(Cl)c1OCC(N)=O,C57553658_decoy,TRY1,Decoy,0,-8.96146,-5.24,-3.29,-5.437237782387599
C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C32810581_decoy,TRY1,Decoy,0,-5.46224,-7.32,-3.29,-4.7749170820879705
Cc1ccccc1OCC[NH+](C)[C@H](C)C(=O)Nc1sccc1C(N)=O,C58290474_decoy,TRY1,Decoy,0,-7.88737,-6.47,-1.78,-5.551200825843002
CCOc1ccc(C2(C[NH2+][C@@H](C)C(=O)NC(=O)NC)CCOCC2)cc1,C62241046_decoy,TRY1,Decoy,0,-7.30805,-5.96,-2.41,-5.543277183082103
CC(C)Cn1c(N)c(C(=O)C[NH+](C)[C@@H]2CCc3ccccc32)c(=O)[nH]c1=O,C63492129_decoy,TRY1,Decoy,0,-7.1889,-7.66,-2.16,-5.707116936475814
CCNC(=O)CNC(=O)C(=O)Nc1ccccc1C[NH+]1CCSCC1,C64269081_decoy,TRY1,Decoy,0,-7.35171,-6.63,-1.85,-5.837394394256857
COc1cc(C(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)cc(Cl)c1O,C64719815_decoy,TRY1,Decoy,0,-8.03927,-7.17,-0.45,-5.77015321660177
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc2c(F)cccc2s1,C64886581_decoy,TRY1,Decoy,0,-8.16382,-6.95,-2.63,-5.648452916382334
CC1CC[NH+](C[C@H](O)CSc2nnc(SCC(N)=O)s2)CC1,C65169725_decoy,TRY1,Decoy,0,-10.013,-4.2,-3.91,-5.376128548062551
O=c1[nH]cc(CC[NH+]2CN[C@H](c3ccccc3)[C@@H]2c2ccsc2)c(=O)[nH]1,C65394205_decoy,TRY1,Decoy,0,-7.88258,-7.95,-1.95,-7.252528641732161
Cc1ccc(OC2(C(=O)N3CCNC(=O)[C@@H]3CCO)CC[NH2+]CC2)cc1,C65526223_decoy,TRY1,Decoy,0,-6.45952,-6.12,-0.65,-5.149660866037528
C[C@H]1CCC[NH+]([C@@H](C)CNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)C1,C66240564_decoy,TRY1,Decoy,0,-7.88353,-7.74,-4.56,-6.442809228759464
C=CCNC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2cccc(F)c2)CCOCC1,C66390125_decoy,TRY1,Decoy,0,-8.58216,-6.76,-1.83,-8.398617973603947
C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CCOCC1)C(=O)NC(=O)NC1CC1,C66390425_decoy,TRY1,Decoy,0,-6.62641,-6.03,-2.14,-5.054765871794845
CCOc1ccc(C2(C[NH2+][C@H](C)C(=O)NC(=O)NC)CCOCC2)cc1,C66392101_decoy,TRY1,Decoy,0,-7.67997,-6.1,-1.73,-5.604532275039634
CCNC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2ccc(OC)cc2)CCOCC1,C66392920_decoy,TRY1,Decoy,0,-8.11811,-4.74,-2.01,-5.406942690797528
Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N[C@H]1CCC[NH+](CC(N)=O)C1,C66451668_decoy,TRY1,Decoy,0,-7.3098,-6.6,-1.48,-5.009151812698104
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C2CCC3(CC2)NC(=O)NC3=O)C1,C67269409_decoy,TRY1,Decoy,0,-7.65609,-7.16,-0.93,-5.388746426390893
C[C@@H]1CCC[C@](CNC(=O)C2CCC3(CC2)NC(=O)NC3=O)([NH+](C)C)C1,C67269554_decoy,TRY1,Decoy,0,-5.83878,-5.36,-0.69,-4.095544581139754
CC[NH+](C)Cc1cccc(CNC(=O)C2CCC3(CC2)NC(=O)NC3=O)c1,C67269609_decoy,TRY1,Decoy,0,-7.80405,-6.68,-1.24,-5.315522565533182
CCC[NH+]1CC[C@@H](CNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)C1,C67393603_decoy,TRY1,Decoy,0,-7.67348,-6.24,-2.66,-5.422344769743293
CNC(=O)c1n[nH]c2c1[C@H](c1ccc(C[NH+]3CCCCC3)s1)CC(=O)N2,C65381351_decoy,TRY1,Decoy,0,-7.36833,-7.36,-2.6,-5.48822669858815
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)NC[C@@H]1CC[NH+](C2CC2)C1,C67612130_decoy,TRY1,Decoy,0,-8.58832,-5.77,-1.4,-5.881138164670961
CC1CC[NH+](C[C@H](O)CNC(=O)NC2CCN(C(=O)C3CC3)CC2)CC1,C67614858_decoy,TRY1,Decoy,0,-8.09115,-6.79,-3.53,-5.561957973336813
CC1CC[NH+](C[C@@H](O)CNC(=O)NCc2ccccc2-n2cccn2)CC1,C67637021_decoy,TRY1,Decoy,0,-8.20641,-7.35,-1.27,-6.827719418392103
[NH3+][C@H]1CCCC[C@@H]1/N=C/[C@H]1C(=O)N(CCc2ccc(F)cc2)C(=O)N=C1O,C06448136_decoy,TRY1,Decoy,0,-8.28276,-7.11,-2.94,-5.493152016209995
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1,C08863785_decoy,TRY1,Decoy,0,-8.24692,-6.91,-3.43,-5.721961281536943
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3cccs3)C[NH+]12)NC1CC1,C15708307_decoy,TRY1,Decoy,0,-7.83247,-4.53,-1.2,-5.104672337733073
CCNC(=O)NC(=O)[C@H](C)[NH+](C)CC(=O)Nc1c(Cl)cccc1Cl,C16635760_decoy,TRY1,Decoy,0,-6.45862,-5.66,-1.86,-4.929529285210638
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)CC(=O)NC(C)(C)C)c(C)c1,C26885313_decoy,TRY1,Decoy,0,-6.69908,-6.69,-4.04,-5.443554540597392
CCCc1ccc([C@@H]([NH2+]CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)C(C)C)cc1,C28731095_decoy,TRY1,Decoy,0,-7.82876,-6.06,-3.46,-5.228619549151129
CN(C)c1ccc(Br)cc1NC(=O)[C@@H]([NH3+])CCS(C)(=O)=O,C37041950_decoy,TRY1,Decoy,0,-6.95333,-5.15,-2.19,-5.298265642646467
CC(C)Nc1scc(-c2cccs2)[n+]1/N=C/c1ccc(O)c(O)c1O,C37867336_decoy,TRY1,Decoy,0,-10.107,-5.29,-0.83,-5.9584188822484965
C[C@@H]1C(C[NH+]2CCC[C@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)=CNN1C,C39551739_decoy,TRY1,Decoy,0,-8.72016,-6.93,-1.13,-5.788983964553395
O=C(NCCOCCO)[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2,C39601930_decoy,TRY1,Decoy,0,-8.52854,-5.43,-4.01,-6.0806422588719045
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCCO)C3(CC[NH2+]CC3)C2)cc1F,C39605397_decoy,TRY1,Decoy,0,-6.87494,-7.63,-1.29,-5.469192722824193
CCCCCCC(=O)N1C[C@@H](C(=O)N[C@@H](C)C(=O)NC)C2(CC[NH2+]CC2)C1,C39683934_decoy,TRY1,Decoy,0,-8.90981,-5.87,-2.94,-6.518444611048319
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)C(=O)NC)C2(CC[NH2+]CC2)C1,C39683971_decoy,TRY1,Decoy,0,-7.3547,-4.34,-2.87,-4.885850547015749
CC(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685695_decoy,TRY1,Decoy,0,-8.25424,-5.72,-1.5,-5.924878524949854
CN(C)C(=[NH2+])c1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40425124_decoy,TRY1,Decoy,0,-7.75891,-5.79,-0.63,-4.685050186427785
C[C@@H](O)C[NH2+]Cc1ccc(OC[C@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C40743834_decoy,TRY1,Decoy,0,-7.68335,-7.26,-2.08,-5.940150644786322
CS(=O)(=O)NCCCNC(=O)NCC1([NH+]2CCSCC2)CCCC1,C41186126_decoy,TRY1,Decoy,0,-10.0794,-4.78,-1.56,-5.801200213671034
CNC(=O)Cc1ccccc1NC(=O)C(=O)NCC[NH+]1C[C@@H](C)C[C@H](C)C1,C41726294_decoy,TRY1,Decoy,0,-8.22493,-7.26,-1.26,-6.551001823508412
CCCNC(=O)C[NH+]1CCC(NC(=O)C(=O)Nc2ccc(C)c(F)c2)CC1,C41825915_decoy,TRY1,Decoy,0,-7.59303,-7.11,-1.47,-7.76601203075168
CCCNC(=O)C[NH+]1CCC(NC(=O)C(=O)Nc2ccc(F)cc2C)CC1,C41826016_decoy,TRY1,Decoy,0,-7.72182,-7.51,-1.41,-6.707647679946367
CC[NH+](CC)[C@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccccc1,C43230356_decoy,TRY1,Decoy,0,-7.13037,-5.79,-3.35,-5.432790879608771
C[C@H]([NH2+][C@H](C)c1cccc2ccccc12)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C43303478_decoy,TRY1,Decoy,0,-5.88695,-8.23,-3.42,-5.431063166847987
Cc1ccccc1CC(=O)N1C[C@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714315_decoy,TRY1,Decoy,0,-8.33975,-5.35,-2.49,-6.087734114854214
Cc1ccccc1CC(=O)N1C[C@@H](C(=O)N[C@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714318_decoy,TRY1,Decoy,0,-8.80007,-6.19,-2.18,-5.761190489182631
CC1CC[NH+]([C@@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)C(C)C)CC1,C46254700_decoy,TRY1,Decoy,0,-8.39209,-6.95,-1.35,-5.919650753099426
C[NH+](CCCNC(=O)NNC(=O)c1ccc2ccccc2n1)CC(F)(F)F,C46983322_decoy,TRY1,Decoy,0,-7.59569,-7.26,-1.47,-6.387303019643193
CC[NH+]1CCN(CCCCNC(=O)NNC(=O)c2ccc(Cl)cc2)CC1,C46757108_decoy,TRY1,Decoy,0,-9.22095,-6.53,-1.63,-6.7424281682401
CC[NH+]1CCN(Cc2ccc(NC(=O)NCC(=O)NCC(C)C)cc2)CC1,C50056167_decoy,TRY1,Decoy,0,-7.48273,-6.32,-2.06,-6.333936819905576
CC[NH+]1CCN(CCCCNC(=O)Nc2ccc(F)c(C(=O)NC)c2)CC1,C50088342_decoy,TRY1,Decoy,0,-8.1299,-6.51,-3.25,-5.664839322115938
N#Cc1cnc(SCC(=O)NC[C@H]2CC[NH+](CC(F)(F)F)C2)nc1N,C53549829_decoy,TRY1,Decoy,0,-7.79917,-6.88,-3.37,-8.011386432162935
C[NH+](C)[C@@H](CNC(=O)CNC(=O)NCc1ccco1)c1ccccc1Cl,C56144827_decoy,TRY1,Decoy,0,-7.80588,-6.54,-4.41,-5.855867924070051
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1ccsc1)[NH+](C)C,C56624813_decoy,TRY1,Decoy,0,-7.92456,-5.71,-1.81,-5.623330795910689
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1ccsc1)[NH+](C)C,C56624814_decoy,TRY1,Decoy,0,-7.66098,-5.9,-3.01,-5.142284003651978
N#Cc1cccnc1NCCNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C43231356_decoy,TRY1,Decoy,0,-8.6795,-4.93,-2.22,-5.954619581132933
O=C(CCNC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)NC1CCCCC1,C57179031_decoy,TRY1,Decoy,0,-8.38984,-6.44,-3.43,-6.757248663044237
CC(=O)N(C)c1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C62566525_decoy,TRY1,Decoy,0,-8.58054,-5.87,-2.3,-5.175924098696157
CCCC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H](C)[NH+]2CCCC2)c1C,C63204633_decoy,TRY1,Decoy,0,-8.10259,-5.71,-2.04,-6.331494537037523
Cc1ccc([C@H]2CCC[NH+]2CC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1,C63492472_decoy,TRY1,Decoy,0,-6.96969,-5.87,-2.05,-5.29885955831915
CC(C)Cn1c2c(c(=O)[nH]c1=O)C(C(F)(F)F)(C(F)(F)F)NC(O)=[NH+]2,C09287217_decoy,TRY1,Decoy,0,-6.28306,-6.23,-2.26,-5.114481283272361
NC(=O)C[NH+]1CCCN(C(=O)CCNC(=O)c2ccc(F)cc2Cl)CC1,C63759453_decoy,TRY1,Decoy,0,-8.18183,-5.54,-2.06,-5.440325828359836
CC(C)OC(=O)c1c(NC(=O)[C@H](C)[NH+](C)CC(N)=O)sc2c1CCCC2,C52831340_decoy,TRY1,Decoy,0,-8.66926,-6.45,-1.15,-6.280674963777177
Cc1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)sc2ccc(F)cc12,C64885763_decoy,TRY1,Decoy,0,-7.26615,-6.07,-1.2,-5.238077668884482
COCCN1C[C@H](CNc2nc(CC[NH3+])nc3sc(C)c(C)c23)CC1=O,C65380893_decoy,TRY1,Decoy,0,-9.32591,-6.47,-0.68,-8.518610520892873
COc1ccc([C@H]([NH3+])C[C@@H](O)Cc2cc(OC)c3c(c2OC)OCO3)cc1,C66091426_decoy,TRY1,Decoy,0,-7.54196,-6.96,-3.46,-6.049279045350724
COc1nc(C)ccc1CNC(=O)NC[C@H](O)C[NH+]1CCc2ccccc2C1,C66204221_decoy,TRY1,Decoy,0,-7.3539,-6.81,-1.89,-5.851570512682263
C=CCNC(=O)NC(=O)[C@H](C)[NH2+]CC1(c2ccc(OC)cc2)CCOCC1,C66392704_decoy,TRY1,Decoy,0,-7.8404,-6.62,-2.1,-5.759687774851452
C[NH+](C)[C@H](CNC(=O)NCc1n[nH]c(-c2cccs2)n1)c1cccs1,C66688561_decoy,TRY1,Decoy,0,-9.50377,-6.7,-2.22,-7.428428372438306
CN(C)c1ccc(CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)c[nH+]1,C67162386_decoy,TRY1,Decoy,0,-7.56712,-6.35,-1.41,-5.437310656859455
CN(C)c1cc(CNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)cc[nH+]1,C67162934_decoy,TRY1,Decoy,0,-7.91992,-6.75,-3.8,-5.527468949860257
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2cc(C(=O)NCC)ccc2C)C1,C67393686_decoy,TRY1,Decoy,0,-7.63471,-6.76,-4.36,-5.973687862519561
NNc1nc2n[nH]c(N)c2c2c1C[NH+](Cc1ccccc1)CC2,C05819206_decoy,TRY1,Decoy,0,-7.59345,-8.24,-0.06,-10.50938058159339
CCS(=O)(=O)c1ccc(N2C(=[NH2+])NC(=[NH2+])NC2(C)C)cc1,C08581552_decoy,TRY1,Decoy,0,-9.22946,-6.88,-1.29,-9.834020706591929
C[NH+](C)CCCOc1ccccc1[C@@H](C[NH3+])[NH+](C)CCO,C32053270_decoy,TRY1,Decoy,0,-7.45935,-4.08,-1.06,-5.165208327723354
C[NH+](C)CCCOc1ccccc1[C@H](C[NH3+])[NH+](C)CCO,C32053272_decoy,TRY1,Decoy,0,-7.69326,-4.06,-3.42,-5.248622826211304
CC(C)[NH+](Cc1ccccc1)[C@@H](C[NH3+])c1ccc(O)cc1O,C32066767_decoy,TRY1,Decoy,0,-5.42845,-7.31,-2.11,-6.284157302223593
[NH3+]CC(=O)Nc1ccc(NC23CC4CC(CC(C4)C2)C3)[nH+]c1,C31961553_decoy,TRY1,Decoy,0,-9.60517,-6.15,-2.9,-6.312519438472749
C[C@H]([NH3+])C(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37034034_decoy,TRY1,Decoy,0,-6.073,-4.56,-0.99,-3.953294633949021
CC[NH+]1CCC[C@H]1CNc1cc(N)cc(S(N)(=O)=O)c1,C37934066_decoy,TRY1,Decoy,0,-8.75555,-5.03,-2.47,-5.049108163460435
C[C@H](O)c1ccc(-c2ccc(C[NH2+]CC[NH2+]CCO)o2)cc1,C38246121_decoy,TRY1,Decoy,0,-9.18331,-6.23,-1.08,-8.078979620611161
C=CCNc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40708944_decoy,TRY1,Decoy,0,-7.39113,-5.43,-1.1,-4.9715978708838895
Cc1ccccc1Nc1[nH+]cnc(NNc2ccccc2)c1N,C40757444_decoy,TRY1,Decoy,0,-6.86699,-5.37,-0.71,-5.008518642141679
CC(C)C[C@H](CNC(=O)[C@H]([NH3+])CC(N)=O)N1CCOCC1,C40824739_decoy,TRY1,Decoy,0,-8.87581,-4.36,-2.0,-5.999338854220025
COC[C@H](O)C[NH+](C)C[C@H](O)COc1ccccc1C[NH3+],C42499321_decoy,TRY1,Decoy,0,-7.5118,-4.74,-2.1,-6.6062119653324345
CCCC[NH+](CC(N)=O)[C@H]1C[C@H](C(C)(C)C)CC[C@@H]1C[NH3+],C42690909_decoy,TRY1,Decoy,0,-7.38231,-5.14,-2.99,-5.781412835400167
CC(C)C[NH+](CC(N)=O)[C@@H]1C[C@H](C(C)(C)C)CC[C@@H]1C[NH3+],C42690961_decoy,TRY1,Decoy,0,-7.87553,-5.32,-2.55,-5.692519137233852
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(C)cc1,C42944049_decoy,TRY1,Decoy,0,-7.0273,-7.18,-0.98,-9.09752228585229
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(C)cc1,C42944051_decoy,TRY1,Decoy,0,-7.78134,-6.61,-1.56,-10.102527796006315
CC[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(C)cc1,C42944055_decoy,TRY1,Decoy,0,-8.09838,-6.81,-2.53,-8.153543855495117
C[C@@H]([NH3+])[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(CC(N)=O)CC1,C42946568_decoy,TRY1,Decoy,0,-7.68582,-4.07,-1.97,-4.612324940515447
C[C@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+]1CCC(CC(N)=O)CC1,C42946570_decoy,TRY1,Decoy,0,-7.20218,-5.75,-1.0,-5.30262120289968
C[C@@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+]1CCC(CC(N)=O)CC1,C42946573_decoy,TRY1,Decoy,0,-7.3704,-4.05,-0.97,-5.586411183153758
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)cc1,C42951493_decoy,TRY1,Decoy,0,-9.5169,-6.8,-1.17,-8.962113630892292
COc1ccc([C@H](Sc2nc(N)cc(=O)[nH]2)[C@@H](C)[NH3+])cc1,C42965246_decoy,TRY1,Decoy,0,-8.30071,-5.88,-1.74,-7.012838170011265
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(Cl)c1,C43019694_decoy,TRY1,Decoy,0,-8.13058,-7.0,-2.54,-7.669864131916388
CC[C@H]([NH3+])[C@H](c1ccccc1Cl)[NH+](CC(N)=O)C(C)C,C43052504_decoy,TRY1,Decoy,0,-6.70536,-4.47,-2.67,-4.959904157943681
COc1ccccc1[C@@H](Sc1nc(N)cc(N)n1)[C@@H](C)[NH3+],C43101977_decoy,TRY1,Decoy,0,-8.78301,-7.06,-1.47,-8.6789286587332
COc1ccccc1[C@H](Sc1nc(N)cc(=O)[nH]1)[C@@H](C)[NH3+],C43102001_decoy,TRY1,Decoy,0,-8.31219,-6.8,-0.6,-9.494411584315031
CCCC[NH+](CC(N)=O)[C@H](c1ccc(C)s1)[C@H]([NH3+])CC,C43243232_decoy,TRY1,Decoy,0,-7.37629,-5.59,-1.47,-8.19952078588827
CCCC[NH+](CC(N)=O)[C@H](c1sccc1C)[C@H]([NH3+])CC,C43248997_decoy,TRY1,Decoy,0,-7.04668,-4.04,-2.56,-5.490963610144557
Nc1c(Br)cc(Br)cc1[C@H]([NH3+])CCO,C44233349_decoy,TRY1,Decoy,0,-8.11312,-3.82,-1.93,-4.614833085837447
Nc1c(Br)cc(Br)cc1[C@@H]([NH3+])CCO,C44233353_decoy,TRY1,Decoy,0,-9.13686,-5.35,-0.84,-5.151721674726848
CC[C@H]([NH3+])Cc1ccc(-c2ccc(C[C@@H]([NH3+])CC)cn2)nc1,C44402333_decoy,TRY1,Decoy,0,-10.842,-6.63,-1.49,-13.244263429480108
CCCC[C@H](CC)Cn1c2ccc(C[C@@H](C)[NH3+])cc2c2cc(C[C@@H](C)[NH3+])ccc21,C44461796_decoy,TRY1,Decoy,0,-10.5518,-7.01,-2.88,-9.162920195788104
C[NH+]1CCC[C@H](CNc2ccc(S(N)(=O)=O)cc2N)C1,C44535395_decoy,TRY1,Decoy,0,-7.51139,-5.08,-2.5,-4.404412405057902
C[NH+]1CCC[C@@H](CNc2ccc(S(N)(=O)=O)cc2N)C1,C44535397_decoy,TRY1,Decoy,0,-7.33328,-5.89,-0.59,-4.478056727518709
NC(=O)NNC(=O)NCC1([NH+]2CCSCC2)CCCC1,C47009001_decoy,TRY1,Decoy,0,-8.90683,-4.46,-1.27,-5.509817578337235
Nc1cc(S(N)(=O)=O)ccc1N[C@H]1CC[NH+]2CCCC[C@H]12,C49564188_decoy,TRY1,Decoy,0,-7.80655,-6.44,-3.63,-4.934062173309983
CCC[NH+](CC(=O)NC(N)=O)C1(C[NH3+])CCC(CC)CC1,C50089786_decoy,TRY1,Decoy,0,-6.55204,-5.77,-3.7,-7.222326861180074
C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(S(N)(=O)=O)cc1,C51694013_decoy,TRY1,Decoy,0,-8.38515,-5.72,-1.31,-5.888988138844009
CCCc1cc(=O)[nH]c(SCCC[C@@](C)([NH3+])C(N)=O)n1,C45581453_decoy,TRY1,Decoy,0,-9.30037,-5.47,-4.31,-5.810097628329277
CCCn1c(SCCCC[C@](C)([NH3+])C(N)=O)n[nH]c1=O,C61607993_decoy,TRY1,Decoy,0,-8.65721,-5.93,-2.85,-7.165168196091747
CCCn1c(SCCCC[C@@](C)([NH3+])C(N)=O)n[nH]c1=O,C61607994_decoy,TRY1,Decoy,0,-7.12878,-5.19,-2.09,-5.079051276632309
CC(C)n1c(SCCCC[C@@](C)([NH3+])C(N)=O)n[nH]c1=O,C61608146_decoy,TRY1,Decoy,0,-7.23865,-5.42,-3.2,-4.950571278428494
CC(C)[NH2+][C@@](C)(CCC[NH+](C)CC[NH+]1CCCC1)C(N)=O,C63053289_decoy,TRY1,Decoy,0,-7.7556,-5.28,-0.94,-5.551838648121952
C[NH+](CCC[C@@](C)([NH2+]C1CC1)C(N)=O)CC[NH+]1CCCC1,C63053291_decoy,TRY1,Decoy,0,-7.58498,-4.03,-1.27,-4.804674218644068
NS(=O)(=O)c1ccc(N[C@H]2CCC[C@@H]2[NH3+])c([N+](=O)[O-])c1,C63177614_decoy,TRY1,Decoy,0,-7.61711,-5.05,-2.44,-5.087262367862528
OC[C@@H]1O[C@@H]([NH2+]Cc2ccc(Cl)cc2)[C@H](O)[C@H](O)[C@@H]1O,C66087549_decoy,TRY1,Decoy,0,-7.42063,-4.95,-0.67,-4.837390387012828
OC[C@@H]1O[C@@H]([NH2+]Cc2ccc(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C66087553_decoy,TRY1,Decoy,0,-6.98785,-7.08,-1.12,-6.811629684495613
OC[C@@H]1O[C@@H]([NH2+]Cc2ccc(Cl)cc2)[C@@H](O)[C@@H](O)[C@@H]1O,C66087555_decoy,TRY1,Decoy,0,-5.39663,-5.81,-1.32,-4.315255313069486
CC1CC[NH+](C[C@@H](O)CSc2nc(N)cc(N)n2)CC1,C66481575_decoy,TRY1,Decoy,0,-8.66714,-5.0,-0.58,-5.272516823444977
N#CCn1cnc2scc(-c3ccc(F)cc3)c2c1=O,C00145949_decoy,TRY1,Decoy,0,-7.33093,-6.04,-0.24,-4.468915702444161
CC(C)(C)[C@H]1CN(C=O)[C@@H](C(C)(C)C)CN1C=O,C00332331_decoy,TRY1,Decoy,0,-4.25439,-5.11,-2.11,-4.17086261382541
O=C1c2cccc(Cl)c2C(=O)N1c1ccccn1,C00349172_decoy,TRY1,Decoy,0,-6.39938,-5.44,-0.42,-3.400562365595025
Cc1c(C#N)c2ncnc(Cl)c2n1-c1ccccc1,C00478657_decoy,TRY1,Decoy,0,-6.19953,-5.91,-2.29,-3.4962760213714428
Clc1ccc(-n2ncnc2-c2ccncc2)cc1,C00766474_decoy,TRY1,Decoy,0,-6.21463,-4.6,-0.46,-3.3687619815378054
O=C1c2cc([N+](=O)[O-])ccc2S[C@H]2C=CS[C@H]12,C01701394_decoy,TRY1,Decoy,0,-7.75847,-6.12,-2.88,-3.980260915829168
CC1(C)O[C@@H]2[C@@H](OC(C)(C)O[C@H]2CF)[C@H](CF)O1,C05048011_decoy,TRY1,Decoy,0,-5.10482,-3.87,-1.91,-2.9809809317767697
O=C1CS[C@H]([C@@H]2CC=CCC2)N1c1nncs1,C01610763_decoy,TRY1,Decoy,0,-7.90618,-4.11,-1.0,-4.112706913698943
O=C1[C@@H]2[C@H](C(=O)N1c1ccc(Cl)cn1)[C@H]1C=C[C@@H]2C1,C00472744_decoy,TRY1,Decoy,0,-6.35914,-5.53,-0.89,-3.539958473753863
Cc1ccc(-c2cc(C(F)F)n3ncnc3n2)s1,C02802739_decoy,TRY1,Decoy,0,-5.91741,-6.05,-0.95,-3.900307862037703
Cc1cc(N2C[C@H](C)O[C@@H](C)C2)nc(C(C)C)n1,C04087972_decoy,TRY1,Decoy,0,-6.93441,-5.85,-4.1,-5.374854150976976
CC(C)n1nnc2sc3c(c2c1=O)CCCC3,C01945004_decoy,TRY1,Decoy,0,-6.82374,-6.44,-0.36,-4.4489804449333565
COc1cc2cc(C#N)c(Cl)nc2cc1OC,C11985197_decoy,TRY1,Decoy,0,-7.11562,-5.44,-0.08,-7.802203620126031
CON(C)c1ncnc2sc3c(c12)CCCC3,C07978979_decoy,TRY1,Decoy,0,-7.54408,-5.6,-0.25,-5.069380059427481
O=c1/c(=C/C=C/c2ccccc2)sc2ncnn12,C13149284_decoy,TRY1,Decoy,0,-7.66369,-6.8,-0.52,-6.577240346302874
FC(F)(F)c1cnc2c(-c3ccccn3)onc2c1,C03134964_decoy,TRY1,Decoy,0,-5.49103,-6.01,-0.83,-3.916185316598624
C[C@@H]1C[C@@H](C)CN(C(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)C1,C13941705_decoy,TRY1,Decoy,0,-5.93844,-5.86,-1.54,-4.329348546174962
Cc1ccc2nc(N3CCOCC3)c(C#N)cc2c1,C19096757_decoy,TRY1,Decoy,0,-6.54361,-6.15,-0.96,-4.25356197117631
Cc1cnc(N2C(=O)[C@@H](C)S[C@H]2c2ccco2)s1,C19927639_decoy,TRY1,Decoy,0,-7.50054,-4.47,-1.92,-4.407238943804125
Cc1nn2c(-c3ccccc3Cl)nnc2s1,C19927756_decoy,TRY1,Decoy,0,-6.92702,-4.3,-1.53,-3.3197543012233
O=C(c1nc(Cl)ccc1Cl)N1CCOCC1,C19965722_decoy,TRY1,Decoy,0,-7.2735,-3.92,-2.99,-3.2922193211318214
ClCc1noc(-c2cncc(Br)c2)n1,C20481025_decoy,TRY1,Decoy,0,-6.89948,-4.55,-0.41,-5.093914928355244
c1csc(-c2nnc3sc(C4CCC4)nn23)c1,C32097245_decoy,TRY1,Decoy,0,-7.8546,-6.48,0.18,-8.336985057718193
C[C@H]1CN(c2nc3sccn3c2CCl)CCO1,C35429049_decoy,TRY1,Decoy,0,-7.9226,-3.7,-0.37,-3.746674488726992
C[C@@H]1CN(c2c(C#N)cnc3ccccc23)[C@H](C)CO1,C36913341_decoy,TRY1,Decoy,0,-6.57806,-5.48,-1.49,-3.54825996377195
Brc1nn2cc(-c3cccnc3)nc2s1,C36939199_decoy,TRY1,Decoy,0,-6.82301,-5.09,-0.2,-3.9251781398705288
Cc1cnn(-c2nc3ccccn3c2CCl)c1,C37677536_decoy,TRY1,Decoy,0,-5.80828,-4.91,-0.73,-3.147697285077489
CN(C(=O)c1cnn(C)c1)C12CC3CC(CC(C3)C1)C2,C04650760_decoy,TRY1,Decoy,0,-5.42443,-4.7,-2.95,-3.2786255254371683
Cc1sc2nc(-c3ccco3)oc(=O)c2c1C,C00284081_decoy,TRY1,Decoy,0,-6.57461,-4.81,-2.69,-3.111216539858312
O=C1N=C(c2ccncc2)N=C2S[C@H]3CCCCC3=C12,C38597150_decoy,TRY1,Decoy,0,-7.20331,-6.39,-1.76,-4.047769543290665
N#CC(C#N)=C1C=C2C=C(C(C#N)C#N)CC[C@@H]2CC1,C39440253_decoy,TRY1,Decoy,0,-6.83242,-6.99,-1.12,-5.3480083269465855
N#C[C@@H]1C(=O)N=C(c2ccco2)C=C1c1cccs1,C39577859_decoy,TRY1,Decoy,0,-7.03036,-6.12,-1.27,-4.681038367072223
CC[C@@](C)(C#N)N1C(=O)CC2(CCCCC2)C1=O,C40366070_decoy,TRY1,Decoy,0,-5.98036,-5.06,-0.71,-4.157899144330538
Cc1c(-c2ccccc2)nc2sc([C@H]3CCCO3)nn12,C40964016_decoy,TRY1,Decoy,0,-8.52515,-6.85,-1.27,-9.81316535858762
Cc1cc(Cn2ccc3c2CC(C)(C)CC3=O)no1,C41707243_decoy,TRY1,Decoy,0,-5.31405,-4.98,-0.89,-3.4416049559743787
Cn1ccnc1Sc1nc2c(cc1C#N)CCC2,C43407916_decoy,TRY1,Decoy,0,-7.04723,-4.03,-2.64,-3.582487001261266
CC[C@@H]1CO[C@H](C)CN1c1nc(C)cc(C)c1C#N,C48916346_decoy,TRY1,Decoy,0,-6.20824,-5.13,-1.09,-4.381270167377409
C[C@@]1(c2ccc3c(c2)OCCCO3)CCC(=O)O1,C49836129_decoy,TRY1,Decoy,0,-6.86587,-5.48,-0.68,-3.794898229523319
C[C@H]1CN(c2nc3c(cc2C#N)CCCC3)CCO1,C49957176_decoy,TRY1,Decoy,0,-7.30375,-5.99,-0.96,-4.271795536461901
C[C@@H]1[C@@H](C)CCCN1c1nc2sccn2c1C=O,C50565304_decoy,TRY1,Decoy,0,-7.13516,-5.1,-1.64,-4.194648638263407
Cc1cnn(Cc2nc(Cl)c3ccsc3n2)c1,C50840640_decoy,TRY1,Decoy,0,-6.8903,-6.68,-0.58,-5.907677240147223
Cn1c(=O)n(C)c2cc([C@H](Cl)c3ccco3)ccc21,C51392883_decoy,TRY1,Decoy,0,-6.48101,-6.4,-1.77,-4.019445910717937
Cc1cc(Sc2cc(Cl)nc(C)n2)n(C)n1,C52837840_decoy,TRY1,Decoy,0,-8.21643,-5.14,-2.58,-4.096135093321105
O=C1OCCOc2c1cnc1cc(C(F)(F)F)ccc21,C53994750_decoy,TRY1,Decoy,0,-6.29293,-5.93,-0.5,-3.627515786530527
CCn1nnc(-c2ccc(Br)cc2)n1,C57543132_decoy,TRY1,Decoy,0,-6.60882,-5.71,-0.82,-7.249694188062703
Cc1cc(C(F)F)c2c(n1)sc1c(=O)oc(C)nc12,C59607035_decoy,TRY1,Decoy,0,-7.60069,-5.26,-1.79,-4.036845839077197
Cc1nn(-c2ccc(C#N)cn2)c(C)c1Br,C50593157_decoy,TRY1,Decoy,0,-6.64423,-6.47,-0.54,-5.000769254408912
N#Cc1nnn(-c2ccccc2F)c1C(F)(F)F,C62237393_decoy,TRY1,Decoy,0,-5.47791,-6.62,-0.35,-6.079557026969468
O=C1c2ccncc2C(=O)N1c1ccc(F)cc1Cl,C15861614_decoy,TRY1,Decoy,0,-6.09067,-4.9,-0.01,-3.2543590677933043
N#Cc1ccc(N2CCO[C@H](C#N)C2)cc1C(F)(F)F,C67372318_decoy,TRY1,Decoy,0,-6.05777,-6.02,-1.53,-4.091082631985873
NS(=O)(=O)c1ccc(CC[NH2+]C[C@H](O)COCc2ccc3c(c2)OCO3)cc1,C03293475_decoy,TRY1,Decoy,0,-8.141,-7.24,-1.93,-6.869619617466984
Oc1ccc(-c2ccc(-c3cc(Nc4ccc(C[NH2+]C5CC5)cc4)n[nH]3)cc2)c(O)c1,C06718826_decoy,TRY1,Decoy,0,-9.26454,-7.7,-1.74,-6.007620633301905
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OC,C08253597_decoy,TRY1,Decoy,0,-7.80319,-6.43,-1.94,-6.027803635665989
CC(C)[C@H]([NH2+][C@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(C(C)(C)C)cc1,C11096405_decoy,TRY1,Decoy,0,-7.65714,-5.68,-2.29,-5.289898312897414
Cc1cc(Cl)c2c(c1)[C@]1([NH2+][C@H](CCC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12881985_decoy,TRY1,Decoy,0,-8.98818,-8.03,-1.4,-6.687248378096292
OCC(CO)(CO)[NH2+]C[C@@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21,C05616496_decoy,TRY1,Decoy,0,-8.97745,-5.34,-1.52,-5.731582606991777
C[NH+](C)CCCNC(=S)NNC(=O)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@@H](c1ccc(Cl)cc1)N2,C02793838_decoy,TRY1,Decoy,0,-9.53434,-7.39,-1.91,-6.408045042840462
COCCN1C(=O)[C@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C09058995_decoy,TRY1,Decoy,0,-9.26441,-8.76,-1.75,-10.0911275127106
CC(C)(C)NC(=O)COc1ccc(Br)cc1C[NH2+]CCNCCO,C20873258_decoy,TRY1,Decoy,0,-10.5871,-5.83,-1.89,-10.261640491257175
CCC[C@@H]1C[C@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C22055021_decoy,TRY1,Decoy,0,-7.94811,-5.3,-2.83,-5.309767186597935
C[C@]12CC[C@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@](CO)(CCCC[NH2+]CCc1ccccn1)[C@@H]2O,C36748734_decoy,TRY1,Decoy,0,-10.6639,-6.78,-3.59,-7.076075176563967
OC[C@@H]1O[C@@H](Oc2ccc([C@H]3[NH+]=NC=C3c3ccc4c(c3)OCCO4)c(O)c2)[C@H](O)[C@H](O)[C@@H]1O,C38549325_decoy,TRY1,Decoy,0,-6.38166,-9.03,-1.06,-6.177789323825492
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@H]1NN[C@H](SCc2c(Cl)cccc2Cl)O1,C38971586_decoy,TRY1,Decoy,0,-8.6594,-5.75,-2.49,-5.624911319881477
Oc1ccccc1-c1ccc([C@H](CNF)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533968_decoy,TRY1,Decoy,0,-8.19975,-5.82,-1.63,-5.253686002760741
Oc1ccccc1-c1ccc([C@H](CNCl)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533970_decoy,TRY1,Decoy,0,-8.56493,-5.79,-1.17,-5.429079532285488
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661698_decoy,TRY1,Decoy,0,-9.50479,-5.64,-1.61,-5.953455387300667
CC1=C(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)[C@@H](c2cc(C)on2)ON1,C39695818_decoy,TRY1,Decoy,0,-9.5616,-8.22,-3.02,-7.214729756337317
C[C@]12CC[C@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@](CO)(CCCCCC[NH2+]Cc1ccccn1)[C@@H]2O,C40538100_decoy,TRY1,Decoy,0,-11.5144,-6.71,-2.57,-7.258207419229521
C[C@]12CC[C@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@](CO)(CCCC[NH2+]Cc1ccccn1)[C@@H]2O,C40538182_decoy,TRY1,Decoy,0,-10.4639,-6.39,-3.79,-6.884801492968927
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccccn3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645233_decoy,TRY1,Decoy,0,-6.64256,-8.01,-1.73,-6.589509067298044
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc2c(c1)OCO2,C40684841_decoy,TRY1,Decoy,0,-8.83679,-7.77,-1.15,-5.817826287590568
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(Nc3cc[nH+]cc3)c2N)cc1,C40687570_decoy,TRY1,Decoy,0,-7.03778,-6.88,-1.34,-10.678683219673385
CCCCOc1ccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40754746_decoy,TRY1,Decoy,0,-8.16285,-6.11,-3.56,-5.214301795371413
COc1cc(OC)c(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc1Cl,C40756425_decoy,TRY1,Decoy,0,-8.68752,-5.79,-2.0,-5.446091724992304
Nc1c(NCc2ccc(Cl)cc2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40777823_decoy,TRY1,Decoy,0,-8.31386,-5.99,-1.52,-6.659985778238777
Nc1c(NCc2ccccc2Cl)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40778036_decoy,TRY1,Decoy,0,-7.40156,-5.82,-1.48,-5.303830314059365
Cc1ccc2c(Nc3ncnc(Nc4cccc(C(F)(F)F)c4)c3N)cccc2[nH+]1,C40782012_decoy,TRY1,Decoy,0,-8.24118,-8.89,-2.05,-11.325867995833422
Cc1ccc2c(Nc3ncnc(Nc4ccc(C(F)(F)F)cc4)c3N)cccc2[nH+]1,C40799980_decoy,TRY1,Decoy,0,-8.50492,-7.56,-1.41,-6.912875804307722
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(Oc2ccccc2)cc1,C40801477_decoy,TRY1,Decoy,0,-7.29722,-5.96,-2.44,-4.480958783570123
Cn1cccc1C[NH2+][C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@@]12CCC(=O)NCCc1c[nH]c2ccccc12,C43547771_decoy,TRY1,Decoy,0,-10.1299,-7.91,-3.16,-7.120983241868457
C[NH+](C)CCNC(=O)C[C@@H]1c2nc(NC(=O)C3CCC3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553537_decoy,TRY1,Decoy,0,-10.3817,-6.39,-3.09,-6.979198895769029
O[C@H](C[NH2+]C[C@H](O)[C@@H]1C[C@H](O)c2cc(F)ccc2O1)[C@H]1CCc2cc(F)ccc2O1,C44020792_decoy,TRY1,Decoy,0,-9.01604,-6.44,-2.56,-6.018986493271856
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C45028227_decoy,TRY1,Decoy,0,-7.42523,-4.85,-1.77,-5.1819210099981685
CCOc1ccc(Nc2c(C)c(NC3CCC([NH3+])CC3)c(C#N)c3ccnn23)cc1,C45253141_decoy,TRY1,Decoy,0,-9.11023,-7.56,-1.66,-6.319313340345839
CCOc1ccc(Nc2c(C)c(N[C@@H]3CCC[C@H]([NH3+])C3)c(C#N)c3ccnn23)cc1,C45254347_decoy,TRY1,Decoy,0,-8.96747,-7.37,-2.66,-7.662622883740037
CC(C)C[C@@H]([NH3+])C(=O)N/N=C/c1cc(Br)cc(Br)c1O,C06952281_decoy,TRY1,Decoy,0,-9.96032,-4.36,-0.26,-5.6904855482402175
CC(C)CNC(=O)c1ccccc1NC(=O)CNc1ccccc1[NH+]1CCC(O)CC1,C59806820_decoy,TRY1,Decoy,0,-8.79564,-7.29,-2.0,-7.496151335162722
CN(C)c1ccc([C@H](CNC(=O)C[C@@H](NC(N)=O)c2ccccc2F)C2=c3ccccc3=[NH+]C2)cc1,C63112130_decoy,TRY1,Decoy,0,-8.813,-8.29,-2.78,-9.510356400150176
O=C(C[C@@H]1CS[C@H](NC(=O)NC2CCCC2)N1)NCCC1=c2ccccc2=[NH+]C1,C63686715_decoy,TRY1,Decoy,0,-8.95779,-7.95,-4.16,-8.528350008310777
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C39996794_decoy,TRY1,Decoy,0,-8.90671,-8.21,-2.33,-12.786898093679763
O=C(Nc1ccc([C@@H]2C=CNN2)cc1)[C@H]1CCC[NH+](Cc2cc(C#CCO)cs2)C1,C39500636_decoy,TRY1,Decoy,0,-10.1547,-7.68,-1.78,-7.206830213031448
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1NNS[C@H]1NC(=O)N1CCCCC1,C65330195_decoy,TRY1,Decoy,0,-6.97913,-8.06,-1.38,-5.87154833925735
N[C@H]1C2=CC=C(c3ccccn3)N[C@@H]2S[C@H]1C(=O)NCCC1=c2ccccc2=[NH+]C1,C65546307_decoy,TRY1,Decoy,0,-10.2033,-7.56,-1.1,-6.325603106799721
CC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C65739439_decoy,TRY1,Decoy,0,-6.13133,-6.38,-3.29,-5.236910555716433
CCCCNC(=O)NC(=O)C[NH+](C)CC(=O)Nc1ccccc1Br,C06978424_decoy,TRY1,Decoy,0,-7.29501,-6.99,-2.4,-7.831210205903774
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCN(c2ncccn2)CC1,C08319822_decoy,TRY1,Decoy,0,-8.25457,-7.35,-2.6,-5.414424715658272
COc1ccc(/N=c2/nc(C[NH+]3CCN(c4ccc(F)cc4)CC3)nc(N)[nH]2)cc1,C01305382_decoy,TRY1,Decoy,0,-7.37343,-6.96,-1.01,-7.493338102954944
Cn1nc(C(=O)NCc2ccncc2)c2c1CC[C@H]([NH2+]CC1(O)CCCCC1)C2,C14733491_decoy,TRY1,Decoy,0,-7.68484,-7.25,-0.83,-7.348392036116617
Cc1c(C(N)=O)sc(NC(=O)C[NH+]2[C@H](C)CCC[C@H]2C)c1C(=O)OC(C)C,C17080894_decoy,TRY1,Decoy,0,-8.47974,-6.19,-1.83,-6.3830718935796735
Nc1nc(CN2CCN(c3cccc[nH+]3)CC2)nc(Nc2cccc(Cl)c2)n1,C19899259_decoy,TRY1,Decoy,0,-9.48275,-6.59,-1.1,-5.548223134333906
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3oc(C)c(C)c3C#N)sc2[nH+]1,C23077163_decoy,TRY1,Decoy,0,-7.92802,-6.53,-2.76,-5.043344830748081
CCOC(=O)c1c(NC(=O)[C@H](C)[NH+]2CCC(C(N)=O)CC2)sc(C)c1CC,C25524772_decoy,TRY1,Decoy,0,-8.21577,-6.65,-1.06,-7.108469259875293
CC(=O)[NH+]=c1ccc2c(COC(=O)c3ccccc3NCCO)cc(O)oc-2c1,C28939369_decoy,TRY1,Decoy,0,-7.6492,-5.42,-3.94,-4.917543607559168
C[C@H]1Oc2ccc(-c3nc4ccc(N)cn4c3C[NH+](C)CCO)cc2N(C)C1=O,C36273235_decoy,TRY1,Decoy,0,-7.04418,-7.69,-0.93,-10.767514293573589
COc1cccc([C@H]2C(C(N)=O)=C(C)[NH+]=C3N=C(c4cccs4)NN32)c1OC,C00940756_decoy,TRY1,Decoy,0,-6.88289,-5.74,-2.01,-4.24851029335626
Cc1c(C(N)=O)sc(NC(=O)C[NH+]2[C@H](C)CCC[C@@H]2C)c1C(=O)OC(C)C,C17080893_decoy,TRY1,Decoy,0,-8.73083,-6.32,-1.5,-6.107601864483796
COCCC(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632158_decoy,TRY1,Decoy,0,-9.90636,-6.11,-2.09,-7.418198825151514
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39674116_decoy,TRY1,Decoy,0,-8.20359,-8.07,-2.09,-6.353979618433926
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39674117_decoy,TRY1,Decoy,0,-8.01065,-6.16,-2.27,-5.847971443362537
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39683824_decoy,TRY1,Decoy,0,-7.79055,-6.82,-2.66,-6.204220953484895
Cc1ccc(NC(=O)NC(=O)[C@H](C)[NH+]2CCC(NS(C)(=O)=O)CC2)c(C)c1,C42632639_decoy,TRY1,Decoy,0,-7.49837,-6.69,-1.94,-5.763483727113395
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2ccc3c(c2)OC(F)(F)O3)CC1,C43851174_decoy,TRY1,Decoy,0,-6.94551,-6.2,-2.03,-4.96043904008832
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C44695571_decoy,TRY1,Decoy,0,-8.3629,-7.48,-3.29,-6.042043395111844
COc1ccc(Br)c(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714010_decoy,TRY1,Decoy,0,-8.11647,-6.34,-2.62,-6.601076361056164
COc1ccc(Br)c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714012_decoy,TRY1,Decoy,0,-8.81879,-5.92,-2.68,-6.191524683519716
COc1ccc(Br)c(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714014_decoy,TRY1,Decoy,0,-9.6496,-6.99,-1.92,-6.76207114179629
COc1ccc(Br)c(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714016_decoy,TRY1,Decoy,0,-8.21881,-7.37,-2.14,-6.226191034117798
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC2CC[NH+](C3CC3)CC2)cc1,C45410326_decoy,TRY1,Decoy,0,-7.89074,-5.06,-1.91,-4.821862065144976
O=C(C[C@H]([NH2+]CCCn1cc[nH+]c1)C(=O)[O-])Nc1ccccc1Br,C36342178_decoy,TRY1,Decoy,0,-5.77779,-6.76,-1.87,-6.182028719739295
Cc1csc(NC(=O)C2CC[NH+]([C@H](C)C(=O)NC(=O)NC(C)(C)C)CC2)n1,C47264170_decoy,TRY1,Decoy,0,-7.93753,-7.33,-1.55,-5.832803897678203
C[NH+](C)C1(CNC(=O)C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)CCCC1,C48752289_decoy,TRY1,Decoy,0,-9.56825,-7.02,-1.7,-5.874516482238641
Cc1ncsc1C(=O)NC1CC[NH+]([C@H](C)C(=O)NC(=O)NC(C)(C)C)CC1,C51099887_decoy,TRY1,Decoy,0,-8.79296,-4.29,-1.82,-5.1986567611251004
C[NH+](CC(=O)NC(=O)NCc1cccs1)CC(=O)Nc1ccccc1Cl,C15108577_decoy,TRY1,Decoy,0,-8.50805,-7.73,-3.2,-7.766355153446285
CCC[NH+](CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)[C@H]1CCc2ccccc2C1,C60039714_decoy,TRY1,Decoy,0,-8.56141,-7.86,-1.8,-6.256860964125748
N#Cc1cccnc1NCCNC(=O)Nc1ccccc1C[NH+]1CCSCC1,C61788071_decoy,TRY1,Decoy,0,-7.47699,-7.36,-2.45,-6.233318004533802
O=C(CNC(=O)c1ccncc1)NNC1=c2cc(Br)ccc2=[NH+]C1=O,C15885132_decoy,TRY1,Decoy,0,-8.47062,-7.57,-1.48,-6.692155887477481
O=C(Cc1ccc(F)cc1)NCCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C20621885_decoy,TRY1,Decoy,0,-8.94768,-6.79,-1.29,-5.805481610555529
COc1cccc([C@H](C[NH2+][C@H](CCO)C(=O)[O-])C2=c3ccccc3=[NH+]C2)c1OC,C63182459_decoy,TRY1,Decoy,0,-6.58345,-5.3,-1.89,-4.953783106856778
COc1ccc2c(c1)=[NH+][C@@H](C(=O)NCCC(=O)N[C@@H]1Nc3ccccc3S1)C=2,C63295814_decoy,TRY1,Decoy,0,-7.84004,-7.68,-2.51,-6.652129464564804
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1NN(c2ccccc2Cl)N=C1CO,C63515134_decoy,TRY1,Decoy,0,-9.0278,-5.56,-1.05,-6.607737735773512
COc1cccc2c1=C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H]1Nc3ccccc3S1)[NH+]=2,C63821469_decoy,TRY1,Decoy,0,-8.5513,-7.48,-1.89,-6.761346489361319
O=C(NCc1ncc[nH]1)C1CC[NH+](C2CCN([C@@H]3Nc4ccccc4O3)CC2)CC1,C64040655_decoy,TRY1,Decoy,0,-8.43969,-5.75,-1.63,-5.383007780653083
CNC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C64417255_decoy,TRY1,Decoy,0,-8.58902,-7.71,-3.21,-8.009493222099518
O=C(Cc1ccc(F)c(Br)c1)NNC(=O)NCCCn1cc[nH+]c1,C64885812_decoy,TRY1,Decoy,0,-7.97922,-6.64,-1.99,-5.5693878788420825
COCC/[NH+]=C1\Nc2ccccc2CN[C@@]12CCN(C(=O)NCc1ccco1)C2,C65265823_decoy,TRY1,Decoy,0,-8.47913,-5.44,-0.94,-5.132667328406
COc1ccc2[nH]cc(C3CC[NH+]([C@H](C)c4nc(N)nc(N(C)C)n4)CC3)c2c1,C66436608_decoy,TRY1,Decoy,0,-7.72075,-8.32,-2.02,-5.75139443337114
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1CCC[NH+](CC(N)=O)C1,C66449002_decoy,TRY1,Decoy,0,-7.93774,-5.55,-1.93,-5.08752261026476
C[C@@H](CNC(=O)NCc1nc(-c2cccs2)n[nH]1)[NH+]1CCc2ccccc2C1,C66700129_decoy,TRY1,Decoy,0,-9.04188,-7.02,-3.47,-6.037244328976289
O=C1NC(=O)C2(CCC(C(=O)NC3CC[NH+](CCc4ccncc4)CC3)CC2)N1,C67272897_decoy,TRY1,Decoy,0,-6.8561,-5.06,-0.76,-4.648952974750167
COc1ccc(C(=O)NCCC(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)cc1,C20573350_decoy,TRY1,Decoy,0,-8.27637,-6.23,-1.53,-5.661376740341351
O=S(=O)(NCC[NH2+]Cc1c[nH]nc1-c1cc2ccccc2o1)c1ccccc1,C67451224_decoy,TRY1,Decoy,0,-6.49477,-5.8,-2.43,-5.749833607935312
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67609673_decoy,TRY1,Decoy,0,-7.73458,-7.63,-2.3,-6.121292139506675
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67609673_decoy,TRY1,Decoy,0,-7.73458,-7.63,-2.06,-6.121292139506675
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)CC1,C67611432_decoy,TRY1,Decoy,0,-8.74412,-7.26,-2.62,-6.536433321822989
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCc2cc(F)cc3c2OCOC3)CC1,C67626931_decoy,TRY1,Decoy,0,-8.49813,-7.38,-1.55,-6.181885173040708
OCC[NH+](CCO)C[C@@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21,C00626541_decoy,TRY1,Decoy,0,-8.55811,-4.77,-2.01,-5.738592796952599
C[NH+]1CCN(C(=S)SCc2nc(N)nc(Nc3ccc(F)cc3)n2)CC1,C04145069_decoy,TRY1,Decoy,0,-6.94993,-6.51,-1.27,-6.462935644254908
NS(=O)(=O)c1ccc(C[NH2+][C@@H]2CC(=O)N(c3ccc(I)cc3)C2=O)cc1,C06188936_decoy,TRY1,Decoy,0,-10.0673,-6.41,-0.88,-5.723695616268605
COC(=O)c1c(NC(=O)C[NH+]2CCC(C(N)=O)CC2)sc2c1CC[C@H](C)C2,C07435315_decoy,TRY1,Decoy,0,-8.55415,-6.45,-1.65,-5.841801618741653
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)Cc1ccc(Cl)cc1Cl,C12852400_decoy,TRY1,Decoy,0,-7.74994,-7.24,-1.18,-7.932119545076484
Cc1c(C(N)=O)sc(NC(=O)C[NH+]2C[C@H](C)C[C@@H](C)C2)c1C(=O)OC(C)C,C17080898_decoy,TRY1,Decoy,0,-8.5344,-5.07,-3.12,-5.777335655293148
Cc1c(C(N)=O)sc(NC(=O)C[NH+]2C[C@H](C)C[C@H](C)C2)c1C(=O)OC(C)C,C17080900_decoy,TRY1,Decoy,0,-8.67672,-4.9,-1.14,-6.3114640452789335
O=S(=O)(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1[NH+]1CCc2ccccc2C1)c1ccc(F)cc1,C20465228_decoy,TRY1,Decoy,0,-6.6436,-6.67,-2.73,-6.052042116318266
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)Cc1ccc(F)cc1F,C22965024_decoy,TRY1,Decoy,0,-9.17325,-7.57,-3.18,-6.442122429674488
CCOC(=O)c1c(C2CC2)csc1NC(=O)[C@@H](C)[NH+]1CCC(C(N)=O)CC1,C25524787_decoy,TRY1,Decoy,0,-8.94323,-3.83,-2.07,-5.438771765439278
Nc1nn(CC(=O)c2cccc(Cl)c2Cl)c(=S)n1Nc1cc[nH+]cc1,C28535019_decoy,TRY1,Decoy,0,-6.7884,-4.77,-2.1,-4.764432218529207
Cc1ccc(NC(=O)Nc2ccc[nH+]c2N2CCC(C(=O)NC3CC3)CC2)cc1,C33175523_decoy,TRY1,Decoy,0,-9.13646,-7.2,-1.1,-6.177595071706373
CC[C@@H]([NH3+])C(=O)Nc1c(Br)cc(Br)cc1C(=O)OC,C37769922_decoy,TRY1,Decoy,0,-7.36641,-3.93,-1.0,-4.360648031021903
CCOc1ccc([C@H]2CN[C@H](NCc3c[nH]c4ccccc34)[NH+]2CCOC)cc1,C39159971_decoy,TRY1,Decoy,0,-7.70572,-6.94,-1.8,-6.979537748023691
CC1=C[C@@H](C)N(c2ccc(NC(=O)C3CC[NH+](Cc4cc(C)[nH]n4)CC3)cc2)N1,C39420686_decoy,TRY1,Decoy,0,-7.09318,-5.87,-1.81,-4.684252165201944
Cc1cccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c1,C39597549_decoy,TRY1,Decoy,0,-7.54125,-9.33,-1.11,-6.931039537685271
Cc1cccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c1,C39597551_decoy,TRY1,Decoy,0,-9.02365,-8.77,-2.19,-6.9104602924077785
O=C(NCCc1c[nH]c2ccccc12)[C@H]1CN(C(=O)c2cccc(Cl)c2)CC12CC[NH2+]CC2,C39597687_decoy,TRY1,Decoy,0,-8.97362,-6.81,-1.36,-5.98578454030804
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)C4CCOCC4)CC34CC[NH2+]CC4)c2c1,C39656236_decoy,TRY1,Decoy,0,-9.83524,-7.18,-0.94,-6.440632297384792
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4ccncc4)CC34CC[NH2+]CC4)c[nH]c12,C39684175_decoy,TRY1,Decoy,0,-8.98253,-8.63,-1.5,-7.321501255556354
CCC(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685776_decoy,TRY1,Decoy,0,-8.91531,-5.84,-1.71,-6.7214901525753215
CC(=O)Nc1cc(NC(=O)NCC2([NH+]3CCSCC3)CCCC2)ccc1F,C44015329_decoy,TRY1,Decoy,0,-11.098,-6.1,-2.33,-6.50604263914158
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713809_decoy,TRY1,Decoy,0,-8.0566,-8.27,-0.69,-8.203067112575328
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713811_decoy,TRY1,Decoy,0,-8.00206,-6.95,-1.03,-5.404196356979519
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713813_decoy,TRY1,Decoy,0,-9.44805,-5.67,-1.53,-6.675165626948452
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C44713815_decoy,TRY1,Decoy,0,-9.03432,-6.06,-2.41,-5.928256511429175
C[C@H]([NH2+][C@H](C)C(=O)NC(=O)NCc1cccs1)c1ccc(OC(F)F)cc1,C44803491_decoy,TRY1,Decoy,0,-7.14954,-6.81,-0.55,-5.910743111608224
Cc1ccc(S(N)(=O)=O)cc1C(=O)Nc1nc(C[NH+]2CCC[C@H](C)C2)cs1,C46669494_decoy,TRY1,Decoy,0,-9.15225,-5.54,-2.4,-5.154423903246146
C[NH+](CCCNC(=O)NNC(=O)Cc1cccc2ccccc12)CC(F)(F)F,C46982853_decoy,TRY1,Decoy,0,-6.67548,-7.13,-1.99,-5.6346074203459
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)Nc2ccc(C(=O)NC3CC3)c(Cl)c2)C1,C47589597_decoy,TRY1,Decoy,0,-8.61436,-5.98,-1.94,-5.325866900041578
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C48604985_decoy,TRY1,Decoy,0,-7.96293,-5.94,-3.51,-4.63853292777372
CC[NH+]1CCN(c2ccc(Cl)cc2NC(=O)NCC(=O)NCC(C)C)CC1,C50051040_decoy,TRY1,Decoy,0,-8.84132,-7.16,-3.75,-7.192214204148948
CNC(=O)c1cc(NC(=O)NCC2([NH+]3CCSCC3)CCCC2)ccc1F,C50087328_decoy,TRY1,Decoy,0,-9.16267,-6.51,-1.34,-6.130408157999285
COc1ccccc1[C@@H](CNC(=O)NNC(=O)c1ccccc1C)[NH+]1CCCC1,C54042301_decoy,TRY1,Decoy,0,-8.1447,-7.36,-1.95,-6.268250441435322
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1,C54805451_decoy,TRY1,Decoy,0,-7.17379,-6.5,-2.23,-5.171916299191378
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1,C56945869_decoy,TRY1,Decoy,0,-7.8206,-7.41,-4.72,-6.118442425471646
C[C@@H](CNC(=O)NNC(=O)CCSc1ccc(F)cc1)C[NH+]1CCCCC1,C57043262_decoy,TRY1,Decoy,0,-8.70746,-6.69,-2.23,-5.814868927567012
C=CCNC(=O)NC(=O)C[NH+](C)CC(=O)Nc1ccc(Br)cc1C,C23826557_decoy,TRY1,Decoy,0,-7.11525,-5.88,-3.38,-5.865445266392766
O=C(Nc1ccc(F)cc1)NC1CC[NH+](C[C@H](O)c2ccc3c(c2)OCO3)CC1,C58328440_decoy,TRY1,Decoy,0,-7.60503,-6.75,-2.38,-5.8745037542531
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCC[C@H](C2OCCO2)C1,C60363226_decoy,TRY1,Decoy,0,-8.9273,-6.93,-2.66,-6.013222827148717
CC(=O)Nc1cc(NC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)ccc1Cl,C63292747_decoy,TRY1,Decoy,0,-8.5451,-5.68,-3.13,-5.685477291764214
C[C@@H]1c2c(O)cc(O)cc2OC(=O)[C@@H]1CC(=O)NCCC1=c2ccccc2=[NH+]C1,C64137020_decoy,TRY1,Decoy,0,-7.97717,-8.94,-2.63,-5.80189768049179
C[C@H]1c2ccc(O)c(O)c2OC(=O)[C@H]1CC(=O)NCCC1=c2ccccc2=[NH+]C1,C64165834_decoy,TRY1,Decoy,0,-8.30039,-8.6,-2.68,-7.519376937324739
Cc1ccc([C@H](CNC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)[NH+](C)C)cc1,C65469029_decoy,TRY1,Decoy,0,-7.27176,-6.72,-2.3,-6.261904909973859
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)C1,C66240617_decoy,TRY1,Decoy,0,-9.36798,-7.55,-2.88,-6.481466918672028
CC(C)CNC(=O)NC(=O)[C@H](C)[NH2+]CC1(c2cccc(Cl)c2)CCOCC1,C66389335_decoy,TRY1,Decoy,0,-7.82631,-7.32,-1.99,-5.8325984285577
CC(=O)Nc1cc(NC(=O)NC[C@H](C(C)C)[NH+]2CCC(C)CC2)c(F)cc1F,C66980992_decoy,TRY1,Decoy,0,-8.05274,-5.84,-1.94,-5.229518048037713
OCC1CCN(c2ccc(C[NH2+]Cc3c[nH]nc3-c3ccc(F)cc3)cc2)CC1,C67247413_decoy,TRY1,Decoy,0,-8.04617,-8.02,-2.15,-7.884001290061477
CCCCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67400554_decoy,TRY1,Decoy,0,-8.57629,-7.44,-2.72,-6.381773142373041
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67400710_decoy,TRY1,Decoy,0,-8.56776,-7.14,-1.38,-6.459831907449631
Oc1c(C[NH+]2CCOCC2)cc(/N=N/c2ccccc2)c(O)c1C[NH+]1CCOCC1,C04991092_decoy,TRY1,Decoy,0,-8.33642,-7.58,-1.71,-7.261263020501629
C[NH+](C)CC(C)(C)C[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1,C03310791_decoy,TRY1,Decoy,0,-6.79983,-5.1,-1.76,-4.622083376742292
O[C@H](COc1ccc(C[NH2+]CCn2ccc3ccccc32)cc1)C[NH+]1CCCCC1,C11818505_decoy,TRY1,Decoy,0,-7.6984,-6.68,-1.11,-5.871179102556546
O[C@H](COc1cccc(C[NH2+]Cc2ccccc2)c1)C[NH+]1CCc2ccccc2C1,C11950823_decoy,TRY1,Decoy,0,-6.47191,-7.49,-1.12,-6.299242431636039
C[NH+](C[C@@H](O)COc1ccccc1C[NH2+]C1(c2ccccc2)CC1)C1CCCCC1,C11951729_decoy,TRY1,Decoy,0,-8.72218,-7.18,-0.46,-7.934512675567087
C[NH+](C[C@H](O)COc1ccccc1C[NH2+]C1(c2ccccc2)CC1)C1CCCCC1,C11951737_decoy,TRY1,Decoy,0,-7.67989,-7.72,-3.22,-8.035083285007216
Cc1ccc(C[NH2+]Cc2cccc(OC[C@@H](O)C[NH+]3CCc4ccccc4C3)c2)o1,C12053881_decoy,TRY1,Decoy,0,-7.97098,-5.79,-3.32,-5.333861276485068
O[C@@H](COc1ccccc1C[NH2+]CCc1ccc(Cl)cc1)C[NH+]1CCCCC1,C12195850_decoy,TRY1,Decoy,0,-8.5227,-6.29,-2.77,-6.62964901012784
COc1ccc(C[NH2+]CC2(C)COC2)c(OC[C@@H](O)C[NH+]2CCCCCCC2)c1,C12197723_decoy,TRY1,Decoy,0,-8.12395,-4.86,-1.43,-5.488330002890601
O[C@@H](COc1ccccc1C[NH2+]C(C1CC1)C1CC1)C[NH+]1CCc2ccccc2C1,C12387155_decoy,TRY1,Decoy,0,-8.77405,-5.7,-3.59,-5.679321505954118
O[C@H](COc1ccccc1C[NH2+]C(C1CC1)C1CC1)C[NH+]1CCc2ccccc2C1,C12387156_decoy,TRY1,Decoy,0,-8.72501,-7.28,-3.75,-6.51920162761014
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2ccc(OC)cc2)C[C@@]1(C)CO,C12581264_decoy,TRY1,Decoy,0,-7.9082,-4.79,-1.69,-4.730204940443563
O[C@@H](COc1cccc(C[NH2+]C(C2CC2)C2CC2)c1)C[NH+]1CCc2ccccc2C1,C12702260_decoy,TRY1,Decoy,0,-8.99697,-7.02,-2.1,-6.409953807662047
O[C@H](COc1cccc(C[NH2+]C(C2CC2)C2CC2)c1)C[NH+]1CCc2ccccc2C1,C12702264_decoy,TRY1,Decoy,0,-8.39439,-6.9,-2.73,-5.876177038535428
O[C@@H](COc1ccccc1C[NH2+]C12CC3CC(CC(C3)C1)C2)C[NH+]1CCSCC1,C12705397_decoy,TRY1,Decoy,0,-8.07535,-5.15,-4.29,-5.249797110870069
CSc1cccc(C[NH2+]Cc2ccc(OC[C@H](O)C[NH+]3CCCCC3)cc2)c1,C12710868_decoy,TRY1,Decoy,0,-9.41713,-6.58,-2.13,-5.6836354206264295
Cc1c[nH]c(C[NH+](C)Cc2cccc(OC[C@H](O)C[NH+](C)C3CCCCC3)c2)n1,C11819994_decoy,TRY1,Decoy,0,-7.67433,-6.38,-3.53,-5.300225431211308
O[C@H](COc1ccc(Cl)cc1C[NH2+]Cc1ccsc1)C[NH+]1CCCCCC1,C15069018_decoy,TRY1,Decoy,0,-7.93724,-7.21,-1.64,-8.515121943353561
C=CC[NH+](C)C[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=S)Nc1ccc(N(C)C)cc1,C08636191_decoy,TRY1,Decoy,0,-8.67066,-6.1,-3.16,-6.789013835741697
COc1ccc(C[NH2+]Cc2cccc(C)c2)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C20351731_decoy,TRY1,Decoy,0,-8.87011,-7.14,-1.25,-6.339917651339615
CCCOc1c(Br)cc(C[NH2+]CCN2CC[NH2+]CC2)cc1OCC,C20968598_decoy,TRY1,Decoy,0,-8.47297,-5.08,-2.24,-5.175757708831947
CC[NH+]1CCN(C[C@H](O)COc2cccc(C[NH2+]Cc3ccc(C)s3)c2)CC1,C22851335_decoy,TRY1,Decoy,0,-9.64903,-7.3,-4.55,-7.986625719168594
O[C@H]1CCCC[C@H]1[NH+]1CCC(CCCC2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)CC1,C28238036_decoy,TRY1,Decoy,0,-9.22706,-7.36,-3.28,-6.357580520641219
O[C@@H]1CCCC[C@@H]1[NH+]1CCC(CCCC2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)CC1,C28238029_decoy,TRY1,Decoy,0,-9.87377,-5.12,-2.94,-5.530860597510646
CCn1nc(C(=O)NC)c2c1CC[C@H]([NH2+]CC1([NH+]3CCCCC3)CCCCC1)C2,C32551014_decoy,TRY1,Decoy,0,-8.34459,-6.84,-2.08,-6.02897468572025
C[NH+]1CCN(C[C@@H](O)COc2ccc(C[NH2+]Cc3cccc(Cl)c3)cc2)CC1,C23374913_decoy,TRY1,Decoy,0,-8.80632,-6.33,-1.89,-5.977767473727148
CC1=C(CC[NH2+]Cc2cccc(OC[C@H](O)C[NH+]3CCCCCC3)c2)[C@@H](C)N=N1,C39558031_decoy,TRY1,Decoy,0,-8.29412,-6.51,-1.56,-5.552955950375249
CC1=C(CC[NH2+]Cc2cccc(OC[C@@H](O)C[NH+]3CCCCCC3)c2)[C@H](C)N=N1,C39558034_decoy,TRY1,Decoy,0,-7.65441,-7.01,-0.82,-5.590946761879014
CCCCCCC(=O)N1C[C@@H](C(=O)NC[C@@H]2CCC[NH+]2CC)C2(CC[NH2+]CC2)C1,C39695573_decoy,TRY1,Decoy,0,-10.1804,-6.36,-2.26,-7.435894809496261
COc1ccc([C@H](C[NH2+]C[C@H](O)COc2ccc(C#N)cc2)[NH+]2CCCCC2)cc1,C39936135_decoy,TRY1,Decoy,0,-9.44085,-7.34,-3.56,-7.201218924764076
C[NH+](C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccn3cc[nH+]c3c2)ncc1C(F)(F)F,C40379158_decoy,TRY1,Decoy,0,-7.54163,-7.51,-3.97,-7.703111466425148
C=CC[NH+](C)C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=S)Nc1ccc(N(C)C)cc1,C43526791_decoy,TRY1,Decoy,0,-8.5593,-6.4,-2.66,-5.93376136111297
O=C(NCC[NH+]1CCCCC1)[C@@H]1CSC[C@H](c2ccc(C(F)(F)F)cc2)[NH2+]1,C44166070_decoy,TRY1,Decoy,0,-7.64074,-7.01,-1.64,-5.615131325130533
Cc1c(Nc2ccc(C[NH2+]C[C@@H](c3ccco3)[NH+](C)C)cc2)c(=O)n(-c2ccccc2)n1C,C22925207_decoy,TRY1,Decoy,0,-7.68933,-7.45,-1.81,-5.722653980959479
COc1ccccc1C[NH+](C)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362079_decoy,TRY1,Decoy,0,-7.94566,-0.09,-2.58,-3.29796906309468
C[C@H](O)C[NH2+]CC[NH2+]Cc1c(OCc2ccccc2Cl)ccc2ccccc12,C22075225_decoy,TRY1,Decoy,0,-8.59883,-6.1,-2.22,-6.7247183433081785
C=CCNC(=S)N/N=C/c1ccc(OC)c(CSC2[NH+]=c3ccccc3=[NH+]2)c1,C63111163_decoy,TRY1,Decoy,0,-7.55364,-5.28,-3.39,-5.896335616079099
COC(=O)/C=C1/CS[C@H](NC(=O)C[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)N1,C63122462_decoy,TRY1,Decoy,0,-7.41024,-7.41,-2.72,-5.304091904633838
C[NH+](C)CCCNC(=O)CCCCCNC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2C1,C63271233_decoy,TRY1,Decoy,0,-8.87532,-6.74,-2.01,-6.3804975555380485
C[NH+](C)CCCNC(=O)CCCCCNC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2C1,C63271235_decoy,TRY1,Decoy,0,-9.13613,-5.69,-2.63,-5.510064299422799
Cc1cccc([C@@H]2NN[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2Cc2ccco2)c1,C63446111_decoy,TRY1,Decoy,0,-7.8214,-6.29,-2.17,-5.811684482086814
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](NCc4cccnc4)N3N2)[C@H](C)N=N1,C63494595_decoy,TRY1,Decoy,0,-8.78575,-6.46,-1.78,-5.590291396670315
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](NCc4ccc(C)cc4)N3N2)[C@@H](C)N=N1,C63494665_decoy,TRY1,Decoy,0,-9.03018,-8.04,-1.98,-8.056274334313658
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](NCc4ccc(C)cc4)N3N2)[C@@H](C)N=N1,C63494667_decoy,TRY1,Decoy,0,-8.37522,-8.55,-2.25,-8.613904640795612
O[C@H](C[NH2+]C[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1)COc1ccccc1F,C63806832_decoy,TRY1,Decoy,0,-8.52391,-7.42,-1.72,-6.376915795520701
O[C@H](C[NH2+]C[C@H](C1=c2ccccc2=[NH+]C1)c1ccccc1)COc1ccccc1F,C63806833_decoy,TRY1,Decoy,0,-8.27125,-8.35,-0.87,-8.578841668903381
O=C(C[NH+]1CCC[C@@H]1[C@@H]1Nc2ccccc2S1)NCCC1=c2ccccc2=[NH+]C1,C63830723_decoy,TRY1,Decoy,0,-8.20808,-6.21,-3.76,-4.899472560159066
COc1ccc2c(c1)S[C@H](NC(=O)CS[C@@H]1[NH+]=c3ccc(OC)cc3=[NH+]1)N2,C64062202_decoy,TRY1,Decoy,0,-8.46663,-8.17,-1.28,-6.715396553730598
Cc1cccc2c1=[NH+][C@@H](CCNC(=O)[C@@H]1C=C(COc3ccc(F)cc3F)ON1)[NH+]=2,C64084041_decoy,TRY1,Decoy,0,-6.83401,-8.01,-1.31,-6.324154704287104
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@H](SCc2c(Cl)cccc2Cl)O1,C64428649_decoy,TRY1,Decoy,0,-8.2231,-7.46,-2.48,-5.796185733399643
CCc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc[nH+]4)CC3)n2)cc1,C04740310_decoy,TRY1,Decoy,0,-7.06774,-7.98,-1.08,-5.19039821375336
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCCC[NH2+]CC[C@H](C)O)c2c1,C04748025_decoy,TRY1,Decoy,0,-8.24095,-5.42,-0.31,-5.339526734519406
Cc1cc(N2CC[NH+](C)CC2)[nH+]c2ccc(NC(=O)CCC(=O)NC(C)C)cc12,C04879544_decoy,TRY1,Decoy,0,-8.34268,-7.62,-2.51,-8.374929821534042
Cc1c[nH]c(C[NH+](C)Cc2cccc(OC[C@@H](O)C[NH+]3CCCCCC3)c2)n1,C11663256_decoy,TRY1,Decoy,0,-8.45564,-6.8,-2.87,-5.913295302769741
O[C@H](COc1ccc(C[NH2+]Cc2ccccc2Cl)cc1)C[NH+]1CCCCC1,C12074751_decoy,TRY1,Decoy,0,-8.15261,-7.15,-2.08,-5.6326309547723525
C[NH+](Cc1cccc(OC[C@H](O)C[NH+]2CCOCC2)c1)Cc1n[nH]c2c1CCCC2,C11936684_decoy,TRY1,Decoy,0,-8.26716,-7.76,-4.04,-5.894944300230344
O[C@@H](COc1cccc(C[NH2+]Cc2ccc(F)cc2F)c1)C[NH+]1CCOCC1,C12597327_decoy,TRY1,Decoy,0,-8.223,-7.09,-3.0,-6.174193429925332
O[C@H](COc1cccc(C[NH2+]C2CCOCC2)c1)C[NH+]1CCc2ccccc2C1,C14950927_decoy,TRY1,Decoy,0,-7.10775,-7.39,-1.84,-6.106777746019814
CN(C(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1ccccc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C14973310_decoy,TRY1,Decoy,0,-7.41773,-5.41,-1.81,-5.528061022073491
C[NH+]1[C@H](CO)C[C@H](C[NH2+]Cc2coc(-c3ccccc3)n2)[C@@H]1c1ccccc1F,C20451557_decoy,TRY1,Decoy,0,-7.47898,-7.21,-0.8,-7.580116116652432
CCCOc1c(Br)cc(C[NH2+]CCN2CC[NH2+]CC2)cc1OC,C20968601_decoy,TRY1,Decoy,0,-7.16694,-4.91,-2.95,-4.742030949207679
CC[C@@H](c1ccccc1)[NH+](C)Cc1ccc(-c2nc3c(c(=O)[nH]2)C[NH2+]CC3)cc1,C23429932_decoy,TRY1,Decoy,0,-8.89378,-6.6,-2.98,-8.077675746991694
CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1nc2sc(C)c(C)c2c(=O)[nH]1,C25702859_decoy,TRY1,Decoy,0,-7.87672,-6.47,-1.63,-5.466558122154808
Cc1cc2c(C)nc(N3CCC([NH2+]CC[NH+]4CCC[C@H](O)C4)CC3)nc2cc1F,C32519488_decoy,TRY1,Decoy,0,-9.82337,-8.18,-1.19,-6.0205518220733465
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630576_decoy,TRY1,Decoy,0,-8.2892,-6.18,-2.0,-5.872913286827877
CCC(CC)C(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630760_decoy,TRY1,Decoy,0,-8.62945,-5.0,-0.89,-5.581962312755238
N#CCc1ccc(OC[C@H](O)C[NH2+]CC2([NH+]3CCCCC3)CCCCC2)cc1,C39978415_decoy,TRY1,Decoy,0,-9.14605,-6.1,-2.18,-6.863144493020979
C[C@@H]1CN(c2ccc(NC(=O)NC[C@@H](c3ccco3)[NH+](C)C)c[nH+]2)C[C@@H](C)O1,C40121071_decoy,TRY1,Decoy,0,-7.48132,-6.7,-1.64,-5.303146738035177
C[NH+]1CCN(C[C@H](O)COc2ccc(C[NH2+]C3(c4ccccc4)CC3)cc2)CC1,C23358873_decoy,TRY1,Decoy,0,-7.59455,-6.89,-1.85,-5.646299563530096
C[NH+]1CCN(C[C@@H](O)COc2ccc(C[NH2+]C3(c4ccccc4)CC3)cc2)CC1,C23358870_decoy,TRY1,Decoy,0,-7.50439,-7.35,-1.78,-5.284632969641316
CC[NH+]1CCN(c2ccc(Cl)cc2NC(=O)NCCCn2cc[nH+]c2)CC1,C43454865_decoy,TRY1,Decoy,0,-7.82574,-6.97,-1.38,-7.40102495507393
CC(=O)Nc1ccc(C[NH2+]C[C@H]2C[C@H]3CC[NH+]2C[C@@H]3c2cc(-c3ccco3)nc(C)n2)cc1,C43528220_decoy,TRY1,Decoy,0,-7.23476,-7.73,-1.57,-5.898624308330684
Cc1nc(-c2ccccc2)cc([C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNCc2[nH]cc[nH+]2)n1,C43528229_decoy,TRY1,Decoy,0,-8.54787,-7.69,-1.48,-6.992974876922399
C[NH+]1CCN(c2ccccc2NC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1,C43800799_decoy,TRY1,Decoy,0,-7.42269,-5.84,-1.68,-5.778362319940063
C[C@H](CNC(=O)Nc1ccc[nH+]c1N1CCCC1)[NH+]1CCc2sccc2C1,C48172117_decoy,TRY1,Decoy,0,-9.30678,-7.36,-1.29,-7.3282479308514255
CC[C@@H](CNC(=O)Nc1ccc[nH+]c1N1CCCC1)[NH+]1CCc2ccccc2C1,C48237841_decoy,TRY1,Decoy,0,-8.50273,-7.42,-2.12,-8.697206454773708
CC[C@H](CNC(=O)Nc1ccc[nH+]c1N1CCCC1)[NH+]1CCc2ccccc2C1,C48237843_decoy,TRY1,Decoy,0,-7.63378,-7.09,-3.35,-5.8663712711261
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C[NH2+]C[C@@H](O)C[NH+]1CCCCC1,C48285671_decoy,TRY1,Decoy,0,-8.02376,-2.16,-1.99,-3.97925487144986
CC1(C)CC(NC(=O)C(=O)Nc2ccccc2C[NH+]2CCCC2)CC(C)(C)[NH2+]1,C48605235_decoy,TRY1,Decoy,0,-8.66068,-6.07,-2.06,-6.069876880940591
C[C@H](Cn1cc[nH+]c1)NC(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C49073913_decoy,TRY1,Decoy,0,-8.67795,-6.44,-2.59,-6.322916709340161
Cc1c(Nc2ccc(C[NH2+]C[C@H](c3ccco3)[NH+](C)C)cc2)c(=O)n(-c2ccccc2)n1C,C22925212_decoy,TRY1,Decoy,0,-7.22101,-5.46,-2.32,-4.86004616841321
CC(C)[NH+](C)Cc1ccccc1CNC(=O)Nc1ccc[nH+]c1N1CCOCC1,C54482878_decoy,TRY1,Decoy,0,-6.80609,-6.67,-1.45,-5.080778818048767
CC[NH+]1CCN(c2ccccc2NC(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC1,C43574965_decoy,TRY1,Decoy,0,-7.38768,-5.6,-3.25,-5.155092096445039
CC[NH+]1CCN(c2ccccc2NC(=O)NC[C@H](c2ccco2)[NH+](C)C)CC1,C43574966_decoy,TRY1,Decoy,0,-7.70346,-5.97,-1.12,-5.704157404998016
C[C@@H]1CN(c2ccc(NC(=O)NC3CC[NH+](CC(F)F)CC3)c[nH+]2)C[C@H](C)O1,C61768110_decoy,TRY1,Decoy,0,-7.42896,-7.23,-3.75,-5.353661871912551
COc1ccc2c(c1)=C(CC[NH2+]C[C@H]1C(=O)O[C@@H]3CC4=CCC[C@@H](C)[C@@]4(C)[C@H](O)[C@@H]31)C[NH+]=2,C63225286_decoy,TRY1,Decoy,0,-9.24907,-8.12,-3.53,-7.791681681090864
COc1ccc([C@H](CNc2n[nH+]c(C)c(=O)n2N)C2=c3ccccc3=[NH+]C2)cc1,C63230012_decoy,TRY1,Decoy,0,-7.80579,-6.18,-1.51,-5.408693512885852
CC1=CC(C)=N[C@@H]2[NH+]=C(CC(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)NN12,C63486241_decoy,TRY1,Decoy,0,-8.24299,-6.63,-2.62,-4.93794196482023
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@H](SCc2ccccc2Cl)O1,C63720242_decoy,TRY1,Decoy,0,-7.93108,-4.98,-0.78,-4.8921098477486735
Cc1ccc2cc(/C=N/NC(=O)[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c(Cl)nc2c1,C63805744_decoy,TRY1,Decoy,0,-8.54701,-7.0,-2.4,-5.634976943005852
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1)NC[C@H]1C=c2ccccc2=[NH+]1,C64131693_decoy,TRY1,Decoy,0,-6.87648,-9.31,-2.23,-7.170496816192347
O=C(NCC1([NH+]2CCSCC2)CCCC1)NC1CC[NH+](CC(F)F)CC1,C64255371_decoy,TRY1,Decoy,0,-9.70487,-6.6,-1.21,-6.032960260095294
COc1ccc2c(c1)=C(C)[C@@H](C[NH2+][C@H](C)C1=CNN(c3cccc(F)c3)[C@@H]1C)[NH+]=2,C64626107_decoy,TRY1,Decoy,0,-7.08183,-8.35,-2.62,-6.651224434522551
CC[C@@H](C)[NH+](C)CCNC(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66188151_decoy,TRY1,Decoy,0,-7.17967,-6.09,-1.34,-5.474389332826901
Cc1noc(C)c1COc1ccc(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)cc1,C67122098_decoy,TRY1,Decoy,0,-6.80576,-6.76,-2.07,-5.16759166388539
Cc1nn(Cc2ccccc2)c(Cl)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122397_decoy,TRY1,Decoy,0,-8.72901,-6.8,-2.77,-7.82121440010019
COC(=O)c1sc2ncc(C[NH2+]C[C@H](O)C[NH+]3CCC(C)CC3)cc2c1C,C67122414_decoy,TRY1,Decoy,0,-8.36462,-6.32,-2.62,-5.495138432727916
Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122459_decoy,TRY1,Decoy,0,-8.43608,-7.04,-4.25,-6.161212818623846
c1ccc(C[NH+]2CCCC2)c(C[NH2+]Cc2c[nH]nc2-c2cc3ccccc3o2)c1,C67185061_decoy,TRY1,Decoy,0,-7.23897,-5.92,-1.27,-5.354966414324082
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCC3([NH+](C)C)CCCCC3)c2C1,C67491197_decoy,TRY1,Decoy,0,-9.17148,-5.49,-2.99,-5.713925427633463
COc1cc2c(c(Oc3c(OC)cc4c(c3O)[C@H](CC(C)C)[NH+](C)CC4)c1O)[C@@H](CC(C)C)[NH+](C)CC2,C03847200_decoy,TRY1,Decoy,0,-8.26782,-0.49,-3.41,-3.169180596496184
CC(C)(CCCCC(C)(C)[NH2+]C[C@@H]1COc2ccccc2O1)[NH2+]C[C@@H]1COc2ccccc2O1,C01636962_decoy,TRY1,Decoy,0,-8.41677,-7.67,-2.49,-7.031114238279295
CC(C)(CCCCC(C)(C)[NH2+]C[C@H]1COc2ccccc2O1)[NH2+]C[C@@H]1COc2ccccc2O1,C01636960_decoy,TRY1,Decoy,0,-8.97692,-7.35,-3.42,-6.603566751698832
O=C(N[C@@H]([NH+]1CCCCC1)C(Cl)(Cl)Cl)N[C@@H]([NH+]1CCCCC1)C(Cl)(Cl)Cl,C02905260_decoy,TRY1,Decoy,0,-9.37843,-4.63,-2.08,-5.79331009119903
CCCCSC1(SCCCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccccc3)[NH2+]C(C)=C(C)[C@]12C#N,C08686658_decoy,TRY1,Decoy,0,-7.63718,-4.87,-1.76,-5.8237779325365215
C[C@@H]1CCc2c(sc3nc(CC[NH+]4CCCN(c5ccc(C(F)(F)F)c[nH+]5)CC4)nc(N)c23)C1,C08718763_decoy,TRY1,Decoy,0,-8.31913,-6.74,-0.82,-4.828904676368802
OCC[NH2+]CCC[NH2+]Cc1cc(Br)ccc1OCc1ccccc1Cl,C13732893_decoy,TRY1,Decoy,0,-6.9142,-5.99,-1.83,-6.36587465113504
CCCCSC1(SCCCC)[NH+]=C(N)[C@]2(C#N)[C@@H](c3ccccc3)[NH2+]C3=C(CCC3)[C@@]12C#N,C13801113_decoy,TRY1,Decoy,0,-7.56646,-4.58,-1.91,-4.926087114120182
C[C@H]([NH2+]CCCCCC[NH2+][C@@H](C)[C@@H]1COc2ccccc2O1)[C@@H]1COc2ccccc2O1,C16849771_decoy,TRY1,Decoy,0,-7.73456,-6.77,-2.99,-6.666785985571118
CC[NH+](CC)[C@@H](NC(=O)N[C@@H]([NH+](CC)CC)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,C03114922_decoy,TRY1,Decoy,0,-8.23524,-3.0,-2.19,-5.138620525609955
COc1ccc(OC[C@@H](O)C[NH2+]CC2([NH+]3CCCCC3)CCCCC2)c(C(C)(C)C)c1,C19365078_decoy,TRY1,Decoy,0,-9.28624,-6.75,-2.6,-6.0853804465846935
CC1(C)CC(NC(=S)N(Cc2ccccc2F)C2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C21264203_decoy,TRY1,Decoy,0,-9.13612,-6.35,-1.88,-6.569932814708637
CC[C@]1(C)Cc2c(c(N3CCOCC3)[nH+]c3sc4c(c23)NC=[NH+][C@@H]4NCc2ccccc2)CO1,C27345062_decoy,TRY1,Decoy,0,-9.18315,-6.53,-0.9,-6.572323342933768
C[C@@H]1NN(C)C=C1C[NH+](C)[C@@H](Cc1ccccc1F)C1CC[NH+](Cc2cc3ccccc3[nH]2)CC1,C39442817_decoy,TRY1,Decoy,0,-8.0561,-6.54,-4.1,-5.416357471853645
CC(C)Cc1ccc([C@H](CNc2ccccc2O)[NH+]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1,C39533303_decoy,TRY1,Decoy,0,-9.10302,-6.29,-2.34,-7.647965849649954
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39674820_decoy,TRY1,Decoy,0,-9.33444,-9.2,-2.79,-7.541651340583174
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39674821_decoy,TRY1,Decoy,0,-9.27939,-6.71,-3.03,-6.082695555695616
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39674822_decoy,TRY1,Decoy,0,-9.62151,-7.78,-2.83,-7.7479026632210175
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39674823_decoy,TRY1,Decoy,0,-9.3005,-8.25,-2.11,-7.602316679977772
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)c(C)c1,C39674828_decoy,TRY1,Decoy,0,-8.01594,-8.26,-3.42,-6.159828530018465
O[C@H](C[NH2+]CC1([NH+]2CCCCC2)CCCCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1,C39945626_decoy,TRY1,Decoy,0,-9.02117,-7.45,-2.44,-8.060618076642829
CCOc1cc(C[NH2+]CC2CC[NH2+]CC2)cc(Br)c1OCc1ccc(Cl)cc1Cl,C40719333_decoy,TRY1,Decoy,0,-9.72145,-5.55,-1.87,-5.695384182539699
CCOc1cc(C[NH2+]CC2CC[NH2+]CC2)cc(Cl)c1OCc1ccc(Cl)cc1Cl,C40719342_decoy,TRY1,Decoy,0,-8.8535,-5.65,-1.63,-6.023067164974782
Fc1cccc(Cl)c1COc1ccc(Br)cc1C[NH2+]CC1CC[NH2+]CC1,C40720406_decoy,TRY1,Decoy,0,-9.90882,-6.99,-1.24,-8.091174479915598
CN(C)c1ccc(NC(=S)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3C[NH+](C)CCc2ccccn2)cc1,C43526946_decoy,TRY1,Decoy,0,-8.40544,-6.8,-1.83,-6.382465102701925
S=C(NCc1ccco1)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCC(Cc2ccccc2)CC1,C43527163_decoy,TRY1,Decoy,0,-9.25606,-7.59,-3.47,-7.431636374177792
CC(C)(C)c1cc([C@@H]2CSC[C@@H](C(=O)NCC[NH+]3CCCCC3)[NH2+]2)cc(C(C)(C)C)c1O,C44166106_decoy,TRY1,Decoy,0,-9.48376,-5.93,-1.32,-5.660507869628044
CCc1cc2c(cc1[C@H]1CSC[C@@H](C(=O)NCC[NH+]3CCCCC3)[NH2+]1)C(C)(C)CCC2(C)C,C44168313_decoy,TRY1,Decoy,0,-10.3375,-6.86,-3.04,-6.403348545916369
COc1ccc2ncc(F)c([C@@H](O)C[NH+]3CCC([NH2+]Cc4cc5c(cn4)OCS5)CC3)c2c1,C45229034_decoy,TRY1,Decoy,0,-9.50017,-7.35,-1.94,-5.690044443061983
Oc1ccccc1C[NH+]1CC[NH+](Cc2ccccc2O)C1c1cc(Br)ccc1O,C19320592_decoy,TRY1,Decoy,0,-7.12625,-6.63,-0.95,-6.321387030902612
C[NH+](Cc1cccc(Br)c1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362060_decoy,TRY1,Decoy,0,-9.13364,-4.93,-1.98,-5.323970612889353
C[NH+](Cc1ccccc1Br)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362065_decoy,TRY1,Decoy,0,-8.73013,-5.29,-2.23,-5.278769190032652
C[NH+](Cc1cc(Br)cs1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362272_decoy,TRY1,Decoy,0,-10.6044,-4.24,-2.17,-6.051137354183936
NC(=O)c1ccc2c(c1)CCO[C@@H]2CC[NH+]1CC=C(C2=c3ccc(Cl)cc3=[NH+]C2)CC1,C52595197_decoy,TRY1,Decoy,0,-8.58638,-6.76,-3.21,-5.654703990088148
[NH3+][C@H](COc1cncc(-c2ccc3cnc(-c4ccccc4)cc3c2)c1)CC1=c2ccccc2=[NH+]C1,C52627918_decoy,TRY1,Decoy,0,-9.49521,-10.85,-2.06,-7.264605228426232
[NH3+][C@H](COc1cncc(-c2ccc3cnc(C#Cc4ccccc4)cc3c2)c1)CC1=c2ccccc2=[NH+]C1,C52627922_decoy,TRY1,Decoy,0,-9.47664,-9.78,-2.69,-6.496418656049195
O[C@H](COc1ccc(-c2ccc(OC[C@H](O)C[NH+]3CCCC3)cc2)cc1)C[NH+]1CCCC1,C13425555_decoy,TRY1,Decoy,0,-7.99398,-7.2,-4.05,-6.628389342825087
CC1(C)CC([NH2+]C[C@@H](O)COC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC(C)(C)[NH2+]1,C12561486_decoy,TRY1,Decoy,0,-10.7174,-7.44,-2.73,-8.829744543131167
COc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)cc(Br)c1OCc1ccc(Cl)cc1Cl,C23469509_decoy,TRY1,Decoy,0,-9.66058,-5.54,-3.05,-5.661252089737862
COc1cc(C[NH2+]CC[NH2+]CCO)cc(Br)c1OCc1ccc(Cl)cc1Cl,C22942537_decoy,TRY1,Decoy,0,-9.28736,-5.71,-2.0,-6.073349403011662
C[C@H](O)C[NH2+]CC[NH2+]Cc1cc(Br)ccc1OCc1ccc(Cl)cc1,C23469525_decoy,TRY1,Decoy,0,-8.12075,-5.69,-2.69,-6.7451109970574645
CCOc1ccc(N2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]2c2cccc(C)c2)cc1,C63165295_decoy,TRY1,Decoy,0,-8.65443,-6.22,-1.97,-5.628670815560068
C[NH+](C)CCCNC(=S)NC[C@H](C1=c2ccccc2=[NH+]C1)c1ccc(Cl)cc1Cl,C63217009_decoy,TRY1,Decoy,0,-9.75306,-4.67,-3.16,-5.664606481289763
COCCNC(=S)Nc1ccccc1CC(C1=c2ccccc2=[NH+]C1)C1=c2ccccc2=[NH+]C1,C63234353_decoy,TRY1,Decoy,0,-5.96034,-5.69,-1.51,-4.65577812981717
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](NCc4ccccc4Cl)N3N2)[C@H](C)N=N1,C63494618_decoy,TRY1,Decoy,0,-9.01431,-7.65,-1.37,-8.47669632816265
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@H]1C=C2[NH+]=C(c3ccco3)C=C(C(F)(F)F)N2N1,C63547033_decoy,TRY1,Decoy,0,-9.79787,-8.28,-1.74,-6.659851196832677
COc1ccccc1[C@H]1NN[C@H](SCC2[NH+]=c3ccccc3=[NH+]2)N1c1ccc(Cl)cc1,C63838894_decoy,TRY1,Decoy,0,-8.87714,-8.39,-1.65,-9.678084305058867
Cn1nc(C(=O)NCc2ccccc2F)c2c1CC[C@H]([NH2+]C[C@H]1C=c3ccccc3=[NH+]1)C2,C63980633_decoy,TRY1,Decoy,0,-7.42112,-7.43,-3.01,-5.543860387677921
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)c1ccccc1[C@@H]1NC(c3ccc(F)cc3)=NO1)[NH+]=2,C64580500_decoy,TRY1,Decoy,0,-7.55084,-9.23,-1.34,-7.657014087508465
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH2+]CCC4=c5ccccc5=[NH+]C4)CC3)cc2)c(C)c1,C64609727_decoy,TRY1,Decoy,0,-9.45217,-7.4,-2.06,-5.818800589778631
O=c1[nH]c(C[NH+](CCO)Cc2nc3sccc3c(=O)[nH]2)nc2sccc12,C06509228_decoy,TRY1,Decoy,0,-7.84694,-7.03,-0.9,-7.739520661109366
CSCC[C@H](NC(=O)c1ccco1)C(=O)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12,C08996696_decoy,TRY1,Decoy,0,-7.53383,-7.32,-1.69,-6.096782678756485
CC[NH+](CC(=O)NCCNC(C)=O)CC(=O)Nc1c(Cl)cccc1Cl,C11240596_decoy,TRY1,Decoy,0,-7.14636,-6.21,-4.7,-5.365772758258154
CCC[NH+](CC(=O)NCCNC(C)=O)CC(=O)Nc1ccc(F)c(F)c1F,C12814424_decoy,TRY1,Decoy,0,-8.37112,-6.39,-2.7,-7.0340526817787685
O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]1(O)C[NH2+]Cc1n[nH]c2c1CCC2,C12445924_decoy,TRY1,Decoy,0,-9.36711,-6.2,-1.82,-5.762385158849489
O=C1N(Cc2cccc(F)c2F)CCC[C@]1(O)C[NH2+]Cc1n[nH]c2c1CCC2,C12446275_decoy,TRY1,Decoy,0,-8.48385,-7.8,-3.24,-7.307896331448481
CC[NH+]1CCc2c(sc(NC(=O)[C@@H]3CCCN(S(=O)(=O)c4ccc(C)cc4)C3)c2C(N)=O)C1,C14023278_decoy,TRY1,Decoy,0,-8.94806,-7.54,-1.99,-5.792092058596641
OCC[NH+](C[C@H](O)COC1CCCCC1)C[C@@H](O)Cn1ccc2ccccc21,C21364665_decoy,TRY1,Decoy,0,-7.69954,-5.12,-2.15,-5.784364189707672
C=CCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(C(=O)Nc2ccccc2OC)CC1,C29911175_decoy,TRY1,Decoy,0,-6.69484,-6.79,-2.5,-5.765706183442477
Cc1cccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1C,C31302664_decoy,TRY1,Decoy,0,-7.53635,-7.81,-1.05,-7.071856105276007
Cc1nccnc1C1=CC(=O)N[C@H](c2cccc(C[NH+](C)Cc3cc[nH]n3)c2)N1,C39541625_decoy,TRY1,Decoy,0,-8.66939,-7.43,-1.14,-7.343726211850752
O=C1NC[C@@H](CCC(=O)N2CCCC2)[NH+]2C[C@@H](NCc3ccc(CO)o3)C[C@@H]12,C22936700_decoy,TRY1,Decoy,0,-8.94733,-7.42,-3.36,-7.154420739038442
O=C(Nc1ccc(NC(=O)c2ccco2)cc1)C(=O)NC1CC[NH+](C2CC2)CC1,C41240327_decoy,TRY1,Decoy,0,-8.05583,-5.69,-1.86,-5.630163425007215
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NCC(C)(C)N2CC[NH+](C)CC2)c1,C41324865_decoy,TRY1,Decoy,0,-7.42887,-6.03,-2.46,-5.7290510961607
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](C(C)C)N2CC[NH+](C)CC2)cc1,C41329251_decoy,TRY1,Decoy,0,-8.63893,-6.92,-1.82,-6.018161693328201
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1cccc(C(=O)NC)c1C)CC(C)C,C41334234_decoy,TRY1,Decoy,0,-7.47435,-5.27,-2.63,-5.936883905049427
CCCNC(=O)C[NH+]1CCC(NC(=O)C(=O)Nc2c(C)cccc2CC)CC1,C41825816_decoy,TRY1,Decoy,0,-6.743,-6.4,-3.64,-5.132093134844769
CCC(=O)Nc1ccc(NC(=O)C(=O)NCCC[NH+](C)CC(F)(F)F)cc1,C41922384_decoy,TRY1,Decoy,0,-6.87918,-6.53,-3.49,-5.025851787123206
C[NH+](C)[C@@H](CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccccc1Cl,C43307514_decoy,TRY1,Decoy,0,-9.81034,-6.36,-3.82,-5.819743949960946
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C44713736_decoy,TRY1,Decoy,0,-8.21519,-5.41,-2.61,-5.698868594163471
CC(C)[C@H](CNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[NH+]1CCCCCC1,C45534583_decoy,TRY1,Decoy,0,-8.73981,-5.99,-1.39,-7.159281322728694
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H](C(=O)NC(C)(C)C)C(C)C,C45911128_decoy,TRY1,Decoy,0,-7.58476,-5.85,-2.03,-6.06635170010817
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H](C(=O)NC(C)(C)C)C(C)C,C45911131_decoy,TRY1,Decoy,0,-7.29752,-5.55,-2.75,-5.688565801553995
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)[NH+]1CCCC1,C46228781_decoy,TRY1,Decoy,0,-8.07512,-7.23,-3.37,-7.334596942528617
CC[NH+](CC)[C@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccsc1,C46254951_decoy,TRY1,Decoy,0,-8.61229,-6.16,-1.78,-6.515250901281523
CC[NH+](CC)[C@H](C)CNC(=O)N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1,C46279793_decoy,TRY1,Decoy,0,-8.47633,-6.15,-1.43,-6.08735897823578
Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@H](c2ccsc2)[NH+](C)C)c1,C46347494_decoy,TRY1,Decoy,0,-7.65273,-5.88,-2.4,-5.406080592324864
CNC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@H](c1cccs1)[NH+](C)C,C48743658_decoy,TRY1,Decoy,0,-8.41114,-6.92,-2.6,-7.810941548655798
Cc1cccc(NC(=O)C2CC[NH+]([C@@H](C)C(=O)NC(=O)NCC(C)C)CC2)n1,C53164374_decoy,TRY1,Decoy,0,-7.88338,-6.72,-3.29,-5.685809478214182
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[NH+](C)Cc1ccccc1,C54763303_decoy,TRY1,Decoy,0,-7.18941,-6.59,-2.67,-5.580612642569355
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[NH+](C)Cc1ccccc1,C54763306_decoy,TRY1,Decoy,0,-6.10704,-8.06,-3.22,-5.921865017780672
CC(C)NC(=O)NC(=O)[C@@H](C)Nc1ccc(CC(=O)N2CC[NH+](C)CC2)cc1,C56215206_decoy,TRY1,Decoy,0,-7.61884,-7.09,-3.74,-5.922107879970046
Cc1n[nH]c2nc(SCC(=O)NCc3ccco3)[n+](-c3ccccc3Cl)c(N)c12,C49539824_decoy,TRY1,Decoy,0,-10.4491,-7.05,-1.64,-6.995682172487181
O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)/C1=C\NCCN1CC[NH2+]CC1,C19997612_decoy1,TRY1,Decoy,0,-7.93891,-6.39,,-5.754693675094091
COc1ccc(C2(C[NH2+][C@@H](C)C(=O)NC(=O)NCC(C)C)CCOCC2)cc1,C62242472_decoy,TRY1,Decoy,0,-7.97979,-7.27,-1.48,-7.78515982742323
CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1,C62360076_decoy,TRY1,Decoy,0,-7.46332,-6.99,-1.47,-9.340274852253446
CCCC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H](C)C[NH+]2CCCC2)c1C,C63208123_decoy,TRY1,Decoy,0,-8.06447,-7.12,-2.48,-5.712890730585223
CC(C)NC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2ccc3c(c2)OCO3)CCOCC1,C63631420_decoy,TRY1,Decoy,0,-8.14949,-6.78,-3.78,-5.945674983184828
CC1=NN[C@@H](c2ccc(NC(=O)C(=O)NCCC3=c4ccccc4=[NH+]C3)cc2)O1,C63807275_decoy,TRY1,Decoy,0,-8.09139,-8.24,-2.06,-6.27124800182063
CC[NH+](C)Cc1cccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)c1,C64229957_decoy,TRY1,Decoy,0,-8.40137,-6.57,-2.07,-5.9631111304196365
O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)/C1=C/NCCN1CC[NH2+]CC1,C19997612_decoy2,TRY1,Decoy,0,-7.8485,-7.33,,-6.048414100251372
CC(C)(C)c1ccc(SCC(=O)NNC(=O)NCCCn2cc[nH+]c2)cc1,C64886399_decoy,TRY1,Decoy,0,-7.17527,-5.28,-3.96,-5.3706249650750255
CCN(CC)c1ccc(CNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)c[nH+]1,C66240682_decoy,TRY1,Decoy,0,-8.26619,-6.45,-2.07,-6.000325026036337
C=CCNC(=O)NC(=O)[C@H](C)[NH2+]CC1(c2ccc(OCC)cc2)CCOCC1,C66391993_decoy,TRY1,Decoy,0,-8.03261,-5.73,-2.14,-5.250405444299997
C[NH+](C)[C@@H](CNC(=O)NCc1n[nH]c(-c2cccs2)n1)c1cccc(F)c1,C66697555_decoy,TRY1,Decoy,0,-8.01097,-7.23,-1.99,-6.479150275918594
C[NH+](C)[C@H](CNC(=O)NCc1n[nH]c(-c2cccs2)n1)c1ccc(F)cc1,C66700805_decoy,TRY1,Decoy,0,-9.37494,-5.98,-1.37,-5.719772379076637
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)C1,C66720546_decoy,TRY1,Decoy,0,-8.93991,-5.71,-1.29,-6.308223261342618
C[NH+](CCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)Cc1ccccc1,C67232331_decoy,TRY1,Decoy,0,-7.62393,-5.35,-1.97,-5.274463984873996
COCCn1ccc2cc(NC(=O)NC[C@@H](O)C[NH+]3CCC(C)CC3)ccc21,C67577218_decoy,TRY1,Decoy,0,-8.27781,-6.38,-1.56,-5.585246395964615
CC1CC[NH+](C[C@H](O)CNC(=O)NCC2(c3ccc4c(c3)OCO4)CC2)CC1,C67639824_decoy,TRY1,Decoy,0,-8.24346,-8.15,-2.31,-6.114202760484805
NC(=O)c1c(NC(=O)C(=O)NCC[NH+]2CCOCC2)sc2c1CCCC2,C06670377_decoy,TRY1,Decoy,0,-10.6987,-6.29,-1.31,-7.281527836057158
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C12880057_decoy,TRY1,Decoy,0,-7.46098,-6.89,-2.28,-5.220010444823601
CCOc1ccc(N2C(=O)N=C(O)[C@H](/C=[NH+]/C(CO)(CO)CO)C2=O)cc1,C13176432_decoy,TRY1,Decoy,0,-7.21548,-5.03,-1.09,-5.146545529557486
N#CC1=C([NH3+])Nc2c(oc(CO)cc2=O)[C@@H]1c1conc1-c1ccc(F)cc1,C20071458_decoy,TRY1,Decoy,0,-6.90276,-6.91,-3.38,-4.587506972627803
N#CC1=C([NH3+])Nc2c(oc(CO)cc2=O)[C@H]1c1conc1-c1ccc(F)cc1,C20071461_decoy,TRY1,Decoy,0,-6.69388,-8.16,-1.13,-6.7322217580986425
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680359_decoy,TRY1,Decoy,0,-7.91618,-6.45,-1.51,-6.435097558538633
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680361_decoy,TRY1,Decoy,0,-7.67824,-6.98,-1.15,-5.466572565634908
O=C(NCC[NH2+]CCO)/C(=C\c1ccccc1Cl)NC(=O)c1ccco1,C26580495_decoy,TRY1,Decoy,0,-7.7442,-5.84,-1.81,-5.82067432179014
C[NH+]1CCN(c2cc(NCCO)c3c(c2N)C(=O)c2ccccc2C3=O)CC1,C09418904_decoy,TRY1,Decoy,0,-6.95824,-5.49,-2.74,-4.61827950979944
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)c3ccco3)c2C(N)=O)C1,C02447324_decoy,TRY1,Decoy,0,-8.55199,-5.65,-0.46,-5.512406910336081
CC[NH+]1[C@@H](SCC(=O)Nc2nc(C)cs2)NN[C@H]1c1ccccc1O,C39037465_decoy,TRY1,Decoy,0,-9.62558,-7.2,-1.58,-6.554254001821041
CC[NH+]1[C@@H](SCC(=O)Nc2nc(C)cs2)NN[C@@H]1c1ccccc1O,C39037466_decoy,TRY1,Decoy,0,-8.78019,-7.44,-3.22,-6.802568223754312
O=C(C[C@H]1[NH2+]CCNC1=O)N/N=C1/C(=O)Nc2ccc(Br)cc21,C36107619_decoy,TRY1,Decoy,0,-8.30745,-6.66,-1.23,-5.174160093306676
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NCc3ccc(CO)o3)C[NH+]12,C22936678_decoy,TRY1,Decoy,0,-7.5484,-7.1,-2.67,-6.139229457163807
CC1(C)CC(Nc2ncnc(N3CCN(CCO)CC3)c2N)CC(C)(C)[NH2+]1,C40734303_decoy,TRY1,Decoy,0,-9.00377,-5.62,-2.68,-5.81829086993524
Cc1ccc2c(Nc3ncnc(N4CCN(CCO)CC4)c3N)cccc2[nH+]1,C40734678_decoy,TRY1,Decoy,0,-8.35443,-8.22,-2.03,-7.302119487466838
C[NH+]1CCN(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2N)CC1,C40756944_decoy,TRY1,Decoy,0,-8.43163,-5.68,-1.28,-5.861031012015068
CC1(C)CC(Nc2ncnc(NCCN3CCOCC3)c2N)CC(C)(C)[NH2+]1,C40760910_decoy,TRY1,Decoy,0,-8.40162,-5.34,-1.9,-5.292484462621196
Cc1ccc2c(Nc3ncnc(NCCN4CCOCC4)c3N)cccc2[nH+]1,C40800597_decoy,TRY1,Decoy,0,-8.85527,-7.54,-1.14,-7.054069531323736
CCn1c(-c2nonc2N)nc2c(-c3ccccc3)ncc(OCCC[NH3+])c21,C40952852_decoy,TRY1,Decoy,0,-8.56801,-5.87,-1.48,-6.746018661622877
O=C(NC1CC[NH+](C2CC2)CC1)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42892016_decoy,TRY1,Decoy,0,-7.2071,-6.49,-0.32,-5.540270003316524
O=C(NC1CC[NH+](C2CC2)CC1)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42892020_decoy,TRY1,Decoy,0,-8.30817,-6.29,-2.31,-6.1329062552154525
O=C(NC1CC[NH+](C2CC2)CC1)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42892025_decoy,TRY1,Decoy,0,-7.84504,-5.1,-1.59,-5.343015696336181
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2nnc(NCc3ccccc3)o2)co1,C44163260_decoy,TRY1,Decoy,0,-9.20855,-8.13,-2.6,-11.003495336691827
O=C(C[NH+](CC(=O)NC(=O)NC1CC1)C1CCCCC1)NC(=O)NC1CC1,C47549516_decoy,TRY1,Decoy,0,-8.50669,-7.93,-2.57,-7.45689910057845
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1cccc(F)c1,C47964315_decoy,TRY1,Decoy,0,-7.69325,-7.26,-2.45,-6.061793868489774
CCNC(=O)NC(=O)[C@H](C)[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C16556786_decoy,TRY1,Decoy,0,-7.18492,-4.52,-4.15,-4.774738899772581
C[C@@H](C[NH+]1CCCC1)NS(=O)(=O)c1cc(Br)cnc1NN,C49186550_decoy,TRY1,Decoy,0,-7.84878,-5.79,-0.95,-8.323272288136412
CC[NH+]1CCC[C@H](NS(=O)(=O)c2cc(Br)cnc2NN)C1,C49226819_decoy,TRY1,Decoy,0,-8.20698,-3.87,-2.65,-4.598427520716225
CC[NH+]1CCC[C@@H](NS(=O)(=O)c2cc(Br)cnc2NN)C1,C49226822_decoy,TRY1,Decoy,0,-8.00541,-5.59,-2.62,-6.513769399180151
CC(=O)NCC1CC[NH+](CC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)CC1,C52848970_decoy,TRY1,Decoy,0,-7.68445,-4.76,-3.89,-5.119530444846798
COc1cccc(C(=O)NNC(=O)NC[C@@H](c2cccs2)[NH+](C)C)c1O,C54539719_decoy,TRY1,Decoy,0,-8.43956,-6.21,-3.29,-6.646644152319249
COc1cccc(C(=O)NNC(=O)NC[C@H](c2cccs2)[NH+](C)C)c1O,C54539720_decoy,TRY1,Decoy,0,-9.31183,-6.3,-1.67,-6.905623679928733
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)NC(=O)NC(C)(C)C)sc2[nH+]1,C10645035_decoy,TRY1,Decoy,0,-7.687,-7.37,-2.26,-6.7421021614688055
Cc1nc(C2([NH2+]CC(=O)Nc3sccc3C(N)=O)CCCCCC2)no1,C63512106_decoy,TRY1,Decoy,0,-7.74297,-6.76,-1.66,-7.424527545630858
O=C(NCc1nc2ccccc2c(=O)[nH]1)N[C@@H]1[NH+]=C(c2ccccc2)NS1,C63882936_decoy,TRY1,Decoy,0,-7.91618,-8.27,-3.41,-6.572239594381069
O=C(NCc1nc2ccccc2c(=O)[nH]1)N[C@H]1[NH+]=C(c2ccccc2)NS1,C63882939_decoy,TRY1,Decoy,0,-7.04658,-8.47,-1.72,-6.612924095086652
Cc1cc(C)c(C[NH+]2CCN(c3cc(N)nc(N)n3)CC2)c(-n2cccn2)c1,C65397445_decoy,TRY1,Decoy,0,-7.89648,-8.34,-0.62,-7.757313612626148
C=CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C65598274_decoy,TRY1,Decoy,0,-8.73569,-7.02,-1.61,-6.053780153171029
CC[NH+](CC)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccco1,C65602216_decoy,TRY1,Decoy,0,-8.87051,-5.62,-2.39,-5.663395313433485
CC(=O)NC[C@@H]1CCC[NH+](CC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)C1,C67415230_decoy,TRY1,Decoy,0,-7.70299,-6.64,-1.34,-5.719932897299021
CC(=O)NC[C@@H]1CCC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1,C67418237_decoy,TRY1,Decoy,0,-10.1002,-6.64,-3.61,-6.144828308306773
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc3c(c2)NC(=O)CS3)CC1,C67538215_decoy,TRY1,Decoy,0,-10.6048,-6.21,-3.15,-6.319264105076502
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc3c(c2)NC(=O)CS3)CC1,C67538216_decoy,TRY1,Decoy,0,-9.59022,-5.72,-1.56,-6.01991968782406
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNc2ccccc2[N+](=O)[O-])CC1,C67609863_decoy,TRY1,Decoy,0,-6.30426,-6.62,-2.76,-5.340269343953428
CCNC(=O)[C@@H]1C[C@@H](n2cc(CNC(=O)NC3CCCCCC3)nn2)C[NH2+]1,C67643154_decoy,TRY1,Decoy,0,-8.21401,-6.7,-3.09,-6.1014196430740375
COc1ccc(CN2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@]4(C(=O)Nc5c(C)cc(Cl)cc54)[C@@H]3C2=O)cc1,C02132100_decoy,TRY1,Decoy,0,-8.83175,-7.75,-0.28,-6.269502459630192
COc1cc2c(c(OC)c1OC)-c1ccc(NCCO)c(=O)cc1[C@@H]([NH3+])CC2,C05512914_decoy,TRY1,Decoy,0,-8.60793,-4.54,-0.85,-6.553628166755827
C[NH+]1CCN(c2nc(N)nc(N)c2S(=O)(=O)c2ccc(Cl)cc2)CC1,C06677880_decoy,TRY1,Decoy,0,-7.2079,-5.12,-3.06,-4.019447369173597
COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C08789042_decoy,TRY1,Decoy,0,-8.35078,-5.64,-2.6,-5.568741067916823
Cc1cc(Cl)c2c(c1)[C@]1([NH2+][C@@H](CCC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08790170_decoy,TRY1,Decoy,0,-10.2941,-7.11,-2.69,-6.344091123286115
NC(=O)C[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C08790670_decoy,TRY1,Decoy,0,-9.59811,-6.32,-0.97,-5.870342727683605
Cc1ccc(Nc2nc(N)nc(C[NH2+][C@@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C09442181_decoy,TRY1,Decoy,0,-7.46381,-7.99,-2.06,-6.854985825853724
C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC(NS(C)(=O)=O)CC1,C10043172_decoy,TRY1,Decoy,0,-9.32931,-6.98,-2.16,-5.822809370109304
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC(NS(C)(=O)=O)CC1,C10043173_decoy,TRY1,Decoy,0,-10.345,-5.9,-1.81,-5.896655786625807
COc1cc2c(cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CC[NH+]1CC=C3C=C[C@@H](OC)C[C@@]321,C12339510_decoy,TRY1,Decoy,0,-7.89196,-6.0,-2.31,-5.688948620195602
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N([C@H](C)c3ccccc3)C(=O)[C@H]21,C02130481_decoy,TRY1,Decoy,0,-9.05745,-7.43,-0.76,-6.440406904414755
Cc1ccc(OC[C@@H](O)Cn2c(NCCC[NH3+])nc3c2c(=O)[nH]c(=O)n3C)cc1,C05460903_decoy,TRY1,Decoy,0,-5.96819,-6.72,-1.34,-6.587151730739475
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C16637540_decoy,TRY1,Decoy,0,-6.73418,-5.31,-3.04,-4.863965679906658
COc1ccc(NC(=O)N[C@H]2[C@H](O)[C@@H]([NH+]3CCC(C(N)=O)CC3)[C@@H]3OC[C@H]2O3)cc1,C20463915_decoy,TRY1,Decoy,0,-7.48092,-5.77,-2.45,-4.727578045256548
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC(=O)NCC(F)(F)F)cc1,C30499321_decoy,TRY1,Decoy,0,-5.94121,-6.81,-1.16,-5.04469267181907
CC(C)Oc1c(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1Cl,C40744472_decoy,TRY1,Decoy,0,-7.25324,-6.43,-1.66,-5.722044736769379
CCC(CC)[C@@H](CNC(=O)C(=O)Nc1cccc(C(N)=O)c1C)[NH+]1CCCC1,C41327680_decoy,TRY1,Decoy,0,-8.53219,-5.99,-1.53,-6.840883925740683
CC(C)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCCCC1,C41328672_decoy,TRY1,Decoy,0,-8.95081,-6.93,-1.81,-7.894426945144665
NC(=O)Cc1ccccc1NC(=O)C(=O)NCCC[NH+]1CCc2ccccc2C1,C41732749_decoy,TRY1,Decoy,0,-7.34776,-7.45,-2.11,-5.595722749375448
Cc1c(C(N)=O)cc(-c2cccc(Cl)c2)n1[C@@H](Cc1ccc(O)cc1)C(=O)NCC[NH+](C)C,C43225894_decoy,TRY1,Decoy,0,-9.60223,-7.35,-2.96,-9.903694580602671
CC1(C)C[C@H]([NH2+]Cc2ccc(CO)o2)[C@]2(CCC(=O)NCc3cccnc3)CC[C@](C)(O)C[C@@H]12,C43548029_decoy,TRY1,Decoy,0,-10.3183,-6.29,-1.45,-7.45665237146267
C[NH+](C)CCNC(=O)C[C@@H]1c2nc(NC(=O)c3ccco3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553502_decoy,TRY1,Decoy,0,-10.2411,-8.31,-2.09,-8.713159594567836
CCOC(=O)C1=C(CS/C(N)=[NH+]/C)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C44793333_decoy,TRY1,Decoy,0,-8.63119,-5.95,-2.13,-6.20572317478321
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)O)[NH+](C)C1,C04340339_decoy,TRY1,Decoy,0,-7.54125,-4.43,-2.43,-5.282012013432249
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44964073_decoy,TRY1,Decoy,0,-7.54147,-4.44,-4.1,-5.170712350265083
C[C@H](C(=O)NC(N)=O)[NH+]1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1,C47261985_decoy,TRY1,Decoy,0,-7.85879,-6.29,-0.71,-5.522315344885031
NC(=O)CCOc1ccccc1NC(=O)NCCC[NH+]1CCc2ccccc2C1,C47878090_decoy,TRY1,Decoy,0,-8.41817,-6.78,-2.3,-6.877576346906436
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccccc1Cl,C47964716_decoy,TRY1,Decoy,0,-9.40936,-7.1,-2.58,-6.236706404983699
C[NH+](C)[C@@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccco1,C54038136_decoy,TRY1,Decoy,0,-7.76657,-6.1,-1.64,-5.39227451000789
NS(=O)(=O)c1c[nH]cc/c1=[NH+]\NC1=NS(=O)(=O)c2cnccc2S1,C49808255_decoy,TRY1,Decoy,0,-9.27444,-6.26,-1.23,-5.428003793063472
CC[NH+]1CCC[C@H](NC(=O)NNC(=O)Nc2ccc(Br)cc2)C1,C56752900_decoy,TRY1,Decoy,0,-8.26892,-5.5,-1.79,-5.167159143980481
N#Cc1c(CCCCC[NH2+]CC2=C(c3ccc(Cl)cc3)N=NC2)n[nH]c1N,C39936518_decoy,TRY1,Decoy,0,-7.36058,-6.75,-1.65,-7.244618449822776
C[NH+](C)[C@@H](CNC(=O)NNC(=O)Nc1cc(F)cc(F)c1)c1cccs1,C63399151_decoy,TRY1,Decoy,0,-8.76027,-6.96,-2.9,-5.735754715490637
NC(=O)[C@@H]1N[C@H](Nc2ccccc2)S[C@H]1NC(=O)[C@@H]1C=c2cc(Cl)ccc2=[NH+]1,C63686323_decoy,TRY1,Decoy,0,-8.64601,-6.23,-1.1,-6.079841043075229
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C39996791_decoy,TRY1,Decoy,0,-9.04412,-7.97,-1.62,-6.609919635591896
Nc1nc(N)nc(COC(=O)CCC2=c3cc(F)ccc3=[NH+][C@H]2c2ccc(F)cc2)n1,C64150831_decoy,TRY1,Decoy,0,-7.71353,-8.99,-1.42,-8.504884875252873
O=C1[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@@H](O)N[C@H](O)N1Cc1ccccc1,C64227785_decoy,TRY1,Decoy,0,-7.02227,-7.28,-2.01,-4.678941266761378
CC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C33902777_decoy,TRY1,Decoy,0,-7.00203,-5.24,-3.5,-4.805184977739948
Cc1ccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cc1C(N)=O,C67491386_decoy,TRY1,Decoy,0,-8.30397,-8.04,-1.63,-6.465306863448013
CNC(=O)c1cc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)ccc1Cl,C67546004_decoy,TRY1,Decoy,0,-9.26068,-6.12,-2.38,-5.838761781490664
CNC(=O)c1cc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)ccc1Cl,C67546005_decoy,TRY1,Decoy,0,-9.57366,-6.11,-2.0,-6.319925773985975
CC[NH+](CC)[C@H](CNC(=O)C(=O)Nc1ccc(C)c(C(N)=O)c1)c1ccco1,C67557587_decoy,TRY1,Decoy,0,-8.63748,-6.15,-2.91,-8.18828451006277
Cc1ccc([C@H](CNC(=O)C(=O)Nc2ccc(C)c(C(N)=O)c2)[NH+]2CCCC2)o1,C67565700_decoy,TRY1,Decoy,0,-8.16752,-6.32,-1.35,-5.9555602942017964
CC1CC[NH+](C[C@H](O)CNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)CC1,C67581915_decoy,TRY1,Decoy,0,-8.47149,-6.21,-2.72,-5.946327206145269
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)n(C2CC2)c(=S)[nH]c1=O,C03985146_decoy,TRY1,Decoy,0,-6.95205,-6.47,-1.21,-4.897736978379346
COc1cc2c(c(OC)c1OC)-c1ccc(NCCO)c(=O)cc1[C@H]([NH3+])CC2,C01872649_decoy,TRY1,Decoy,0,-7.99049,-4.46,-1.84,-4.969595072122705
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2c1ccc(C)c2C,C09042975_decoy,TRY1,Decoy,0,-8.83346,-6.72,-1.8,-6.751893793210192
COC(=O)c1c(NC(=O)C(=O)NCC[NH+]2CCCCC2)sc(C(N)=O)c1C,C09047615_decoy,TRY1,Decoy,0,-10.1542,-6.68,-0.82,-8.120974740140852
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)N1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C09439617_decoy,TRY1,Decoy,0,-7.24765,-5.27,-4.95,-4.31765426102742
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C09593824_decoy,TRY1,Decoy,0,-10.7248,-5.47,-2.0,-6.630943865607311
CC(CO)(CO)[NH2+]Cc1cc2c(-c3cccc(F)c3)nn(-c3ccccc3)c2[nH]c1=O,C12186515_decoy,TRY1,Decoy,0,-7.10407,-7.6,-1.23,-7.572342570023032
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccc(F)cc3F)C[NH+]12)NC1CC1,C12530545_decoy,TRY1,Decoy,0,-7.977,-8.22,-3.77,-7.440729557408733
CSc1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C08636344_decoy,TRY1,Decoy,0,-11.6803,-7.47,-3.55,-8.045863016020457
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C16696690_decoy,TRY1,Decoy,0,-7.31245,-6.06,-1.78,-5.004095348974557
COc1cc(Nc2nccc(-c3ccc(NCC[NH3+])nc3)n2)cc(OC)c1OC,C26983604_decoy,TRY1,Decoy,0,-10.1132,-7.39,-1.15,-8.650342674190316
COc1cc(Nc2nccc(-c3ccc(NCC[NH3+])nc3)n2)cc(OC)c1OC,C26983604_decoy,TRY1,Decoy,0,-10.1132,-7.39,-1.86,-8.650342674190316
C[C@H](c1nc(N)nc(N(C)C)n1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C27373941_decoy,TRY1,Decoy,0,-7.0602,-7.96,-1.9,-6.318262245340456
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NC(=O)NCC(F)(F)F)cc1,C30499325_decoy,TRY1,Decoy,0,-6.70646,-6.37,-2.87,-7.221811546520893
Nc1c(C(=O)NNC(=O)c2cncc(Br)c2)c[nH+]c2ccccc12,C32605499_decoy,TRY1,Decoy,0,-7.77855,-5.23,-2.37,-4.5385368527903065
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323206_decoy,TRY1,Decoy,0,-8.37925,-5.54,-1.12,-6.163235886075651
COc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)[C@H]4C=C(C)N(C)N4)CC34CC[NH2+]CC4)c2c1,C39599499_decoy,TRY1,Decoy,0,-8.58902,-8.43,-2.85,-6.817518330763142
CCOC(=O)C1=C(N)OC2=c3ccccc3=[NH+]C(=O)[C@H]2[C@@H]1c1ccc(O)c(O)c1,C39767159_decoy,TRY1,Decoy,0,-7.35054,-9.99,-2.31,-6.437721655102152
Cc1csc(NC(=O)C2CC[NH+]([C@H](C)C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)CC2)n1,C40149653_decoy,TRY1,Decoy,0,-8.90575,-5.27,-0.86,-5.261418530386576
COc1cc(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)c1OC(C)C,C40744458_decoy,TRY1,Decoy,0,-7.82983,-7.44,-2.54,-9.251307713151538
COc1c(Br)cc(C/C(=N/O)C(=O)NCCc2c[nH+]c(N)[nH]2)cc1Br,C13393261_decoy,TRY1,Decoy,0,-9.67125,-6.92,-3.08,-8.566267316265803
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C44963767_decoy,TRY1,Decoy,0,-7.20917,-5.42,-1.03,-5.148024903305451
CC(C)C[NH+]1CCC(NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1,C45464000_decoy,TRY1,Decoy,0,-7.79025,-4.4,-0.71,-4.729376256671228
C[n+]1c(NNC(=O)Nc2ccccc2SCC(N)=O)sc2ccccc21,C45695159_decoy,TRY1,Decoy,0,-8.04527,-8.3,-1.7,-7.060940539437038
C[C@@H](C(=O)NC(N)=O)[NH+]1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1,C47261984_decoy,TRY1,Decoy,0,-8.66676,-6.75,-5.54,-7.227006921143374
NC(=O)[C@@H]([NH3+])COc1c(Br)cc([N+](=O)[O-])cc1Br,C50441509_decoy,TRY1,Decoy,0,-8.36534,-4.59,-2.66,-4.990021188667675
NC(=O)[C@H]([NH3+])COc1c(Br)cc([N+](=O)[O-])cc1Br,C50441510_decoy,TRY1,Decoy,0,-9.79526,-5.42,-1.47,-13.444075949272328
C[C@@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)C[NH+]1CCCCC1,C57042670_decoy,TRY1,Decoy,0,-9.27689,-5.96,-2.41,-6.272133113697579
C[C@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)C[NH+]1CCCCC1,C57042672_decoy,TRY1,Decoy,0,-8.9095,-5.84,-3.67,-6.3941344464331165
NC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CN1C(=O)N[C@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63161117_decoy,TRY1,Decoy,0,-7.99792,-7.49,-1.6,-6.1922274683768
NC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63272243_decoy,TRY1,Decoy,0,-6.49954,-7.86,-1.63,-5.656681511687241
Nc1nc(N)nc(C[NH+]2CCN(Cc3sccc3Br)CC2)n1,C63763083_decoy,TRY1,Decoy,0,-8.9102,-7.46,-1.32,-14.2051755902218
NC(=O)C1CCN(C(=O)C(=O)NCCNC(=O)[C@@H]2C=c3ccccc3=[NH+]2)CC1,C63780901_decoy,TRY1,Decoy,0,-6.89653,-8.07,-1.77,-6.573256895635911
NC(=O)C1CCN(C(=O)C(=O)NCCNC(=O)[C@H]2C=c3ccccc3=[NH+]2)CC1,C63780903_decoy,TRY1,Decoy,0,-8.32606,-7.11,-3.7,-7.20338974307314
CC(=O)Nc1ccccc1OC[C@@H]1NO[C@@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1,C63786512_decoy,TRY1,Decoy,0,-8.01416,-8.72,-1.52,-7.028372411124929
CC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C65739436_decoy,TRY1,Decoy,0,-6.56924,-6.36,-3.36,-6.102272439138311
CC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C33902779_decoy,TRY1,Decoy,0,-7.52593,-5.71,-2.89,-5.191924187681522
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)Cl)C1,C65748470_decoy,TRY1,Decoy,0,-7.6072,-6.38,-3.32,-5.855494592398829
C[NH+]1CCN(c2ncccc2CNC(=O)NNC(=O)c2ccccc2O)CC1,C66986322_decoy,TRY1,Decoy,0,-8.35654,-6.04,-1.61,-6.102101591797154
CC(=O)NC[C@H]1CCC[NH+]([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1,C67416044_decoy,TRY1,Decoy,0,-9.87759,-5.73,-2.01,-6.529289169302621
CC1=C(C(=O)N2CCc3n[nH]c(C(C)C)c3C2)[C@@H](c2[nH]c[nH+]c2C)NC(=O)N1,C67447259_decoy,TRY1,Decoy,0,-7.12018,-5.07,-1.77,-5.729218854462217
CC1=C(C(=O)N2CCc3n[nH]c(C(C)C)c3C2)[C@H](c2[nH]c[nH+]c2C)NC(=O)N1,C67447260_decoy,TRY1,Decoy,0,-8.34315,-6.9,-1.87,-6.477880298428344
CC(=O)Nc1cc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c(F)cc1F,C67550360_decoy,TRY1,Decoy,0,-8.46606,-7.35,-3.81,-6.646229373195049
CC1CC[NH+](C[C@@H](O)CNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)CC1,C67581918_decoy,TRY1,Decoy,0,-8.34942,-6.96,-1.7,-6.200629752924918
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)CC1,C67624133_decoy,TRY1,Decoy,0,-9.25877,-2.42,-3.65,-4.620383791812759
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OC,C04488493_decoy,TRY1,Decoy,0,-6.88538,-6.42,-2.03,-5.540741868045337
CC[C@H](C)N1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C05345855_decoy,TRY1,Decoy,0,-6.44788,-5.39,-1.9,-4.9513602946819
O=C1c2ccccc2C(=O)c2c(NCC[NH2+]CCO)ccc(NCCO)c21,C05545062_decoy,TRY1,Decoy,0,-7.70129,-5.31,-0.99,-5.095023098148478
CCOC(=O)c1c(NC(=O)C[NH2+]C[C@H]2CCCO2)sc(C(N)=O)c1C,C06578834_decoy,TRY1,Decoy,0,-8.59738,-6.38,-0.5,-9.345678645175528
COc1ccc(Br)cc1C[NH2+]CCNC(=O)c1nonc1N,C06758942_decoy,TRY1,Decoy,0,-7.23798,-6.89,-1.38,-9.87851615324782
CC[C@@H](C)N1C(=O)[C@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C08995293_decoy,TRY1,Decoy,0,-7.60093,-5.16,-1.04,-5.407564185668492
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(N3CCOCC3)[nH+]c2)cc1,C10410149_decoy,TRY1,Decoy,0,-9.84198,-6.69,-3.62,-5.769413243126334
O=C1NC(=O)[C@](CCCc2ccccc2)(C2CC[NH+](C[C@@H](O)CO)CC2)N1,C12098599_decoy,TRY1,Decoy,0,-7.83602,-6.28,-2.36,-5.891540915118681
N#Cc1cccc(NC(=O)N[C@H]2[C@H](O)[C@@H]([NH+]3CCC(C(N)=O)CC3)[C@@H]3OC[C@H]2O3)c1,C20463927_decoy,TRY1,Decoy,0,-7.57949,-7.08,-1.92,-6.129700072804296
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C29787127_decoy,TRY1,Decoy,0,-8.4529,-5.53,-2.02,-5.589301299692621
CC(C)(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)(C)C)C1CC1,C28973954_decoy,TRY1,Decoy,0,-7.01528,-4.82,-2.52,-4.8570735251654
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)[C@@H]1CCCC[C@@H]1C,C31469369_decoy,TRY1,Decoy,0,-8.2381,-6.48,-1.38,-6.901349018147053
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)[C@@H]1CCCC[C@H]1C,C31469377_decoy,TRY1,Decoy,0,-7.90802,-6.71,-2.22,-6.960536033144788
[NH3+]CCCC[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccccn2)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C34388552_decoy,TRY1,Decoy,0,-6.38866,-7.21,-0.21,-6.536545703413039
CCn1c(-c2nonc2N)nc2c(-c3ccoc3)ncc(OCCC[NH3+])c21,C40378997_decoy,TRY1,Decoy,0,-8.45952,-5.89,-1.61,-7.116068010564197
COc1ccc(OC)c(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)c1,C40754346_decoy,TRY1,Decoy,0,-6.98695,-5.51,-1.31,-5.087716917038327
NNc1ncc(Br)cc1S(=O)(=O)N[C@H]1C[NH+]2CCC1CC2,C41069971_decoy,TRY1,Decoy,0,-7.65889,-6.07,-2.91,-5.318970202043972
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)c1ccsc1,C41648738_decoy,TRY1,Decoy,0,-9.79713,-7.06,-1.19,-7.833155632289567
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccsc1,C41648935_decoy,TRY1,Decoy,0,-8.10305,-6.92,-3.55,-7.358830261728819
C[C@@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C41725607_decoy,TRY1,Decoy,0,-9.13865,-7.43,-1.55,-6.208289543449355
C[NH+](CCCNC(=O)C(=O)Nc1ccccc1CC(N)=O)CC(F)(F)F,C41922666_decoy,TRY1,Decoy,0,-7.18592,-6.54,-3.54,-5.408300704974772
CSCC[C@H]([NH3+])c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C43217219_decoy,TRY1,Decoy,0,-8.24316,-5.05,-2.27,-5.405381439284834
CC(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)C)C1CCCC1,C47550231_decoy,TRY1,Decoy,0,-9.0447,-6.56,-3.75,-6.947191595082062
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1cccc(F)c1,C47964314_decoy,TRY1,Decoy,0,-8.8041,-6.98,-2.34,-6.19978317892814
CC1CC[NH+]([C@H](CNC(=O)C(=O)Nc2sccc2C(N)=O)C(C)C)CC1,C47998644_decoy,TRY1,Decoy,0,-9.11321,-5.55,-3.01,-6.408464176323834
CNC(=O)c1cccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1C,C48605181_decoy,TRY1,Decoy,0,-8.21114,-6.03,-2.42,-5.66114635192411
NNc1ncc(Br)cc1S(=O)(=O)N[C@@H]1CC[NH+]2CCC[C@H]12,C49570832_decoy,TRY1,Decoy,0,-7.61089,-5.28,-1.63,-4.757797318067487
CCOc1ccccc1N1C(=O)NC(=O)/C(=C\N[C@@H]2CCCC[C@H]2[NH3+])C1=O,C20266930_decoy,TRY1,Decoy,0,-10.2211,-6.35,-2.52,-6.9386616026561
COc1ccc(N2C(=O)/C(=C/N[C@@H]3CCCC[C@@H]3[NH3+])C(=O)NC2=S)cc1,C20329244_decoy,TRY1,Decoy,0,-8.24314,-6.52,-0.99,-5.446528690351661
COc1ccc(N2C(=O)/C(=C/N[C@@H]3CCCC[C@H]3[NH3+])C(=O)NC2=S)cc1,C20329256_decoy,TRY1,Decoy,0,-10.1177,-5.53,-1.54,-6.053308999622423
[NH3+][C@H]1CCCC[C@@H]1N/C=C1\C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393243_decoy,TRY1,Decoy,0,-8.50599,-6.6,-1.99,-5.708057025083106
CCCNC(=O)C[NH+]1CCC(NC(=O)c2cc(NC(C)=O)ccc2O)CC1,C55248846_decoy,TRY1,Decoy,0,-7.19978,-5.92,-1.19,-5.438151977724751
NC(=O)CCn1cc(C[NH2+]Cc2n[nH]c(=O)c3ccccc23)c2ccccc21,C55282435_decoy,TRY1,Decoy,0,-8.18253,-7.17,-4.0,-6.520829170341654
CNC(=O)C[NH+]1CCC(NC(=O)NCC(=O)Nc2ccc(F)c(F)c2)CC1,C28422974_decoy,TRY1,Decoy,0,-8.45566,-6.69,-2.57,-5.946455537343241
[NH3+][C@@H]1CCCC[C@@H]1N/C=C1/C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393240_decoy2,TRY1,Decoy,0,-9.34422,-5.91,,-5.891645960818933
Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)nc21,C63809168_decoy,TRY1,Decoy,0,-8.14681,-6.36,-2.3,-5.091739168623862
Cc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)[NH+]2CCCC2)cc1,C64237517_decoy,TRY1,Decoy,0,-9.09439,-5.51,-0.89,-5.837731659206785
CCCNC(=O)C[NH+]1CCC(NC(=O)N[C@H](C)C(=O)N[C@H](C)CC)CC1,C65989221_decoy,TRY1,Decoy,0,-7.65659,-5.83,-3.29,-5.8700155468137085
CCCCCOc1c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cccc1OC,C66115428_decoy,TRY1,Decoy,0,-8.06382,-5.79,-2.32,-5.893713129093996
CC1CC[NH+](C[C@H](O)CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1,C67373200_decoy,TRY1,Decoy,0,-8.56224,-5.6,-2.05,-5.943714848929011
Nc1nc(N)nc(C[NH+]2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)n1,C67411463_decoy,TRY1,Decoy,0,-7.66952,-5.84,-1.67,-4.3961534277314565
CC1=C(C(=O)NCCSc2ccccn2)[C@H](c2[nH]c[nH+]c2C)NC(=O)N1,C67459298_decoy,TRY1,Decoy,0,-8.82134,-4.81,-2.04,-6.378731308383475
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC1,C67548428_decoy,TRY1,Decoy,0,-8.58147,-7.71,-2.28,-5.93412027316943
Cc1n[nH]c(-c2ccc(NC(=O)NC[C@H](O)C[NH+]3CCC(C)CC3)cc2)n1,C67572846_decoy,TRY1,Decoy,0,-8.93814,-7.19,-1.2,-5.8702876281035925
Cc1n[nH]c(-c2ccc(NC(=O)NC[C@@H](O)C[NH+]3CCC(C)CC3)cc2)n1,C67572848_decoy,TRY1,Decoy,0,-7.99459,-6.79,-1.87,-4.8622992387625485
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNc2ccccc2[N+](=O)[O-])CC1,C67609865_decoy,TRY1,Decoy,0,-6.3289,-7.35,-1.3,-7.06364366530808
NC(=O)CC[C@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C3CCCCCC3)C(=O)[C@@H]21,C02161147_decoy,TRY1,Decoy,0,-9.35857,-7.59,-1.53,-9.008276344598483
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)/C=C/c3ccco3)c2C(N)=O)C1,C02316557_decoy,TRY1,Decoy,0,-9.79615,-5.27,-3.42,-6.398362888215705
COc1ccc(N2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C08789032_decoy,TRY1,Decoy,0,-7.8752,-5.74,-1.05,-5.236187292759651
Cc1ccc2c(c1)[C@@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791100_decoy,TRY1,Decoy,0,-7.75131,-6.19,-1.82,-5.0147954717379895
Cc1ccc2c(c1)[C@]1([NH2+][C@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791101_decoy,TRY1,Decoy,0,-7.31963,-5.79,-1.78,-5.03968704868599
Cc1ccc2c(c1)[C@@]1([NH2+][C@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791103_decoy,TRY1,Decoy,0,-9.27964,-6.23,-1.17,-6.180003372024073
CCCCN1C(=O)[C@H]2[C@H](CCC(N)=O)[NH2+][C@@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C09042973_decoy,TRY1,Decoy,0,-8.06198,-5.88,-0.88,-6.504572586057726
Cc1ccc(Nc2nc(N)nc(C[NH2+][C@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C09442183_decoy,TRY1,Decoy,0,-8.21573,-7.61,-2.68,-6.416600062925825
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C08789699_decoy,TRY1,Decoy,0,-8.85773,-7.22,-1.54,-6.448736197390092
COc1cc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCCCC4)[C@H]3S2)cc(OC)c1,C08636529_decoy,TRY1,Decoy,0,-10.2148,-7.47,-3.29,-7.417277255156413
CCC[C@H]1C[C@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C16696689_decoy,TRY1,Decoy,0,-6.74647,-6.02,-3.33,-5.539799081137819
NC(=O)C1CC[NH+](CC(=O)NNC(=O)c2ccc(Br)cc2)CC1,C23777210_decoy,TRY1,Decoy,0,-9.0449,-4.93,-2.41,-5.464728817531423
CCNC(=O)NC(=O)C[NH+](CC(=O)Nc1c(C)cccc1C)CC(=O)Nc1c(C)cccc1C,C23777903_decoy,TRY1,Decoy,0,-8.39951,-5.4,-1.92,-5.925991568429217
CC1(C)[NH+]=C(N)N=C(N)N1c1ccc(OCc2cccc(C#N)c2)c(Cl)c1,C16955314_decoy,TRY1,Decoy,0,-10.073,-6.81,-2.93,-10.621964426511536
CCc1c(C)[nH]c(=O)c(NC(=O)CNC(=O)C[NH3+])c1Cc1cc(C)cc(C)c1,C29567953_decoy,TRY1,Decoy,0,-8.50532,-7.41,-2.4,-8.348609056760678
O=C(CN1N[C@H](c2ccc3c(c2)OCO3)N[NH2+]1)N/N=C/[C@@H]1C=NN=C1c1ccc(F)cc1,C39210934_decoy,TRY1,Decoy,0,-7.92728,-8.83,-1.8,-6.42766398221772
CC1(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)CCCCC1,C39661783_decoy,TRY1,Decoy,0,-9.06524,-9.04,-4.36,-9.28733627807732
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OC(C)C,C40744461_decoy,TRY1,Decoy,0,-6.5207,-6.04,-1.96,-5.365941687816044
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3ccc(C(N)=O)cc3)n2)CC1,C41301094_decoy,TRY1,Decoy,0,-7.43198,-8.14,-1.69,-7.9222861920662995
CC(C)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)[NH+]1CCCCCC1,C41328675_decoy,TRY1,Decoy,0,-7.94369,-7.14,-1.33,-8.387256748849655
Nc1nc(NCC[NH2+]CCO)nc(Nc2cccc3cccnc23)c1[N+](=O)[O-],C41334034_decoy,TRY1,Decoy,0,-5.91779,-5.89,-1.77,-5.196957261899648
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2nnc(NCCc3ccccc3)o2)co1,C44163269_decoy,TRY1,Decoy,0,-9.18421,-7.89,-3.26,-7.872378507128428
CCOC(=O)C1=C(CS/C(N)=[NH+]/[C@@H](C)COC)NC(=O)N[C@H]1c1ccco1,C44792829_decoy,TRY1,Decoy,0,-6.30487,-5.51,-2.07,-5.104568519811135
CCOC(=O)C1=C(CS/C(N)=[NH+]/[C@H](C)COC)NC(=O)N[C@H]1c1ccco1,C44792838_decoy,TRY1,Decoy,0,-7.18056,-5.46,-3.18,-5.491534571725632
CCOC(=O)C1=C(CS/C(N)=[NH+]/C)NC(=O)N[C@H]1c1ccc(Cl)cc1,C44793336_decoy,TRY1,Decoy,0,-8.21257,-5.58,-2.73,-5.737878957687967
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)O)[NH+](C)C1,C44830559_decoy,TRY1,Decoy,0,-7.03118,-4.91,-3.14,-4.8314584301556485
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44964075_decoy,TRY1,Decoy,0,-7.9517,-4.78,-1.16,-5.172831378738944
CC[NH+](CC)Cc1cccc(CNC(=O)C(=O)Nc2sccc2C(N)=O)c1,C48029062_decoy,TRY1,Decoy,0,-7.13555,-6.97,-1.9,-6.905370239270485
CC1CC[NH+]([C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2cccs2)CC1,C49790482_decoy,TRY1,Decoy,0,-8.50959,-6.54,-0.76,-6.689400562840508
C[NH+](C)[C@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccco1,C54038138_decoy,TRY1,Decoy,0,-7.83465,-5.72,-1.28,-5.71881206812465
CC[NH+]1CCC[C@@H](NC(=O)NNC(=O)Nc2ccc(Br)cc2)C1,C56752901_decoy,TRY1,Decoy,0,-8.14818,-6.1,-0.96,-5.924219808941048
C[C@@H]1CCC[NH+](C[C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1,C56786198_decoy,TRY1,Decoy,0,-8.35547,-5.58,-1.37,-5.636794561725482
C[C@H]1CCC[NH+](C[C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1,C56786199_decoy,TRY1,Decoy,0,-8.29691,-5.07,-2.14,-6.085692201874421
CCCNC(=O)C[NH+]1CCC(NC(=O)NCCNC(=O)OC(C)(C)C)CC1,C62652017_decoy,TRY1,Decoy,0,-7.91781,-5.72,-3.11,-5.475493245745766
O=C(NCCO)C(=O)Nc1ccccc1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63270258_decoy,TRY1,Decoy,0,-7.12998,-7.33,-1.3,-8.584134928020456
CC(=O)Nc1ccccc1OC[C@H]1NO[C@@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1,C63786510_decoy,TRY1,Decoy,0,-7.94112,-7.17,-2.54,-7.121252857136137
CCCCN(C(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1c(N)n(CCC)c(=O)[nH]c1=O,C64055379_decoy,TRY1,Decoy,0,-8.71532,-7.5,-3.74,-6.74896629851764
CC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C65739434_decoy,TRY1,Decoy,0,-7.18855,-4.82,-3.12,-5.094814433184402
CC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C33902778_decoy,TRY1,Decoy,0,-6.59182,-6.37,-2.02,-5.882676698703458
COC(=O)Nc1cc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)ccc1F,C67489248_decoy,TRY1,Decoy,0,-8.05275,-6.25,-4.17,-5.585944260572127
CNC(=O)c1ccc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1Cl,C67547203_decoy,TRY1,Decoy,0,-9.81898,-6.48,-1.86,-6.655061397996189
CNC(=O)c1ccc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)cc1Cl,C67547204_decoy,TRY1,Decoy,0,-10.1404,-7.18,-2.5,-7.091036320942076
Cc1ccc([C@@H](CNC(=O)C(=O)Nc2ccc(C)c(C(N)=O)c2)[NH+]2CCCC2)o1,C67565704_decoy,TRY1,Decoy,0,-9.10015,-6.41,-2.45,-6.476131311595603
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)CC1,C67624129_decoy,TRY1,Decoy,0,-8.87219,-7.32,-2.45,-6.517833084838429
C[NH2+][C@@H](C)C(=O)N[C@@H]1C=C(C(=O)N[C@@H](C(=O)OC)C(C)C)C[C@@H](O)[C@@H]1O,C03838527_decoy,TRY1,Decoy,0,-9.23529,-6.36,-0.91,-6.075898682940791
C[C@H](O)c1ccc(-c2ccc(C[NH2+]CCNC(=O)c3nonc3N)o2)cc1,C07541028_decoy,TRY1,Decoy,0,-8.41632,-8.66,-1.61,-7.062920048690725
Cc1c(C(=O)NCCCc2[nH][nH]c(=[NH2+])c2C#N)oc2c1ccc1ccccc12,C08734079_decoy,TRY1,Decoy,0,-9.75655,-8.23,-2.06,-8.180021424652306
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3Cc3ccc(O)c(O)c3)C(=O)Nc3ccccc32)cc1,C08790063_decoy,TRY1,Decoy,0,-8.60879,-9.4,-2.04,-10.381508236674724
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3Cc3ccc(O)c(O)c3)C(=O)Nc3ccccc32)cc1,C08790065_decoy,TRY1,Decoy,0,-8.53148,-6.88,-1.58,-6.216564386055066
[NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C12428234_decoy,TRY1,Decoy,0,-8.00641,-7.23,-2.13,-7.8486526511093935
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C08789697_decoy,TRY1,Decoy,0,-9.04752,-8.99,-1.56,-9.872757505151707
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1cccc(O)c1,C19925893_decoy,TRY1,Decoy,0,-8.51685,-7.73,-2.28,-7.927328360587703
COc1cc(/C=N/[NH+]=C(N)N)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C08426916_decoy,TRY1,Decoy,0,-7.20192,-7.0,-2.25,-5.594315921254864
Cc1cc(C)c2c(N)c(C(=O)OCc3nc(N)nc(N(C)C)n3)sc2[nH+]1,C23077150_decoy,TRY1,Decoy,0,-8.14115,-6.57,-2.88,-5.405955375350593
CCCN(CCC)C(=O)CCc1ccc(N2C(N)=NC(N)=[NH+]C2(C)C)cc1,C16954725_decoy,TRY1,Decoy,0,-9.63479,-6.67,-2.17,-5.991656402773046
CC(C)Cn1c(N)c(C(=O)C[NH2+][C@H](C)c2ccccc2Cl)c(=O)[nH]c1=O,C28955207_decoy,TRY1,Decoy,0,-7.83788,-6.88,-2.23,-5.726708188824312
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)[C@H]1CCCC[C@@H]1C,C31469373_decoy,TRY1,Decoy,0,-8.47797,-6.89,-2.13,-7.130137167067114
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)[C@H]1CCCC[C@H]1C,C31469381_decoy,TRY1,Decoy,0,-8.71719,-6.99,-3.1,-7.264992531889104
[NH-]C(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H]([NH2+]Cc3ccc(F)cc3)[C@@H]2O)CC1,C12529672_decoy,TRY1,Decoy,0,-6.08828,-7.6,-0.03,-5.092527127833036
COc1ccccc1N1N[NH2+]N[C@H]1SCc1nc2ccsc2c(=O)[nH]1,C39470314_decoy,TRY1,Decoy,0,-9.42325,-7.37,-0.79,-6.14021357934712
COc1ccccc1N1N[NH2+]N[C@@H]1SCc1nc2ccsc2c(=O)[nH]1,C39470315_decoy,TRY1,Decoy,0,-8.68952,-7.29,-1.42,-6.055903561337063
CC[NH+]1CCN(c2ncnc(NNC(=O)c3ccc(Cl)cc3)c2N)CC1,C40726711_decoy,TRY1,Decoy,0,-8.29852,-6.75,-0.96,-5.88510277175989
COc1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)c(OC)c1,C40754660_decoy,TRY1,Decoy,0,-7.14643,-6.01,-2.83,-4.8804039195238405
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1ccc2c(c1)OCCO2,C40756264_decoy,TRY1,Decoy,0,-7.88002,-6.12,-3.32,-4.924455534274402
CC(=O)Nc1ccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc1,C40756423_decoy,TRY1,Decoy,0,-8.29035,-5.73,-1.5,-5.867510476382464
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)c1ccsc1,C41648743_decoy,TRY1,Decoy,0,-8.71248,-6.68,-2.14,-7.448504343489968
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccsc1,C41648939_decoy,TRY1,Decoy,0,-8.10005,-6.02,-1.16,-5.561453418850546
O=C(NC1CC[NH+](C2CC2)CC1)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42892031_decoy,TRY1,Decoy,0,-8.54506,-6.41,-1.82,-6.969219788634945
CC1(C)CC(NC(=O)NNC(=O)COc2ccc(C#N)cc2)CC(C)(C)[NH2+]1,C42910432_decoy,TRY1,Decoy,0,-7.22046,-5.51,-1.97,-5.761382545731936
NC(=O)C[C@@H]([NH3+])c1cc([N+](=O)[O-])ccc1Sc1nc2cccnc2s1,C44254153_decoy,TRY1,Decoy,0,-8.87199,-6.43,-2.46,-7.456736131945493
CC(C)CNC(=O)NC(=O)C[NH+](C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1,C32542363_decoy,TRY1,Decoy,0,-7.42794,-5.86,-3.7,-5.122893112381091
C[NH+](CCCNC(=O)Nc1ccccc1OCCC(N)=O)CC(F)(F)F,C47878541_decoy,TRY1,Decoy,0,-6.99281,-5.98,-2.73,-7.299060543887691
C=CC[NH+](CC=C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)C(C)C,C48000403_decoy,TRY1,Decoy,0,-8.64671,-5.63,-3.4,-5.776253944683291
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1cccs1,C48743417_decoy,TRY1,Decoy,0,-7.59041,-6.76,-3.05,-6.189849272276623
CCNC(=O)NC(=O)[C@@H](C)[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C16556785_decoy,TRY1,Decoy,0,-7.54538,-5.37,-3.05,-5.444849302151639
C[C@H](C[NH+]1CCCC1)NS(=O)(=O)c1cc(Br)cnc1NN,C49186552_decoy,TRY1,Decoy,0,-7.66482,-4.61,-4.18,-5.280923987392857
C[NH+](C)C1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CCCC1,C49779962_decoy,TRY1,Decoy,0,-8.60007,-6.11,-1.31,-6.387458349565396
N/C(=[NH+]\N=C\c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)c1nonc1N,C09076205_decoy,TRY1,Decoy,0,-8.7598,-5.93,-3.94,-5.399118838556473
CCOc1ccccc1N1C(=O)NC(=O)/C(=C\N[C@@H]2CCCC[C@@H]2[NH3+])C1=O,C20266926_decoy,TRY1,Decoy,0,-8.06892,-6.93,-1.02,-6.387643129675478
CCOc1ccccc1N1C(=O)NC(=O)/C(=C\N[C@H]2CCCC[C@H]2[NH3+])C1=O,C20266932_decoy,TRY1,Decoy,0,-6.93838,-6.43,-2.29,-5.197914025102952
[NH3+][C@@H]1CCCC[C@H]1N/C=C1\C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393246_decoy1,TRY1,Decoy,0,-9.6448,-8.05,,-6.283335156125135
Cc1ccc2c(Nc3ncnc(NCCCn4cc[nH+]c4)c3N)cccc2n1,C40801533_decoy,TRY1,Decoy,0,-7.68093,-7.3,-0.82,-6.5860341735231405
CN/C(N)=N\c1ccc(-c2ccc(-c3ccc(N/C(N)=[NH+]/C)cn3)cc2)nc1,C40861630_decoy,TRY1,Decoy,0,-7.87777,-6.96,-1.55,-10.268537162855155
Cc1cc(C[NH+](C)Cc2nc(N)nc(N)n2)cc(C)c1OCC(F)(F)F,C54395213_decoy,TRY1,Decoy,0,-7.46851,-6.56,-1.11,-8.273598604359911
CCNc1cc(C)[nH+]c(NCCNC(=O)Nc2ccc3c(c2)OCCO3)n1,C62012614_decoy,TRY1,Decoy,0,-8.96123,-7.45,-0.57,-7.350906727254819
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C65104265_decoy,TRY1,Decoy,0,-7.51657,-7.64,-2.51,-6.223453428658655
Cc1nn(CCO)c(C)c1C[NH2+][C@@H](C)c1ccc(NC(=O)NC2CC2)cc1,C67189102_decoy,TRY1,Decoy,0,-7.39634,-6.77,-2.47,-5.039379116374104
Cc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(N)=O)c2)[NH+]2CCCC2)o1,C67308732_decoy,TRY1,Decoy,0,-7.89743,-6.84,-3.18,-6.873530982671259
Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(N)=O)c2)[NH+]2CCCC2)o1,C67308734_decoy,TRY1,Decoy,0,-8.32221,-7.56,-1.17,-6.922902609502915
COc1ccc(-c2n[nH]cc2CNc2nc(CC[NH3+])nc3ccccc23)cc1,C67540346_decoy,TRY1,Decoy,0,-8.88374,-6.95,-1.33,-8.01230674252946
OCC[NH+](C[C@H](O)Cn1ccc2ccccc21)C[C@@H](O)COCc1ccccc1,C09595085_decoy,TRY1,Decoy,0,-8.23488,-5.6,-2.15,-6.020735973555181
OCC[NH+](C[C@H](O)COCc1ccccc1)C[C@H](O)Cn1ccc2ccccc21,C09595089_decoy,TRY1,Decoy,0,-7.74495,-7.33,-1.73,-6.790036834252595
CC[NH+](CC(=O)NC(=O)NCc1ccco1)CC(=O)Nc1c(F)cccc1F,C16559790_decoy,TRY1,Decoy,0,-6.51083,-7.34,-2.27,-5.639307248229505
C[C@H](c1nnc(S[C@H](C)C(=O)NC(N)=O)n1-c1ccc(Cl)cc1)[NH+](C)C,C16927510_decoy,TRY1,Decoy,0,-9.14741,-7.1,-1.59,-7.807280183387088
Cc1n[nH]c(SCCNC(=O)C[C@@H]2C(=O)NCC[NH+]2CC2CCCCC2)n1,C19732749_decoy,TRY1,Decoy,0,-8.7127,-7.18,-2.3,-7.165352637820556
Cc1nnc(C[NH2+]Cc2ccc(OC[C@@H](O)C[NH+](C)Cc3ccccc3)cc2)[n-]1,C20363508_decoy,TRY1,Decoy,0,-7.12378,-6.64,-4.48,-5.506869023745808
NC(=O)c1ccsc1NC(=O)CN1CC[NH+](CC(=O)N2CCCCCC2)CC1,C22785963_decoy,TRY1,Decoy,0,-7.51937,-7.27,-3.15,-7.506234483365999
CC(C)[C@@H]([NH2+]CC(=O)N1CCc2cc(S(N)(=O)=O)ccc21)c1ccc(F)cc1,C27369601_decoy,TRY1,Decoy,0,-8.7175,-5.95,-3.08,-5.860923377454199
C[C@H](NCC1([NH+]2CCSCC2)CCCC1)C(=O)NC(=O)NCC(F)(F)F,C30514136_decoy,TRY1,Decoy,0,-8.54742,-6.75,-0.87,-7.064724244644756
CCN(CC)C(=O)C[NH+]1CCCN(CC(=O)Nc2sccc2C(N)=O)CC1,C31577716_decoy,TRY1,Decoy,0,-7.61733,-5.93,-1.43,-6.696064031616963
COc1c(Br)cc(Cl)cc1NC(=O)[C@@H]([NH3+])CCS(C)(=O)=O,C37019704_decoy,TRY1,Decoy,0,-7.85538,-4.61,-2.45,-5.160738558570726
CCN1C=C(C[NH+]2CCC[C@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)[C@@H](C)N1,C39538045_decoy,TRY1,Decoy,0,-8.85301,-6.92,-0.97,-5.904206629595613
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCCO)C2(CC[NH2+]CC2)C1,C39605384_decoy,TRY1,Decoy,0,-7.10375,-6.34,-1.04,-7.514500822322582
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H](C(=O)NCCCO)C2(CC[NH2+]CC2)C1,C39605385_decoy,TRY1,Decoy,0,-7.8103,-6.55,-1.68,-5.301449853515164
CC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631480_decoy,TRY1,Decoy,0,-9.39429,-6.1,-2.37,-6.250680564623567
Cn1cncc1C(=O)N1C[C@H](C(=O)NCCNc2ccccc2)C2(CC[NH2+]CC2)C1,C39655718_decoy,TRY1,Decoy,0,-7.76201,-5.73,-2.04,-5.560640309603108
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39683883_decoy,TRY1,Decoy,0,-8.07052,-5.89,-1.12,-6.03088415708272
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39683884_decoy,TRY1,Decoy,0,-8.20131,-5.76,-1.67,-6.17792184374661
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)[C@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39683886_decoy,TRY1,Decoy,0,-7.94629,-7.33,-2.47,-8.662962745639463
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cccnc2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685830_decoy,TRY1,Decoy,0,-8.68556,-5.62,-1.16,-6.085744066385849
CCCCCCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2[n+](CCO)c1N,C39841396_decoy,TRY1,Decoy,0,-7.70016,-6.54,-1.67,-5.831936274101484
CC[C@H](CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)[NH+]1CCc2ccccc2C1,C46310687_decoy,TRY1,Decoy,0,-8.04645,-6.48,-1.97,-6.131927388488053
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H](c1ccsc1)[NH+](C)C,C46347450_decoy,TRY1,Decoy,0,-8.18789,-6.29,-1.27,-5.764202010383893
COCC[NH+](C)CCCNC(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1,C48141770_decoy,TRY1,Decoy,0,-8.25031,-5.13,-3.45,-5.912389036390191
C[NH+](C)C[C@@H](CNC(=O)Nc1cccnc1-n1cccn1)[C@@H](O)c1ccccc1,C48197872_decoy,TRY1,Decoy,0,-8.45166,-6.81,-1.25,-7.706486637762425
C[NH+](CCNC(=O)C(=O)NNc1ccc(Cl)cc1Cl)Cc1ccccc1,C50605448_decoy,TRY1,Decoy,0,-8.52546,-7.4,-2.64,-6.382852786750158
CCn1c(N)c(C(=O)CN2CCC[NH+](Cc3ccccc3C)CC2)c(=O)[nH]c1=O,C52666731_decoy,TRY1,Decoy,0,-6.90695,-8.23,-1.79,-7.734470195186493
CCn1cc(-c2cc(NC[C@@H](c3ccc(F)cc3)[NH+]3CCCC3)nc(N)n2)cn1,C19718045_decoy,TRY1,Decoy,0,-8.40353,-5.89,-0.69,-6.14775105637277
CCCNC(=O)c1ccc(NC(=O)C(=O)NCC[NH+]2CCCCC2)cc1Cl,C54847243_decoy,TRY1,Decoy,0,-7.96138,-6.83,-4.43,-5.832622018439131
Cc1cc(-[n+]2c(SCC(=O)NCc3ccco3)nc3[nH]nc(C)c3c2N)ccc1Cl,C33862091_decoy,TRY1,Decoy,0,-10.7674,-8.84,-1.61,-11.514407874491786
C#Cc1cccc(NC(=O)CNC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)c1,C59855051_decoy,TRY1,Decoy,0,-9.36256,-7.4,-3.13,-6.654144467371568
C[C@@H](CNC(=O)NNC(=O)CCOc1ccccc1)[NH+]1CCc2ccccc2C1,C61865200_decoy,TRY1,Decoy,0,-8.53163,-6.47,-1.45,-5.690395761832599
C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CNCCC[NH+](CCO)CCO)[C@H]3C[C@@H]12,C61996999_decoy,TRY1,Decoy,0,-10.1065,-6.26,-3.98,-6.494173493584693
O=C(NCc1ccccc1C[NH+]1CCCC1)Nc1cc(C(F)(F)F)c[nH]c1=O,C63162290_decoy,TRY1,Decoy,0,-7.60128,-6.26,-1.38,-5.412737019358494
O=C(NCc1ccc(C[NH+]2CCCC2)cc1)Nc1cc(C(F)(F)F)c[nH]c1=O,C63162309_decoy,TRY1,Decoy,0,-6.65347,-7.55,-1.55,-6.45583632308243
CC1=C(CCC(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)[C@H](O)n2ncnc2N1,C63314848_decoy,TRY1,Decoy,0,-9.52299,-9.15,-1.52,-8.796826925459715
C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]23)C1,C63704049_decoy,TRY1,Decoy,0,-8.60938,-6.6,-2.96,-6.839265096046072
CC(=O)N[C@@H]1Nc2ccc(CC(=O)NCCC3=c4ccccc4=[NH+]C3)cc2S1,C64491144_decoy,TRY1,Decoy,0,-7.66247,-6.68,-1.99,-5.675146174701832
CC(=O)N[C@H]1Nc2ccc(CC(=O)NCCC3=c4ccccc4=[NH+]C3)cc2S1,C64491145_decoy,TRY1,Decoy,0,-9.22582,-7.81,-1.65,-6.60080945444911
CCC(=O)Nc1ccc([C@@H](C)NC(=O)Nc2ccc[nH+]c2N2CCOCC2)cc1,C54479816_decoy,TRY1,Decoy,0,-7.71954,-6.0,-2.16,-5.541523666360344
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)[NH+](C)C)cc1,C65476684_decoy,TRY1,Decoy,0,-7.55887,-5.94,-3.75,-6.10912560924819
COC(=O)C1=C(C)NC(COCC[NH3+])=C(C(=O)OC)[C@@H]1c1ccccc1Cl,C38358925_decoy,TRY1,Decoy,0,-7.49544,-5.2,-4.48,-7.148617436581156
CC(=O)Nc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)CC[NH+](C)C)cc2)cc1,C65755071_decoy,TRY1,Decoy,0,-7.34015,-6.2,-2.99,-5.5359088927604505
Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)N[C@@H](C)C(=O)NCc1ccco1,C65985041_decoy,TRY1,Decoy,0,-7.38728,-6.81,-0.87,-5.309375639221803
N/C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)=[NH+]\Cc1ccco1,C66244364_decoy,TRY1,Decoy,0,-8.13468,-5.76,-3.2,-5.27521606345424
CCOCC(=O)NNC(=O)N[C@@H](C)c1cc(F)ccc1N1CC[NH+](CC)CC1,C66702749_decoy,TRY1,Decoy,0,-7.35678,-6.1,-3.1,-5.34600133202278
C[NH+](CCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)CC(F)(F)F,C67164491_decoy,TRY1,Decoy,0,-8.75908,-6.03,-2.78,-7.121929356563543
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)C1,C67165573_decoy,TRY1,Decoy,0,-9.32944,-6.35,-1.18,-5.967593696585934
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2cc(N3CCOC3=O)ccc2F)CC1,C67549015_decoy,TRY1,Decoy,0,-9.14778,-6.7,-3.05,-5.702906076642256
C[C@H]1CCC[C@@](CNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)([NH+](C)C)C1,C67612884_decoy,TRY1,Decoy,0,-9.03176,-6.56,-1.75,-5.966895429158512
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C02126770_decoy,TRY1,Decoy,0,-7.42502,-6.62,-1.45,-5.986519993589077
Cc1ccc(Nc2nc(N)nc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C06831115_decoy,TRY1,Decoy,0,-7.14577,-6.57,-1.79,-5.49985510128373
Cc1ccc(Nc2nc(N)nc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C06831116_decoy,TRY1,Decoy,0,-7.06343,-6.37,-2.06,-5.901562609930479
NC(=O)c1cc(Nc2nc(C[NH+]3CCOCC3)nc3sc4c(c23)CCCC4)cc(C(N)=O)c1,C09492233_decoy,TRY1,Decoy,0,-9.51195,-8.26,-1.77,-9.444128214106602
Nc1nc(SCC[NH+]2CCCC2)[nH]c(=O)c1NC(=O)c1ccc(Br)o1,C10243492_decoy,TRY1,Decoy,0,-7.63389,-7.31,-2.4,-6.92222724188651
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3cccc(Cl)c3)C[NH+]12)NC1CC1,C12530547_decoy,TRY1,Decoy,0,-8.39165,-7.26,-1.69,-7.324137952751088
CCOC(=O)c1c(NC(=O)C[NH2+]Cc2ccc(F)cc2)sc(C(N)=O)c1C,C05938336_decoy,TRY1,Decoy,0,-8.73677,-6.57,-1.41,-6.811847589707746
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C12872418_decoy,TRY1,Decoy,0,-7.21731,-5.49,-1.23,-5.432689611534546
CC(C)[C@@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C13569229_decoy,TRY1,Decoy,0,-7.77007,-4.79,-2.23,-5.388899180285431
CC(C)[C@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C13569231_decoy,TRY1,Decoy,0,-7.36633,-7.37,-1.6,-6.533797920727043
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@H]([NH3+])CC(N)=O,C37769945_decoy,TRY1,Decoy,0,-7.43558,-6.8,-3.61,-8.41506503230236
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@H]([NH3+])CC(N)=O,C37769946_decoy,TRY1,Decoy,0,-7.37092,-6.63,-1.4,-9.793240655336366
CCc1cc([C@H]2[NH+]=NC(C)=C2c2ccc3c(c2)OCCO3)c(O)cc1OCC(=O)NN,C39030304_decoy,TRY1,Decoy,0,-7.69684,-8.24,-1.72,-7.971695193891073
CCc1cc([C@@H]2[NH+]=NC(C)=C2c2ccc3c(c2)OCCO3)c(O)cc1OCC(=O)NN,C39030305_decoy,TRY1,Decoy,0,-7.78645,-7.18,-2.08,-7.587736391398853
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NCc3ccc(CO)o3)C[NH+]12)Nc1ccccc1,C22922283_decoy,TRY1,Decoy,0,-8.41631,-7.74,-2.66,-6.243893692979436
CC1(C)CC(Nc2ncnc(NNC(=O)c3cccnc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645232_decoy,TRY1,Decoy,0,-7.10362,-8.3,-2.34,-9.55499434495919
C[NH+]1CCN(Nc2ncnc(NC(c3ccccc3)c3ccccc3)c2N)CC1,C40756927_decoy,TRY1,Decoy,0,-8.14493,-5.98,-1.14,-5.307521769685456
CC1(C)CC(Nc2ncnc(NNC(=O)Cc3ccccc3)c2N)CC(C)(C)[NH2+]1,C40760838_decoy,TRY1,Decoy,0,-7.79507,-6.8,-2.78,-5.543181408340447
CC(=O)Nc1ccc(Nc2ncnc(N3CC[NH+](Cc4ccc5c(c4)OCO5)CC3)c2N)cc1,C40798397_decoy,TRY1,Decoy,0,-8.53863,-7.82,-2.85,-5.526540464044095
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41791917_decoy,TRY1,Decoy,0,-8.26497,-7.23,-1.7,-6.688452142456101
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)Nc2ccc(N3CCOCC3)cc2)co1,C33898198_decoy,TRY1,Decoy,0,-9.37938,-7.39,-3.12,-9.983961858212378
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2cc(NC(C)=O)ccc2F)CC1,C44076919_decoy,TRY1,Decoy,0,-8.90978,-6.27,-2.15,-6.359036686086455
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2nnc(Nc3ccc(Cl)cc3)o2)co1,C44163257_decoy,TRY1,Decoy,0,-8.33813,-9.16,-1.25,-8.155960793389756
Cc1cc(C)c(NC(=O)C[NH+](C)[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(C)c1,C45645207_decoy,TRY1,Decoy,0,-7.55001,-6.74,-2.81,-5.76853124536677
CCc1ccccc1NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc1sccc1C(N)=O,C08493140_decoy,TRY1,Decoy,0,-7.08193,-6.24,-2.92,-5.285916861323061
CCc1ccccc1NC(=O)C[NH+](C)[C@H](C)C(=O)Nc1sccc1C(N)=O,C08493147_decoy,TRY1,Decoy,0,-6.59388,-6.53,-2.0,-5.122291024233394
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2ccc(NC(=O)OC)cc2)CC1,C46869010_decoy,TRY1,Decoy,0,-8.62299,-4.6,-3.01,-5.453609765967365
C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51047555_decoy,TRY1,Decoy,0,-9.13778,-5.91,-1.31,-5.701839033135585
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51047557_decoy,TRY1,Decoy,0,-8.62181,-6.11,-1.38,-6.107608453185261
CCC[C@@H](C)NC(=O)[C@@H]1CCC[NH+](CCC(=O)Nc2sccc2C(N)=O)C1,C51052611_decoy,TRY1,Decoy,0,-7.94294,-6.55,-1.01,-7.278420164175248
CC(C)(C)NC(=O)CN1CCC[NH+](CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CC1,C22935306_decoy,TRY1,Decoy,0,-7.78291,-7.73,-2.3,-7.671305752209544
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N/[NH+]=C1\CCCN1)c1cccs1,C03192046_decoy,TRY1,Decoy,0,-8.06683,-7.76,-2.28,-7.6806580980366705
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N/[NH+]=C1\CCCN1)c1cccs1,C03192050_decoy,TRY1,Decoy,0,-9.39171,-6.78,-0.93,-6.594183137577327
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C54946029_decoy,TRY1,Decoy,0,-9.87463,-7.62,-2.19,-7.623210518612741
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C54946032_decoy,TRY1,Decoy,0,-8.34408,-8.12,-1.47,-6.089217446699817
CC1(C)CC(NC(=O)CSc2nnc(-c3cccc([N+](=O)[O-])c3)n2N)CC(C)(C)[NH2+]1,C59790011_decoy,TRY1,Decoy,0,-7.32363,-7.58,-2.85,-5.555767702744561
NC(=O)c1ccsc1NC(=O)CN1C(=O)N[C@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63187674_decoy,TRY1,Decoy,0,-8.66016,-8.74,-2.11,-7.662470339224258
NC(=O)c1ccsc1NC(=O)CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63187675_decoy,TRY1,Decoy,0,-7.10778,-8.28,-1.8,-6.689810577086105
NC(=O)NC(=O)[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccccc1,C39938498_decoy,TRY1,Decoy,0,-7.85094,-7.48,-3.47,-7.086348533343485
NC(=O)NC(=O)[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccccc1,C39938499_decoy,TRY1,Decoy,0,-7.59168,-6.28,-1.22,-6.908316345771967
NC(=O)NC(=O)[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccccc1,C39938500_decoy,TRY1,Decoy,0,-8.43979,-8.28,-1.95,-10.922867599801858
NC(=O)NC(=O)[C@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccccc1,C39938501_decoy,TRY1,Decoy,0,-7.54603,-7.88,-1.4,-9.35502413936983
Cc1cc(OCC(N)=O)ccc1NC(=O)C(=O)NC[C@H](C)[NH+]1CCC(C)CC1,C65601486_decoy,TRY1,Decoy,0,-9.18697,-7.1,-2.05,-6.287002706879078
Cc1cc(OCC(N)=O)ccc1NC(=O)C(=O)N[C@H](C)C[NH+]1CCC[C@H](C)C1,C67397650_decoy,TRY1,Decoy,0,-7.81941,-7.89,-2.43,-5.84815884760277
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C67438769_decoy,TRY1,Decoy,0,-9.34177,-6.23,-1.51,-6.797567168792636
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C67438771_decoy,TRY1,Decoy,0,-9.61717,-8.01,-1.38,-9.009220320754592
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C67438774_decoy,TRY1,Decoy,0,-9.68447,-6.35,-1.97,-6.199261904019959
CC(/C=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+](C)C1CCCCC1)=C\c1ccco1,C04465016_decoy,TRY1,Decoy,0,-8.78062,-7.46,-2.8,-6.616485625249531
CC[NH+](CC)Cc1c(C(=O)N/N=C(\C)c2ccc(CC(C)C)cc2)nnn1-c1nonc1N,C09109286_decoy,TRY1,Decoy,0,-8.47496,-7.34,-3.51,-6.867346399821741
C[NH+](Cc1c(C(=O)N/N=C/C=C/c2ccccc2)nnn1-c1nonc1N)C1CCCCC1,C09308247_decoy,TRY1,Decoy,0,-9.44318,-5.81,-2.2,-6.415737292015371
CCOC(=O)c1c(NC(=O)C[NH+]2CCC(C(N)=O)CC2)sc(C(=O)OCCOC)c1C,C09539774_decoy,TRY1,Decoy,0,-9.24799,-6.84,-3.44,-7.307007618582569
CC[NH+](CC)CCNC(=O)[C@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)c(Cl)c1,C03665920_decoy,TRY1,Decoy,0,-6.92736,-5.98,-1.69,-6.300972933939764
CC[NH+](CC)CCNC(=O)[C@@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)c(Cl)c1,C03665919_decoy,TRY1,Decoy,0,-9.42032,-5.88,-4.31,-6.30027321428339
CC(C)[NH+]1CCc2c(sc(NC(=O)CCCS(=O)(=O)c3ccccc3)c2C(N)=O)C1,C09911318_decoy,TRY1,Decoy,0,-8.69243,-7.14,-2.0,-6.085742052813292
CC[NH+]1CCc2c(sc(NC(=O)CCCS(=O)(=O)c3ccc(C)cc3)c2C(N)=O)C1,C09911524_decoy,TRY1,Decoy,0,-9.42801,-7.27,-1.94,-6.600992364326127
COc1cccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(C(F)(F)F)c4)CC3)n2)c1,C09971240_decoy,TRY1,Decoy,0,-8.02958,-6.73,-1.53,-5.103210217352281
CC[NH+](CC)CCCNC(=O)C(=O)Nc1c(C(=O)Nc2ccccc2C)oc2ccccc12,C09705840_decoy,TRY1,Decoy,0,-8.62173,-6.38,-1.49,-7.232868214820438
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NC2CC[NH+](CC(N)=O)CC2)CC1,C14482369_decoy,TRY1,Decoy,0,-7.49226,-6.48,-3.22,-4.901821033043481
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2,C14922660_decoy,TRY1,Decoy,0,-8.93826,-7.89,-2.7,-6.7217571899147766
COc1cc(C[NH+]2CCC(O)(c3ccc4oc(C(=O)NCC(C)C)cc4c3)CC2)ccc1O,C14989484_decoy,TRY1,Decoy,0,-9.09495,-6.38,-2.31,-7.425989874261176
CCCCN(C(=O)C[NH+](C)CCOc1ccccc1F)c1c(N)n(CCC)c(=O)[nH]c1=O,C15046067_decoy,TRY1,Decoy,0,-7.06855,-4.63,-4.29,-4.986315129399146
CCc1ccccc1NC(=O)C[NH+](C)[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C15294886_decoy,TRY1,Decoy,0,-7.59236,-7.64,-3.49,-6.925031227795747
O=C1NC[C@@H](CCC(=O)N2CCCC2)[NH+]2C[C@@H](NC(=S)Nc3ccc(Cl)cc3)C[C@@H]12,C15707546_decoy,TRY1,Decoy,0,-7.70908,-7.38,-1.27,-5.809725382978429
CN(C)c1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCCC2)cc1,C15879904_decoy,TRY1,Decoy,0,-9.73225,-5.69,-1.97,-6.41522194830588
CCOc1ccc(C(=O)NCCC(=O)N2CCC3(CC2)[NH2+]CCc2[nH]cnc23)cc1OCC,C09409964_decoy,TRY1,Decoy,0,-7.86917,-7.42,-1.9,-6.501293657361528
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccc(N(C)C)cc2)nnn1-c1nonc1N,C03633023_decoy,TRY1,Decoy,0,-8.77282,-5.22,-1.63,-6.111808373395395
COC(=O)c1c(NC(=O)C[NH+]2CCN(c3ccc(Cl)cc3)CC2)sc(C(N)=O)c1C,C20295013_decoy,TRY1,Decoy,0,-9.35738,-7.26,-2.47,-7.052049730714157
O=S(=O)(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N1CCN(c2cccc[nH+]2)CC1)c1cccs1,C20465619_decoy,TRY1,Decoy,0,-7.5512,-7.45,-0.81,-5.858541649821407
CC[NH+](CC)CCCNC(=S)NNC(=O)c1ccc(COc2ccc(Cl)cc2C)o1,C20613909_decoy,TRY1,Decoy,0,-9.04654,-6.69,-3.19,-6.226791248421986
CC[C@H](Sc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccc(C)c(Cl)c1)C(=O)NCCOC,C02927025_decoy,TRY1,Decoy,0,-9.51149,-6.03,-1.38,-9.259796870867214
CC(C)(C)NC(=O)COc1ccc2ccccc2c1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1,C20872957_decoy,TRY1,Decoy,0,-8.42463,-7.15,-3.85,-7.355263629838689
C[NH+]1CCN(c2nc(N/N=C/c3ccc(O)cc3)nc(Nc3ccc([N+](=O)[O-])cc3)n2)CC1,C21964849_decoy,TRY1,Decoy,0,-8.31788,-9.45,-1.22,-7.416065169976887
CCOC(=O)C1=C(C[NH+]2CCNC(=O)[C@H]2c2c(C)nn(-c3ccccc3)c2C)NC(=O)NC1,C24215331_decoy,TRY1,Decoy,0,-7.39098,-5.84,-3.13,-5.586281567561073
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1=O,C24808724_decoy,TRY1,Decoy,0,-7.85895,-7.51,-1.14,-6.880090650838386
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1=O,C24808731_decoy,TRY1,Decoy,0,-7.95886,-8.11,-2.5,-7.524037995684691
CC(C)Cn1c(N)c(C(=O)C[NH+]2CCN(c3ccc(C(F)(F)F)cn3)CC2)c(=O)[nH]c1=O,C28962187_decoy,TRY1,Decoy,0,-6.49989,-7.05,-1.85,-7.618813952699514
CCCCN(C(=O)C[NH+](C)[C@@H](C)c1ccc(Cl)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C36734392_decoy,TRY1,Decoy,0,-7.95403,-5.67,-2.18,-5.236132467269622
CCCCN(C(=O)C[NH+](C)[C@H](C)c1ccc(Cl)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C36734395_decoy,TRY1,Decoy,0,-7.45972,-7.07,-1.72,-8.931393558138137
COc1ccc(-n2nc3nc(NCC[NH+]4CCCC4)nc(-c4cccc(Cl)c4)c3c2N)cc1,C37359019_decoy,TRY1,Decoy,0,-9.40323,-8.08,-0.03,-7.250370875151955
CC(=C/c1ccccc1)/C=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCC(C)CC1,C04466155_decoy,TRY1,Decoy,0,-8.41424,-6.87,-3.58,-7.396703640459055
Nc1nc(C[NH+]2CCN(C(c3ccccc3)c3ccccc3)CC2)nc(Nc2ccccc2)n1,C19891080_decoy,TRY1,Decoy,0,-6.92076,-7.99,-1.45,-6.712071041989302
CC1CC[NH+](Cc2c(C(=O)N/N=C/c3ccc(C(C)C)cc3)nnn2-c2nonc2N)CC1,C03633151_decoy,TRY1,Decoy,0,-9.34368,-6.42,-3.18,-7.321689184146747
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39601656_decoy,TRY1,Decoy,0,-8.7812,-8.16,-1.51,-6.672088637146633
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C39631379_decoy,TRY1,Decoy,0,-8.88137,-6.61,-1.68,-6.8780737006433466
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2cccnc2Cl)CC12CC[NH2+]CC2,C39631469_decoy,TRY1,Decoy,0,-9.66574,-7.04,-1.46,-8.337335847780974
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NCCNc2ccccc2)C2(CC[NH2+]CC2)C1,C39655414_decoy,TRY1,Decoy,0,-7.54855,-7.2,-1.8,-6.243986486342751
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39693457_decoy,TRY1,Decoy,0,-9.19029,-5.99,-3.07,-5.997090753345061
CC(C)c1ccc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCC[C@@H]2C)cc1,C33923913_decoy,TRY1,Decoy,0,-8.24342,-8.25,-3.41,-7.314135769783219
C[C@H]1CCCC[NH+]1Cc1c(C(=O)N/N=C\c2ccc(N(C)C)cc2)nnn1-c1nonc1N,C33923758_decoy,TRY1,Decoy,0,-9.05419,-5.4,-2.65,-5.854143233517951
C=CCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)NCCN3CCOCC3)[C@H](O)[C@H]1[C@@H]2C,C43548287_decoy,TRY1,Decoy,0,-11.2936,-6.03,-2.99,-7.634065752308608
COc1ccc2nccc(NCC3(O)CCC([NH2+]Cc4cc5c(cn4)OCCO5)CC3)c2n1,C45192399_decoy,TRY1,Decoy,0,-8.90671,-8.73,-3.45,-6.788653242538948
CC[C@@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(C)c(Cl)c1)C(=O)NCCOC,C33672668_decoy,TRY1,Decoy,0,-9.64561,-7.72,-0.4,-10.507405365748763
CC[NH+](CC)[C@H](CNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1)c1ccccc1Cl,C58620492_decoy,TRY1,Decoy,0,-8.13509,-6.71,-3.14,-5.8282367082969495
C[NH+](C)CCOc1ccccc1C(=O)NCCCc1nn(-c2ccc(F)cc2)c(N)c1C#N,C59003396_decoy,TRY1,Decoy,0,-7.55038,-8.56,-2.05,-6.865206615175128
CC[C@@]1(C)NC(=O)N(NC(=O)CS[C@@H]2NN=C(C3=c4ccccc4=[NH+]C3)N2C2CC2)C1=O,C39934520_decoy,TRY1,Decoy,0,-9.00963,-7.41,-1.47,-7.347250671395548
CCOCC[C@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557272_decoy,TRY1,Decoy,0,-8.49917,-5.95,-1.44,-5.951401827251667
CCCN1C(=O)c2sccc2N2[C@H](CCC(=O)NCCC3=c4ccccc4=[NH+]C3)NN[C@@H]12,C64461290_decoy,TRY1,Decoy,0,-8.36395,-8.4,-0.79,-7.709255498666635
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3CCC(N)=O)C(=O)Nc3c(C)cc(Cl)cc32)cc1,C02132094_decoy,TRY1,Decoy,0,-8.70436,-8.03,-1.85,-8.096199541151588
O=C(C[NH+]1CCC(C(=O)N/N=C/c2ccc(O)cc2)CC1)N/N=C/c1ccc(O)cc1,C05569268_decoy,TRY1,Decoy,0,-8.52031,-8.45,-0.72,-7.003356416792009
COC(=O)CSc1cc(Cl)c(C)cc1S(=O)(=O)Nc1n[nH]c(=[NH2+])[nH]1,C08651881_decoy,TRY1,Decoy,0,-9.59307,-7.67,-3.14,-10.611526760993756
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C08788919_decoy,TRY1,Decoy,0,-8.99438,-7.84,-1.69,-8.328702162869547
COCCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C09042914_decoy,TRY1,Decoy,0,-9.96533,-7.77,-1.62,-7.451404078625786
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C09593829_decoy,TRY1,Decoy,0,-6.9948,-6.82,-1.86,-5.57869588379352
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccc(F)cc3F)C[NH+]12)Nc1ccccc1,C12530509_decoy,TRY1,Decoy,0,-9.15613,-6.49,-3.06,-6.512111683933106
NC(=O)c1c(NC(=O)C[NH+]2CCC(C(=O)Nc3ccccc3O)CC2)sc2c1CCC2,C15042829_decoy,TRY1,Decoy,0,-7.82653,-7.33,-1.64,-6.3603283555532215
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccsc3)C[NH+]12,C15707417_decoy,TRY1,Decoy,0,-7.68425,-5.15,-1.07,-5.783163688469312
COc1ccc(C[C@@H]([NH3+])C(=O)N[C@@H]2[C@@H](O)[C@@H](n3cnc4c(N(C)C)ncnc43)O[C@H]2CO)cc1,C16889884_decoy,TRY1,Decoy,0,-7.85117,-5.84,-1.69,-5.241291040367982
C[NH+](CCc1ccccn1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccsc1,C20465887_decoy,TRY1,Decoy,0,-7.27538,-5.63,-1.07,-5.817485614317164
NC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@H]2[C@@H]1S/C(=[NH+]\CCN1CCOCC1)N2Cc1ccc(F)cc1,C08296046_decoy,TRY1,Decoy,0,-10.5714,-6.73,-2.26,-7.261853641200488
Cc1nc(N2CCN(CCO)CC2)cc(Nc2ncc(C(=O)Nc3c(Cl)cccc3CO)s2)[nH+]1,C22060813_decoy,TRY1,Decoy,0,-11.2121,-6.47,-3.2,-6.95050223010367
CCOC(=O)C1=C(C[NH+](C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)NC(=O)NC1,C25795740_decoy,TRY1,Decoy,0,-7.21854,-7.1,-2.28,-5.536330606135021
COc1ccccc1NC(=O)C1CC[NH+](CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)CC1,C29907932_decoy,TRY1,Decoy,0,-8.06677,-7.04,-3.32,-6.245591930080984
COc1ccc(C[NH2+][C@H]2[C@H](O)[C@@H]([NH+]3CCC(C([NH-])=O)CC3)[C@@H]3OC[C@H]2O3)cc1,C20463880_decoy,TRY1,Decoy,0,-8.16048,-5.65,-1.15,-5.832862981417366
CCCn1c(N)c(C(=O)C[NH+](C)CC(=O)Nc2cccc(F)c2)c(=O)[nH]c1=O,C06785426_decoy,TRY1,Decoy,0,-6.08885,-6.77,-2.03,-5.303832753143319
COc1ccc(C[C@@H]([NH3+])C(=O)N[C@@H]2[C@@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1,C04245643_decoy,TRY1,Decoy,0,-7.80589,-4.78,-0.95,-5.06928521780458
CCOC(=O)[C@H]1NN[NH+](Cc2ccc(C)cc2)[C@H]1NC(=O)CSc1nc[nH]n1,C39290205_decoy,TRY1,Decoy,0,-7.2262,-7.17,-1.67,-6.742538252036264
COc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)[C@@H]4C=C(C)N(C)N4)CC34CC[NH2+]CC4)c2c1,C39599502_decoy,TRY1,Decoy,0,-9.23051,-8.62,-2.26,-7.632306231462984
COC(=O)[C@@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H]([NH3+])CCCCNC(=O)C(F)(F)F,C39951605_decoy,TRY1,Decoy,0,-8.4965,-6.13,-2.86,-6.689420676621194
COc1cc(Br)cc(C[NH2+]CCNC(=O)c2nonc2N)c1OC,C40744440_decoy,TRY1,Decoy,0,-7.50255,-7.06,-0.7,-9.220469097824438
Nc1c(NNC(=O)c2ccco2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40794503_decoy,TRY1,Decoy,0,-8.09987,-5.65,-1.43,-5.047166538227601
C[NH+](C)CCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1,C41026384_decoy,TRY1,Decoy,0,-7.71316,-6.63,-3.35,-6.969912423290579
CC1(C)CC(NC(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C42895946_decoy,TRY1,Decoy,0,-7.99781,-5.54,-1.55,-6.118290440972701
CCOC(=O)C1=C(CS/C(N)=[NH+]/C2CCCC2)NC(=O)N[C@@H]1c1ccco1,C44792964_decoy,TRY1,Decoy,0,-7.81157,-5.12,-3.49,-5.707544552396282
CCOC(=O)C1=C(CS/C(N)=[NH+]/C2CCCC2)NC(=O)N[C@H]1c1ccco1,C44792966_decoy,TRY1,Decoy,0,-6.70654,-6.35,-2.82,-5.271883913817953
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C44963769_decoy,TRY1,Decoy,0,-7.70573,-6.84,-2.7,-7.448105035088238
CC(C)n1cnc2c(NCc3ccc(-n4cccn4)nc3)nc(NC3CCC([NH3+])CC3)nc21,C45245817_decoy,TRY1,Decoy,0,-11.6414,-7.93,-3.21,-8.090294575886569
CCCNC(=O)C[NH+]1CCC(NC(=O)NNC(=O)c2ccccc2Cl)CC1,C46869609_decoy,TRY1,Decoy,0,-8.46686,-5.73,-3.75,-5.654656855997166
CC1CC[NH+]([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2cccs2)CC1,C49790481_decoy,TRY1,Decoy,0,-8.8546,-5.62,-3.21,-6.0734189709555455
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2ccc(F)c(C(=O)NC)c2)CC1,C50088377_decoy,TRY1,Decoy,0,-8.30272,-6.77,-1.47,-6.595568390300517
COc1ccccc1NC(=[NH2+])Nc1nc(CSc2nnc(C)s2)cc(=O)[nH]1,C08993692_decoy,TRY1,Decoy,0,-7.24524,-6.39,-2.49,-5.784018559019066
CC(C)(CO)[NH2+]CC(=O)NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-],C59447185_decoy,TRY1,Decoy,0,-5.85883,-6.38,-1.84,-4.9526439155273145
NC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63161119_decoy,TRY1,Decoy,0,-8.18037,-7.37,-1.92,-6.1911337671095765
CC(=O)Nc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@@H]2Nc2ccc(S(N)(=O)=O)cc2)cc1,C39976444_decoy,TRY1,Decoy,0,-7.31895,-8.11,-1.95,-6.227518521942698
O=C(C[C@H]1NO[C@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1)Nc1ccccc1,C63782406_decoy,TRY1,Decoy,0,-7.6722,-8.25,-0.28,-7.021214212923894
CC(=O)Nc1ccccc1OC[C@H]1NO[C@H](C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)N1,C63786515_decoy,TRY1,Decoy,0,-8.12543,-7.69,-2.17,-6.878034187068828
CC1=NNNN1c1cccc(NC(=O)C(=O)NCCC2=c3ccccc3=[NH+]C2)c1,C63807457_decoy,TRY1,Decoy,0,-7.87006,-8.64,-0.73,-7.51448237695188
CCCCN(C(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1c(N)n(CCC)c(=O)[nH]c1=O,C64055381_decoy,TRY1,Decoy,0,-8.96156,-8.17,-3.17,-7.902564758387927
Cc1[nH]c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)c(C)c1C(=O)OC(C)C,C64886583_decoy,TRY1,Decoy,0,-7.476,-4.93,-2.86,-4.914065212936931
CC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C33902780_decoy,TRY1,Decoy,0,-6.3207,-4.11,-2.19,-4.365328649180349
CCCCCCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115429_decoy,TRY1,Decoy,0,-7.93511,-6.42,-3.37,-8.05748547055352
CCCCCCOc1c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cccc1OC,C66115430_decoy,TRY1,Decoy,0,-8.19843,-4.87,-1.48,-6.172318153230408
O=C1C(=O)N(CC[NH2+]CCO)[C@H](c2cccnc2)/C1=C(\O)c1ccc(Cl)cc1,C06548213_decoy,TRY1,Decoy,0,-8.03582,-5.28,-0.92,-6.059491037098572
C[NH+]1CCN([C@@H]2[C@H](O)[C@H](CO)O[C@@H]2CNS(=O)(=O)c2ccc(F)cc2)CC1,C20465146_decoy,TRY1,Decoy,0,-7.42569,-6.43,-1.4,-5.268621313588694
Cc1cc(CN2CC[NH+](Cc3nc(N)nc(Nc4ccc(F)cc4)n3)CC2)on1,C27562981_decoy,TRY1,Decoy,0,-7.34225,-8.25,-1.25,-6.8019236124553215
Cc1ccc(-[n+]2c(SCC(=O)NC[C@@H]3CCCO3)nc3n[nH]c(C)c3c2N)cc1Cl,C36383575_decoy,TRY1,Decoy,0,-10.8328,-8.3,-1.61,-11.778669519085314
O=S(=O)(NCCNc1cc(C2CC[NH2+]CC2)ncn1)c1ccc(Cl)cc1,C39405706_decoy,TRY1,Decoy,0,-9.46182,-6.76,-2.05,-5.926963915586821
CCCNC(=O)C[NH+]1CCC(NC(=O)C(=O)Nc2ccc(C)c(Cl)c2)CC1,C41825820_decoy,TRY1,Decoy,0,-7.9167,-6.18,-4.98,-5.218597772760571
CCC[C@@H](C(=O)NCC[NH+](C)C)n1c(-c2cccc(C#N)c2)cc(C(N)=O)c1C,C44144965_decoy,TRY1,Decoy,0,-7.62182,-5.53,-4.05,-6.703552577429881
C[NH+](CCCNC(=O)NNC(=O)COc1ccccc1C#N)Cc1ccccc1,C45126002_decoy,TRY1,Decoy,0,-7.33313,-5.65,-1.58,-5.8466319209343
C[NH+](CCCNC(=O)Nc1cc2c(cc1Cl)NC(=O)CO2)CC(F)(F)F,C46007623_decoy,TRY1,Decoy,0,-8.24656,-6.96,-3.02,-6.245231463502
CC(C)C[C@H](CNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)N1CC[NH+](C)CC1,C49737894_decoy,TRY1,Decoy,0,-8.31918,-7.67,-1.7,-8.081532017180104
CC[NH+]1CCN(CCCCNC(=O)NNC(=O)COc2ccccc2F)CC1,C46755705_decoy,TRY1,Decoy,0,-8.79986,-6.6,-1.79,-6.2642011251015335
Cc1ccc(C[C@H]2CCC[NH+](CC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)C2)cc1,C51063923_decoy,TRY1,Decoy,0,-7.02571,-8.62,-1.78,-6.759880969968791
Nc1nc(Cl)cc(NCCS(=O)(=O)N2CCN(c3cccc[nH+]3)CC2)n1,C52100362_decoy,TRY1,Decoy,0,-7.64946,-7.94,-1.17,-5.837172237915175
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)Nc1cccc(-c2c[nH+]co2)c1,C52472504_decoy,TRY1,Decoy,0,-9.23245,-6.02,-2.11,-7.079358669182544
CC(C)OC(=O)c1c(NC(=O)[C@@H](C)[NH+](C)CC(N)=O)sc2c1CC[C@@H](C)C2,C52831410_decoy,TRY1,Decoy,0,-7.81564,-5.66,-2.4,-5.407900983592284
Cc1cccc(NC(=O)C2CC[NH+](CC(=O)NC(=O)NCc3ccco3)CC2)n1,C53162353_decoy,TRY1,Decoy,0,-7.73995,-7.33,-0.48,-5.248620358039726
CCCCN(C(=O)C[NH+](C)CCC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C53363775_decoy,TRY1,Decoy,0,-7.65968,-5.65,-2.92,-5.6199694423118665
CCn1cc(-c2cc(NC[C@H](c3ccc(F)cc3)[NH+]3CCCC3)nc(N)n2)cn1,C19718044_decoy,TRY1,Decoy,0,-7.94582,-6.6,-1.9,-6.786395235772807
CCn1c(N)c(C(=O)C[NH+](C)CCCOc2cccc(Cl)c2)c(=O)[nH]c1=O,C53741461_decoy,TRY1,Decoy,0,-6.98429,-6.9,-2.0,-7.344238195347457
O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)NNC(=O)[C@H]1CCS(=O)(=O)C1,C54038821_decoy,TRY1,Decoy,0,-8.72389,-6.26,-1.68,-5.625322957727577
O=C(NCCCCn1cc[nH+]c1)NNC(=O)c1ccc(F)cc1Br,C57373162_decoy,TRY1,Decoy,0,-7.38907,-7.0,-1.76,-6.151152908406965
Cc1ccc(Cl)cc1-[n+]1c(SCC(=O)NC[C@@H]2CCCO2)nc2[nH]nc(C)c2c1N,C33620582_decoy,TRY1,Decoy,0,-9.94093,-7.24,-0.85,-8.830479462196953
Cc1ccc(Cl)cc1-[n+]1c(SCC(=O)NC[C@H]2CCCO2)nc2[nH]nc(C)c2c1N,C33620584_decoy,TRY1,Decoy,0,-10.5583,-6.95,-1.1,-8.621118707487286
CC[C@@H](C)NC(=O)CSc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccccc1Cl,C33692121_decoy,TRY1,Decoy,0,-8.00559,-8.06,-2.54,-7.896337744241899
CCC[NH+](CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)[C@@H]1CCc2ccccc2C1,C60039709_decoy,TRY1,Decoy,0,-8.85916,-5.94,-3.17,-6.511897802982818
CCCc1ccc(-c2cc(NC(=O)NCCCn3cc[nH+]c3)n(CCO)n2)cc1,C60330587_decoy,TRY1,Decoy,0,-7.99481,-7.42,-3.59,-6.094933784570558
COc1cc(/[NH+]=c2/oc3c(C)ncc(CO)c3cc2C(N)=O)cc(OC)c1OC,C13136955_decoy1,TRY1,Decoy,0,-7.809,-4.81,,-5.151313251044654
CCNC(=O)NC(=O)[C@@H](C)S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39763567_decoy,TRY1,Decoy,0,-8.28019,-5.65,-3.36,-5.856645859854659
COc1ccc2c(c1)=[NH+][C@@H](C(=O)NCCC(=O)N[C@H]1Nc3ccccc3S1)C=2,C63295819_decoy,TRY1,Decoy,0,-8.18351,-7.38,-1.89,-5.785826926315841
COc1cc(/[NH+]=c2\oc3c(C)ncc(CO)c3cc2C(N)=O)cc(OC)c1OC,C13136955_decoy2,TRY1,Decoy,0,-8.27633,-4.81,,-5.270095948553808
NC(=O)[C@@H]1CCC[NH+](Cc2ccccc2NC(=O)C2=NN=C(c3ccccc3)C2)C1,C63991129_decoy,TRY1,Decoy,0,-7.68294,-5.9,-3.22,-5.661608409394084
COc1ccc(CN2NC=C3[C@H](c4[nH+]c[nH]c4C)CC(=O)N[C@H]32)c(OC)c1OC,C65430274_decoy,TRY1,Decoy,0,-9.43794,-7.39,-2.96,-9.521131790961435
COc1ccc(CN2NC=C3[C@H]2NC(=O)C[C@@H]3c2[nH+]c[nH]c2C)c(OC)c1OC,C65430279_decoy,TRY1,Decoy,0,-9.02235,-7.0,-2.56,-7.291314920161135
COC(=O)C1=C(C)NC(COCC[NH3+])=C(C(=O)OC)[C@H]1c1ccccc1Cl,C38358924_decoy,TRY1,Decoy,0,-8.13754,-5.3,-2.44,-9.215971140447364
Cc1ccc(-c2n[nH]cc2C[NH2+]CCNS(=O)(=O)c2cccc(Cl)c2)o1,C65978226_decoy,TRY1,Decoy,0,-8.09477,-6.7,-2.44,-5.785809021866819
COc1cc(C[NH2+]C[C@H](C(C)C)N2CCOCC2)cc(OC)c1OCC(N)=O,C25312645_decoy,TRY1,Decoy,0,-7.96806,-5.95,-2.51,-5.753110293472423
COc1cc(C[NH2+]C[C@@H](C(C)C)N2CCOCC2)cc(OC)c1OCC(N)=O,C25312641_decoy,TRY1,Decoy,0,-7.77941,-5.35,-2.85,-5.458214188995661
C[C@@H](C(=O)NC(=O)NCC(F)(F)F)[NH+](C)CC(=O)Nc1cc(F)cc(F)c1,C66836490_decoy,TRY1,Decoy,0,-7.42445,-7.43,-1.68,-7.29849857670564
CC(=O)Nc1ccc(NC(=O)C[NH+]2CCC(NC(=O)c3ccoc3C)CC2)cc1,C66891295_decoy,TRY1,Decoy,0,-8.22553,-7.52,-2.12,-6.508473628100497
CC[NH+](CC)[C@@H](CNC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1)c1ccco1,C67275277_decoy,TRY1,Decoy,0,-8.88168,-6.17,-1.56,-7.72482824111546
CC[NH+](CC)[C@@H](CNC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1)c1ccco1,C67275281_decoy,TRY1,Decoy,0,-6.91757,-7.61,-2.46,-7.253219495704292
COc1ccc(-c2n[nH]cc2C[NH2+][C@H](C)c2ccc(OCCO)c(OC)c2)cc1,C67449378_decoy,TRY1,Decoy,0,-7.90406,-5.69,-3.44,-5.6643609911082775
CNC(=O)[C@@H]1C[C@H](n2cc(CNS(=O)(=O)c3cc(C)ccc3F)nn2)C[NH2+]1,C67515397_decoy,TRY1,Decoy,0,-8.57851,-6.72,-3.25,-5.713463828151101
C[NH+](C)CCn1c(=O)oc2ccc(NC(=O)NCCCNc3ccccc3)cc21,C67550656_decoy,TRY1,Decoy,0,-7.20267,-6.64,-1.67,-5.598643639954946
CCC[NH+]1Cc2cccc(NC(=O)C(=O)N[C@@H](C)C(=O)NCc3ccco3)c2C1,C67558949_decoy,TRY1,Decoy,0,-8.11274,-6.53,-2.7,-6.719993892134927
CC1CC[NH+](C[C@@H](O)CNC(=O)NCC2(N3CCOCC3)CCCCC2)CC1,C67582707_decoy,TRY1,Decoy,0,-9.24072,-5.33,-2.59,-5.891054855157058
COc1cccc(OC)c1OC[C@@H](O)CNC(=O)NC1CC[NH+](C(C)C)CC1,C67589883_decoy,TRY1,Decoy,0,-8.8712,-6.11,-1.75,-6.82304625823387
CCC(CC)(CNC(=O)NC[C@H](O)COc1c(OC)cccc1OC)[NH+](C)C,C67603166_decoy,TRY1,Decoy,0,-7.94844,-5.88,-3.7,-5.411109959959227
COc1ccc(CNC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c(OC)c1OC,C67628982_decoy,TRY1,Decoy,0,-9.44552,-6.14,-2.89,-6.624863743392605
COc1ccc(CNC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)c(OC)c1OC,C67628985_decoy,TRY1,Decoy,0,-7.40607,-6.46,-2.93,-5.48387896644678
CCOC(=O)[C@H]1/C(=C\Sc2nnc(N)[nH]2)NC(=O)N[C@H]1c1cccs1,C03450576_decoy,TRY1,Decoy,0,-8.29025,-4.7,-2.76,-5.476992596058772
Cc1ccc(N(CC(=O)NC(C)(C)C)C(=O)c2snc(C(N)=O)c2N)cc1,C04188505_decoy,TRY1,Decoy,0,-8.5211,-5.72,-1.74,-5.994660338646338
C[C@@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)C1CCCC1,C04192190_decoy,TRY1,Decoy,0,-7.88081,-7.35,-2.26,-9.89711613678571
O=C(NC(=O)c1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)nn1)Nc1ccc(Cl)cc1,C05412411_decoy,TRY1,Decoy,0,-8.69988,-8.66,-1.21,-14.407021824516216
COc1cc(/C=N/NC(=O)c2cc(O)c(O)c(O)c2)cc(Br)c1O,C05526590_decoy,TRY1,Decoy,0,-8.58217,-5.84,-1.32,-7.299127841350993
Cc1cc(S(=O)(=O)Nc2n[nH]c(=[NH2+])[nH]2)c(SCC(=O)[O-])cc1Cl,C08651878_decoy,TRY1,Decoy,0,-8.96644,-7.47,-1.6,-9.640280228508413
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2cccs2)n1N,C08724748_decoy,TRY1,Decoy,0,-8.8028,-7.0,-2.53,-7.1420427979715
COc1c(O)cc(/C=N/NC(=O)C(=O)NN)cc1I,C08815976_decoy,TRY1,Decoy,0,-7.75326,-4.33,-1.14,-5.058969181123206
N#C/C(=C/c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)c1[nH]nc(N)c1C#N,C08995389_decoy,TRY1,Decoy,0,-9.10962,-7.25,-1.91,-7.227662816253814
CC[C@H](Sc1nc(N)cc(N)n1)C(=O)Nc1nnc(C(F)(F)F)s1,C08814454_decoy,TRY1,Decoy,0,-8.845,-5.79,-1.39,-5.882979564752425
Cc1[nH]nc2c1[C@H](c1cc(CSc3nnc(N)s3)cs1)C(C#N)=C(N)O2,C12444773_decoy,TRY1,Decoy,0,-9.52488,-7.07,-3.01,-5.631453759069201
CCc1nc(N)c2nc(N3CCCCC3)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1,C05797568_decoy,TRY1,Decoy,0,-7.2751,-4.91,-1.99,-5.186314084837829
NC(=O)N/N=C(/c1nc2ccccc2[nH]c1=O)[C@H](O)c1ccc([N+](=O)[O-])cc1,C05398901_decoy,TRY1,Decoy,0,-7.51123,-5.36,-1.58,-5.145522838517864
NC(=O)c1ccccc1NC(=O)Cc1csc(NC(=O)[C@@H]2CCC(=O)N2)n1,C13574954_decoy,TRY1,Decoy,0,-8.17644,-7.24,-1.93,-5.741581026700856
CCc1nc(N)c2nc(N3CCCCC3)n([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c2n1,C15220999_decoy,TRY1,Decoy,0,-7.00512,-5.16,-1.66,-4.6022371451039845
CCc1cc([N+](=O)[O-])c(NC[C@@H](O)[C@H](O)[C@@H](O)CO)cc1Br,C19878074_decoy,TRY1,Decoy,0,-7.40047,-5.77,-1.71,-5.869164142123832
Nc1nc(CSc2nnc(C(F)(F)F)n2N)nc(Nc2ccccc2)n1,C20044331_decoy,TRY1,Decoy,0,-7.33984,-6.05,-1.57,-5.7902491358522346
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCC(=O)Nc1nccs1,C20806459_decoy,TRY1,Decoy,0,-9.12346,-8.32,-2.34,-7.46975005957074
Cc1c(C(=O)NC(C(N)=O)C(N)=O)cnn1-c1ccc(Br)cc1,C24926721_decoy,TRY1,Decoy,0,-7.40751,-5.22,-1.38,-4.707404605949404
C=CCNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C25478154_decoy,TRY1,Decoy,0,-8.08385,-6.45,-3.87,-5.685403380865004
Nc1nc(N)nc(CSc2nc(-c3ccccc3Br)n[nH]2)n1,C26468144_decoy,TRY1,Decoy,0,-8.82175,-8.42,-1.52,-9.208795470216
Cc1c(C(=O)NN)sc2c1c(=O)n(CC(N)=O)c(=O)n2CC(=O)N1CC1,C34782747_decoy,TRY1,Decoy,0,-7.83861,-7.3,-1.78,-6.462547234207867
Cc1c(C(=O)NN)sc2c1c(=O)n(CC(=O)N(C)C)c(=O)n2CC(N)=O,C34782799_decoy,TRY1,Decoy,0,-7.64496,-7.04,-0.85,-6.289731727803944
CN(C(=O)CO)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36536334_decoy,TRY1,Decoy,0,-6.99822,-5.97,-1.56,-5.8405192207758025
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C)C(=O)[C@@H]1CCC(=O)N1,C36537243_decoy,TRY1,Decoy,0,-7.30149,-6.08,-3.7,-7.479621274631818
CC(C)(C)N(C(=O)CO)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36590535_decoy,TRY1,Decoy,0,-4.23134,-4.63,-2.74,-3.525285010803723
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H](C)[C@@H](O)C[C@@H]12,C04268365_decoy,TRY1,Decoy,0,-7.0957,-6.09,-3.2,-5.191289943251219
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]2[C@H](C)[C@H](O)C[C@@H]12,C08681472_decoy,TRY1,Decoy,0,-6.82669,-5.68,-1.98,-4.873260729540859
CC1=C[C@@H]([C@H]2NN[C@H](SCC(=O)Nc3cccc(Cl)c3C)N2N)N=N1,C39016331_decoy,TRY1,Decoy,0,-9.06805,-8.16,-1.61,-6.968977926065623
NC(=O)CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1,C39362731_decoy,TRY1,Decoy,0,-7.06875,-7.49,-1.94,-7.004552095235818
CC(=O)C=C=C1C(C)(C)C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@]1(C)O,C34614538_decoy,TRY1,Decoy,0,-8.24297,-6.96,-3.39,-5.389967616762697
CC(=O)C=C=C1C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]1(C)O,C35465756_decoy,TRY1,Decoy,0,-8.54447,-6.49,-4.08,-5.754737280267172
Nc1c(NNC(=O)c2ccncc2)ncnc1Nc1ccc(Br)cc1,C40782272_decoy,TRY1,Decoy,0,-8.49675,-5.35,-2.04,-5.804397092069898
COc1ccc(C(=O)NNc2ncnc(Nc3nc(C)c(C)s3)c2N)cc1,C40783098_decoy,TRY1,Decoy,0,-8.82706,-6.19,-1.84,-6.074131193541801
Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)NC(C(N)=O)C(N)=O,C44389209_decoy,TRY1,Decoy,0,-7.56499,-7.59,-0.78,-5.645029729598355
N/C(=N/OC(=O)C[C@H](NC(=O)C(F)(F)F)c1ccccc1)c1nonc1N,C04188499_decoy,TRY1,Decoy,0,-7.04646,-6.2,-1.37,-6.774277657138626
C[C@@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)NC(=O)NC(C)(C)C,C56159686_decoy,TRY1,Decoy,0,-8.46166,-6.47,-4.17,-6.010894364910186
Cc1noc(N)c1C(=O)O[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C58669382_decoy,TRY1,Decoy,0,-9.57425,-7.86,-2.34,-7.880012685251373
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1ccccn1,C58994086_decoy,TRY1,Decoy,0,-9.42158,-8.89,-1.57,-8.155370607918092
O=C(CN1C(=O)N[C@@H]2NC(=O)N[C@H]21)N/N=C/c1cc(Br)ccc1O,C59092477_decoy,TRY1,Decoy,0,-8.96981,-6.63,-0.27,-5.693027237085401
O=C(CN1C(=O)N[C@H]2NC(=O)N[C@H]21)N/N=C/c1cc(Br)ccc1O,C59092480_decoy,TRY1,Decoy,0,-7.08085,-6.47,-2.25,-5.451407374804667
CCc1c(C(=O)N[C@H]2CCCc3[nH]c(=O)c(C(N)=O)cc32)[nH]c(C)c1C(C)=O,C59373332_decoy,TRY1,Decoy,0,-8.44902,-6.11,-3.66,-5.198230995900298
CCOc1ccccc1-c1nnc(S[C@H](C(=O)NC(N)=O)C(C)C)n1N,C21575451_decoy,TRY1,Decoy,0,-6.63643,-6.64,-3.6,-5.34713311150628
NS(=O)(=O)c1ccc(NCCC(=O)NC2CCC(O)CC2)c([N+](=O)[O-])c1,C61431437_decoy,TRY1,Decoy,0,-8.75771,-6.37,-2.93,-5.381095021671379
O=C(NCCNC(=O)c1ccc(O)cc1)Nc1cc(C(F)(F)F)c[nH]c1=O,C63161439_decoy,TRY1,Decoy,0,-7.32062,-8.8,-1.34,-6.398229243274078
CC(C)CC[C@@H](C)NC(=O)CO/N=C(/N)C1=C(N)C2(CCCC2)N(C)C1=O,C63456233_decoy,TRY1,Decoy,0,-8.01004,-6.77,-2.37,-5.902974040225029
CC1=C([C@H](C)C(=O)N[C@H]2S[C@@H](Nc3ccccc3)N[C@H]2C(N)=O)[C@H](C)N=N1,C63686315_decoy,TRY1,Decoy,0,-7.11907,-6.41,-1.96,-5.524439125767353
NC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSC1=NC(=O)CC(N)=N1,C63885788_decoy,TRY1,Decoy,0,-9.72526,-6.51,-2.44,-5.968644991124909
NC(=O)[C@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CSC1=NC(=O)CC(N)=N1,C63885791_decoy,TRY1,Decoy,0,-8.88492,-7.45,-1.11,-6.814881616222527
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc2[nH]c(=O)[nH]c2c1,C67337549_decoy,TRY1,Decoy,0,-7.78272,-9.48,-3.89,-8.431424308570094
CC/C=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@H]12)c1csc(N)n1,C04215231_decoy,TRY1,Decoy,0,-7.57184,-6.51,-4.23,-7.969745336555076
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C04557187_decoy,TRY1,Decoy,0,-5.65991,-5.7,-3.42,-4.890331512611493
[NH3+][C@@H](CCSCNc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)C(=O)[O-],C05641190_decoy,TRY1,Decoy,0,-6.22015,-6.12,-2.17,-5.86577974352296
[NH3+][C@@H](CCSCNc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)C(=O)[O-],C05641192_decoy,TRY1,Decoy,0,-7.56202,-5.61,-2.02,-5.9390056639728765
Cc1oc2c(C)c3oc(=O)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc2c1C,C08764209_decoy,TRY1,Decoy,0,-7.90802,-7.16,-2.18,-5.3562434978863935
C[C@@]1(O[C@@H]([C@H](O)[C@@H](O)C(=O)[O-])[C@H](O)CO)O[C@](C)(CO)[C@](C)(O)[C@@](C)(O)[C@@]1(C)O,C09970294_decoy,TRY1,Decoy,0,-4.70715,-4.63,-1.11,-3.3648690897750653
CSCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCCNC(C)=O,C04260516_decoy,TRY1,Decoy,0,-9.82988,-6.91,-3.36,-7.730306863821112
OC[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1,C13548747_decoy,TRY1,Decoy,0,-9.4229,-6.48,-0.45,-7.1193576088971975
CCOC(=O)/C=C/[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C1=CCC[NH2+]C1)C(C)C,C13648767_decoy,TRY1,Decoy,0,-8.15762,-7.26,-3.36,-7.222037617532927
OC[C@@H]1O[C@@H](OC[C@H]2C[C@@H](OC/C=C/c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O,C14984975_decoy,TRY1,Decoy,0,-8.26102,-6.71,-1.33,-6.236607824653576
NC(=O)CSc1nnc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)s1,C16665613_decoy,TRY1,Decoy,0,-9.11928,-7.46,-3.13,-8.493568756934353
OC[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)c1cnn(-c2ccccc2)n1,C16951656_decoy,TRY1,Decoy,0,-6.70059,-7.54,-2.51,-8.374699625508711
O=C1NC(=O)/C(=C/c2ccc(S(=O)(=O)N/N=C/[C@H](O)[C@H](O)[C@H](O)CO)cc2)N1,C16958905_decoy,TRY1,Decoy,0,-9.15156,-7.55,-2.2,-6.7595663052070885
CC(C)[C@H]([NH3+])C(=O)N[C@H](CSSC[C@H](NC(=O)[C@H]([NH3+])C(C)C)C(=O)[O-])C(=O)[O-],C16997587_decoy,TRY1,Decoy,0,-9.09158,-5.16,-4.06,-6.376134697769112
O=C1NC(=S)NC(=O)C1=CNCCCCCCNC=C1C(=O)NC(=S)NC1=O,C20808101_decoy,TRY1,Decoy,0,-8.85461,-6.88,-3.22,-6.830593467148758
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)o1,C20835040_decoy,TRY1,Decoy,0,-9.97577,-7.86,-2.67,-8.521361174656496
Cc1nnc(CSc2nnc(NC(=O)CSc3nnc(NN)n3N)s2)o1,C20922791_decoy,TRY1,Decoy,0,-8.99171,-8.16,-1.46,-13.90302699353251
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C22064777_decoy,TRY1,Decoy,0,-5.34378,-5.97,-2.75,-4.7742706370756265
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@H]1O,C22064784_decoy,TRY1,Decoy,0,-5.20923,-5.0,-4.34,-3.945752272045583
CC(C)Cn1c(N)c(C(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)c(=O)[nH]c1=O,C22765296_decoy,TRY1,Decoy,0,-7.76425,-7.11,-2.25,-6.088169737360752
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@H](NC(C)=O)[C@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C26892752_decoy,TRY1,Decoy,0,-5.12771,-5.59,-3.49,-4.445427522522541
C=C(C(=O)OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O)[C@H](O)CO,C31156380_decoy,TRY1,Decoy,0,-7.55559,-7.03,-2.15,-6.425333570330481
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C35636291_decoy,TRY1,Decoy,0,-6.64927,-5.34,-2.75,-5.168317112838232
C=C[C@H](CCCCC)O[C@H]1O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C35454840_decoy,TRY1,Decoy,0,-5.15764,-6.21,-3.5,-5.364068801456912
CC/C=C(/C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@@H]12)c1csc(N)n1,C38339224_decoy,TRY1,Decoy,0,-9.19782,-4.79,-1.97,-5.942696333717084
COc1c(C)c(OC/C=C(\C)C(=O)OC[C@H](O)[C@@H](O)[C@H](O)CO)cc(CO)c1CO,C39559845_decoy,TRY1,Decoy,0,-8.81918,-5.37,-2.47,-5.874783794313352
O=C([O-])CC(=O)OC[C@@H]1O[C@H](Oc2ccc(O)c3c(=O)c(-c4ccc(O)cc4)coc23)[C@H](O)[C@H](O)[C@@H]1O,C43179115_decoy,TRY1,Decoy,0,-7.90637,-7.49,-3.56,-7.162919382609757
O=C([O-])CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(O)c3c(=O)c(-c4ccc(O)cc4)coc23)[C@@H](O)[C@H](O)[C@@H]1O,C43179118_decoy,TRY1,Decoy,0,-8.30274,-6.31,-3.17,-5.868983621309136
COc1cc([C@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C([O-])=NC(=O)[C@@H]23)cc(Br)c1OC,C33887976_decoy,TRY1,Decoy,0,-8.34829,-6.53,-2.01,-6.279539802780943
CC(=O)C[C@@H]1O[C@@H](O[C@@H]2[C@H](NC(C)=O)[C@H](O)O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C44134949_decoy,TRY1,Decoy,0,-5.78733,-4.98,-2.35,-4.836585884124753
CC(=O)C[C@@H]1O[C@@H](O[C@@H]2[C@H](NC(C)=O)[C@H](O)O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C44134953_decoy,TRY1,Decoy,0,-5.17694,-4.68,-4.06,-4.051807140409036
CC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])C[C@@H]1O,C44170565_decoy,TRY1,Decoy,0,-5.7724,-4.88,-4.07,-4.375612937014574
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C(COC(C)=O)=C[C@H](O)[C@@H]12,C44681111_decoy,TRY1,Decoy,0,-7.87478,-4.95,-1.63,-5.25759187030048
C=CCOC(=O)N[C@@H]1[C@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C44699059_decoy,TRY1,Decoy,0,-4.65821,-5.54,-3.02,-4.958003790793484
C=CCOC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H]1O,C44960130_decoy,TRY1,Decoy,0,-7.01038,-5.99,-2.52,-6.224461764824286
O=S(=O)(Nc1ccccn1)c1ccc(/N=C/[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc1,C45289406_decoy,TRY1,Decoy,0,-7.91517,-6.15,-1.56,-6.719889637122251
C[C@H](Cc1ccc(O)c[nH+]1)[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C48998343_decoy,TRY1,Decoy,0,-5.25435,-7.58,-4.51,-5.38715603131508
C[C@@H](Cc1ccc(O)c[nH+]1)[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C49114486_decoy,TRY1,Decoy,0,-6.97932,-8.63,-1.63,-7.099312352630052
C=C1[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3OC(=O)/C=C/c3ccc(O)cc3)OC=C(C(=O)[O-])[C@@H]2C[C@H]1O,C49181136_decoy,TRY1,Decoy,0,-8.00732,-7.95,-2.39,-7.291455170988597
C=C1[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3OC(=O)/C=C/c3ccc(O)cc3)OC=C(C(=O)[O-])[C@H]2C[C@@H]1O,C49181145_decoy,TRY1,Decoy,0,-7.65815,-7.27,-2.19,-7.361082498974925
OC[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O,C49181913_decoy,TRY1,Decoy,0,-4.86244,-5.6,-2.46,-4.248795366046751
C=C1[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C(C(=O)[O-])[C@@H]2C[C@H]1OC(=O)/C=C/c1ccc(O)cc1,C49601744_decoy,TRY1,Decoy,0,-8.71346,-6.82,-1.87,-6.60040508799171
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2ccc3c(c2)C(=O)NC3=O)n[nH]1,C59888032_decoy,TRY1,Decoy,0,-9.10827,-8.59,-3.08,-7.294139402172276
CC(=O)Nc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59888215_decoy,TRY1,Decoy,0,-9.02319,-8.07,-4.04,-6.951823848366706
CCN(CC)S(=O)(=O)[C@@H]1C=C[C@H]2NC(=O)C=C(C(=O)NCCCc3[nH]nc(N)c3C#N)C2=C1,C39943060_decoy,TRY1,Decoy,0,-7.14843,-6.47,-2.74,-6.570923590794947
[H]/N=C(/NCCC[C@@H]([NH3+])C(=O)[O-])NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2,C21991929_decoy,TRY1,Decoy,0,-6.11503,-7.46,-1.88,-5.015088581837305
C=CCc1ccc(O[C@@H]2O[C@@H](CO[C@@H]3OC[C@@](O)(CO)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,C65742721_decoy,TRY1,Decoy,0,-6.51605,-7.26,-2.96,-5.65200988196996
CC[NH+](CC)CCNC(=O)c1cc(Cl)c(N[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)cc1OC,C65747777_decoy,TRY1,Decoy,0,-6.52262,-5.51,-3.19,-4.56146850344244
CC(=O)C[C@@H]1O[C@H](O[C@@H]2[C@@H](NC(C)=O)[C@@H](O)O[C@@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O,C66055319_decoy,TRY1,Decoy,0,-4.78548,-4.62,-4.46,-4.6175662827017065
Cc1ccc2c(c1)c1c3n2CC[NH+](C[C@H](O)C[NH2+]Cc2ccccc2)[C@H]3CCC1,C02295809_decoy,TRY1,Decoy,0,-7.18825,-7.51,-1.84,-5.267007117175127
CNC(=S)Nc1ccc(N2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)[nH+]c1,C04390548_decoy,TRY1,Decoy,0,-8.057,-5.25,-2.25,-5.15529302695782
O[C@@H](COc1ccc(C[NH2+]CCc2ccccc2F)cc1)C[NH+]1CCCCC1,C11773276_decoy,TRY1,Decoy,0,-7.78083,-6.92,-2.03,-5.747334035331938
O[C@H](COc1ccc(C[NH2+]CCc2ccccc2F)cc1)C[NH+]1CCCCC1,C11773282_decoy,TRY1,Decoy,0,-8.08777,-6.88,-1.8,-6.044482986253275
O[C@@H](COc1ccc(C[NH2+]C2CCCCC2)cc1)C[NH+]1CCc2ccccc2C1,C11945357_decoy,TRY1,Decoy,0,-8.24873,-7.52,-2.74,-5.882925349528861
O[C@H](COc1cccc(C[NH2+]Cc2ccc(F)cc2F)c1)C[NH+]1CCOCC1,C12597331_decoy,TRY1,Decoy,0,-9.1172,-7.28,-2.83,-6.424283252045787
O[C@@H](COc1ccccc1C[NH2+]Cc1ccccc1Cl)C[NH+]1CCCCC1,C12755114_decoy,TRY1,Decoy,0,-7.13978,-6.2,-1.71,-5.828887583771347
O[C@@H](COc1cccc(C[NH2+]C2CCOCC2)c1)C[NH+]1CCc2ccccc2C1,C14950922_decoy,TRY1,Decoy,0,-8.49439,-7.52,-3.03,-5.845564535937544
CSCC[NH2+]Cc1cccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)c1,C14958343_decoy,TRY1,Decoy,0,-8.6902,-6.27,-3.79,-6.104720630088706
O[C@@H](COc1ccccc1C[NH2+]CCc1ccc(F)cc1)C[NH+]1CCCCC1,C15076339_decoy,TRY1,Decoy,0,-7.93857,-6.76,-3.1,-6.672697640157988
O[C@H](COc1ccccc1C[NH2+]CCc1ccc(F)cc1)C[NH+]1CCCCC1,C15076340_decoy,TRY1,Decoy,0,-7.70627,-7.23,-1.89,-7.110699774450399
[H]/N=c1\cc(C)sn1/C(=[NH+]/C1CC(C)(C)[NH2+]C(C)(C)C1)N(CCC)CC1CC1,C20423712_decoy,TRY1,Decoy,0,-7.67812,-4.25,-2.79,-4.933485720223354
Cc1nc(-c2ccccc2)cc([C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNCc2[nH]cc[nH+]2)n1,C20503952_decoy,TRY1,Decoy,0,-8.59671,-7.89,-0.93,-6.436675257312396
CCCOc1c(C[NH2+]CCN2CC[NH2+]CC2)cc(Br)cc1OC,C20968610_decoy,TRY1,Decoy,0,-8.76044,-4.5,-3.41,-6.513209724667305
Cc1cc(C)n(CC[NH2+]Cc2ccc(OC[C@@H](O)C[NH+]3CCCCC3)cc2)n1,C20997347_decoy,TRY1,Decoy,0,-7.38306,-6.23,-1.65,-5.340205142213806
Cc1cc(C)n(CC[NH2+]Cc2ccc(OC[C@H](O)C[NH+]3CCCCC3)cc2)n1,C20997349_decoy,TRY1,Decoy,0,-7.98539,-6.37,-2.47,-5.371545256374258
C[NH+]1CCC(N(Cc2ccco2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC1,C21263342_decoy,TRY1,Decoy,0,-7.83374,-5.5,-2.33,-4.950681154808822
CCn1cc[nH+]c1CNC[C@H]1C[C@@](C)(CO)[NH+](CC)[C@H]1c1ccc(Cl)cc1,C19111384_decoy,TRY1,Decoy,0,-6.76811,-5.43,-1.27,-5.253977063195641
CSCC[NH2+]Cc1ccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)cc1,C23367761_decoy,TRY1,Decoy,0,-8.2177,-5.23,-3.93,-5.2012392747591285
CC1=C(CC[NH2+]Cc2ccc(OC[C@H](O)C[NH+]3CCCCC3)cc2)[C@@H](C)N=N1,C39379514_decoy,TRY1,Decoy,0,-8.21705,-6.56,-1.83,-5.969975377914128
CC1=C(CC[NH2+]Cc2ccc(OC[C@@H](O)C[NH+]3CCCCC3)cc2)[C@H](C)N=N1,C39379522_decoy,TRY1,Decoy,0,-7.96547,-6.32,-2.31,-5.2928086346159455
CC1=C(CC[NH2+]Cc2ccccc2OC[C@H](O)C[NH+]2CCCCC2)[C@@H](C)N=N1,C39380639_decoy,TRY1,Decoy,0,-7.10443,-5.88,-1.4,-6.5161280550673695
CC1=C(CC[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCCCC2)[C@H](C)N=N1,C39380645_decoy,TRY1,Decoy,0,-8.24324,-6.63,-2.58,-7.555872915244167
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630574_decoy,TRY1,Decoy,0,-7.48298,-5.78,-2.2,-5.453606600919418
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630578_decoy,TRY1,Decoy,0,-8.32613,-5.96,-1.46,-6.214251635848375
COc1ccccc1COC[C@H](O)C[NH2+]CC1([NH+]2CCCCC2)CCCCC1,C39724963_decoy,TRY1,Decoy,0,-9.09439,-6.84,-1.13,-6.129157514713092
C[C@@H](C(=O)NCC1([NH+]2CCCCC2)CCCCC1)[NH+](C)CC(=O)NC(C)(C)C,C42506284_decoy,TRY1,Decoy,0,-8.04334,-4.99,-3.07,-5.628094069503957
C[C@H](C(=O)NCC1([NH+]2CCCCC2)CCCCC1)[NH+](C)CC(=O)NC(C)(C)C,C42506287_decoy,TRY1,Decoy,0,-8.2108,-6.24,-4.02,-6.886721329085273
COc1ccccc1C[NH+](C)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362081_decoy,TRY1,Decoy,0,-8.19756,-4.6,-2.75,-5.410692748842408
Cc1cc(C)cc(C2=C([C@H](C)C[NH2+]CCc3ccncc3)[C@@H]3C[NH2+]CCC3=N2)c1,C52635041_decoy,TRY1,Decoy,0,-9.41829,-7.27,-2.04,-8.27121390152266
CCOc1cc(C[NH2+]C[C@H](O)C[NH+]2CCCC2)cc(Br)c1OC,C60270339_decoy,TRY1,Decoy,0,-8.76422,-4.95,-3.97,-5.75415081073839
CCOc1cc(C[NH2+]C[C@@H](O)C[NH+]2CCCC2)cc(Br)c1OC,C60270341_decoy,TRY1,Decoy,0,-6.63657,-4.28,-2.47,-5.090759186845793
c1coc(CN2[C@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]2c2cccs2)c1,C63162907_decoy,TRY1,Decoy,0,-8.64046,-6.14,-1.71,-5.565506269901375
O=C(CCC1=c2ccccc2=[NH+]C1)NCCNC(=O)CC1=c2ccccc2=[NH+]C1,C63271654_decoy,TRY1,Decoy,0,-7.25502,-7.84,-1.88,-8.915109086146371
CCN1NC(C)=C(CCNC(=O)C2CCN(C3[NH+]=c4ccccc4=[NH+]3)CC2)[C@H]1C,C63695059_decoy,TRY1,Decoy,0,-8.09895,-7.87,-1.82,-6.300080110738227
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2ccccc2Cl)O1,C63720243_decoy,TRY1,Decoy,0,-9.02052,-5.11,-1.59,-4.86718682478019
COc1ccc2c(c1)=[NH+][C@H](SC[C@H]1Nc3ccc(Cl)cc3N1CCO)[NH+]=2,C63743056_decoy,TRY1,Decoy,0,-9.81295,-7.42,-1.98,-6.548254564970118
COc1ccc2c(c1)=C[C@H](CNC(=O)C[C@@H]1C(=O)NCC[NH+]1C1Cc3ccccc3C1)[NH+]=2,C64058139_decoy,TRY1,Decoy,0,-8.5543,-7.9,-2.31,-8.23466965636492
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1ccc(F)cc1)NC[C@@H]1C=c2ccccc2=[NH+]1,C64131694_decoy,TRY1,Decoy,0,-6.5731,-6.67,-2.14,-5.694309476705052
O=C(Cc1csc(NC(=O)c2ccsc2)n1)NCC1[NH+]=c2ccccc2=[NH+]1,C64372971_decoy,TRY1,Decoy,0,-8.4278,-6.17,-2.8,-6.231105688605583
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2c(Cl)cccc2Cl)O1,C64428653_decoy,TRY1,Decoy,0,-7.768,-8.51,-1.69,-7.692069170676655
CCCNC(=O)[C@H]1CCC[NH+](CC(=O)NC[C@H]2CC[NH+](CC(F)(F)F)C2)C1,C65243845_decoy,TRY1,Decoy,0,-8.33557,-5.88,-1.93,-5.816666296565925
COc1ccccc1CCC(=O)N[C@H](C(=O)NC1[NH+]=c2ccccc2=[NH+]1)C(C)C,C65305795_decoy,TRY1,Decoy,0,-8.10445,-7.4,-1.85,-9.201986198675046
COc1ccccc1CCC(=O)N[C@@H](C(=O)NC1[NH+]=c2ccccc2=[NH+]1)C(C)C,C65305796_decoy,TRY1,Decoy,0,-7.61105,-7.9,-2.59,-9.519364117167807
CC[C@H](C)[NH+](C)CCNC(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66188152_decoy,TRY1,Decoy,0,-8.30442,-5.52,-1.78,-5.402467671978987
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc(OC(F)F)cc2OC(F)F)CC1,C67122330_decoy,TRY1,Decoy,0,-6.72096,-5.36,-1.97,-5.004733287788231
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccc(OC(F)F)cc2OC(F)F)CC1,C67122331_decoy,TRY1,Decoy,0,-7.09098,-6.84,-3.92,-6.60412182933338
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NCC[NH+](C(C)C)C(C)C)c2C1,C67490790_decoy,TRY1,Decoy,0,-7.80415,-6.3,-2.23,-5.544355360975702
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NC[C@@H](CC(C)C)[NH+](C)C)c2C1,C67495313_decoy,TRY1,Decoy,0,-8.86141,-6.48,-3.21,-6.01203270271328
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NC[C@H](CC(C)C)[NH+](C)C)c2C1,C67495315_decoy,TRY1,Decoy,0,-9.0789,-7.12,-4.22,-8.418280195986055
Nc1nonc1-n1nnc(C(=O)N/N=C/c2c3ccccc3cc3ccccc23)c1C[NH+]1CCCCC1,C02276623_decoy,TRY1,Decoy,0,-9.35853,-8.64,-3.69,-7.235093636085057
COc1ccc2c3c1O[C@@H]1[C@]34CC[NH+](C)[C@H](C2)[C@]42C=C[C@@]1(OC)c1c(O)c(SCCO)cc(O)c12,C08789705_decoy,TRY1,Decoy,0,-8.9768,-6.09,-2.58,-5.283823540631383
COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3Cc3c[nH]c4ccccc34)C(=O)Nc3ccc(C)cc32)cc1,C08791094_decoy,TRY1,Decoy,0,-7.86958,-7.32,-1.51,-5.638770955774598
COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3Cc3c[nH]c4ccccc34)C(=O)Nc3ccc(C)cc32)cc1,C12885568_decoy,TRY1,Decoy,0,-8.63491,-8.63,-3.17,-7.316643087688732
COc1cccc(N2C(=O)[C@@H]3[C@H](Cc4c[nH]c5ccccc45)[NH2+][C@]4(C(=O)Nc5c(C)cccc54)[C@@H]3C2=O)c1,C08996016_decoy,TRY1,Decoy,0,-8.09114,-6.54,-1.2,-5.308439674836823
COc1cccc(N2C(=O)[C@@H]3[C@H](Cc4c[nH]c5ccccc45)[NH2+][C@@]4(C(=O)Nc5c(C)cccc54)[C@@H]3C2=O)c1,C08996017_decoy,TRY1,Decoy,0,-7.95137,-8.56,-1.96,-6.474404152761522
Nc1nonc1-n1nnc(C[NH+]2CCCCC2)c1C(=O)N/N=C/c1c2ccccc2cc2ccccc12,C02520772_decoy,TRY1,Decoy,0,-9.02398,-8.31,-5.08,-7.463830121400663
NS(=O)(=O)c1ccc(N2CC[NH+](Cc3nc(=O)c4c5c(sc4[nH]3)CCCC5)CC2)c([N+](=O)[O-])c1,C12547106_decoy,TRY1,Decoy,0,-10.0019,-6.29,-1.63,-6.20694160991626
CC(C)S(=O)(=O)C1=C[C@@H]2C[C@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467610_decoy,TRY1,Decoy,0,-7.00758,-6.27,-2.45,-4.549807496245789
CC(C)S(=O)(=O)[P@@]1(=O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39469826_decoy,TRY1,Decoy,0,-7.0714,-5.9,-3.23,-4.569162137475328
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C4(CC[NH2+]CC4)C3)cccc12,C39631960_decoy,TRY1,Decoy,0,-8.73263,-6.61,-3.77,-5.679003240380752
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39656036_decoy,TRY1,Decoy,0,-9.41732,-6.87,-3.9,-6.903293156525452
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NCc4cc5ccccc5[nH]4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39671595_decoy,TRY1,Decoy,0,-8.46405,-7.17,-3.72,-5.838529049244063
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685807_decoy,TRY1,Decoy,0,-9.30017,-6.83,-2.02,-6.383973811769775
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685866_decoy,TRY1,Decoy,0,-9.40976,-5.22,-2.4,-6.6041619878586
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)c1ccc(Br)cc1)CCC2,C40811822_decoy,TRY1,Decoy,0,-9.91838,-8.01,-5.0,-7.551235567482065
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)c1ccccc1Br)CCC2,C40812944_decoy,TRY1,Decoy,0,-9.78163,-8.36,-2.5,-8.211878646218903
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)c1cncc(Br)c1)CCC2,C40823132_decoy,TRY1,Decoy,0,-9.99313,-8.28,-1.9,-6.74100272057909
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH+]2CCC(O)CC2)cc1Cl,C43018163_decoy,TRY1,Decoy,0,-8.05277,-7.65,-2.98,-7.715927481779748
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C44713740_decoy,TRY1,Decoy,0,-7.74171,-7.32,-1.69,-6.238219005880537
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)ccc1Br,C44713881_decoy,TRY1,Decoy,0,-8.13502,-5.66,-1.82,-5.096652591093937
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)ccc1Br,C44713883_decoy,TRY1,Decoy,0,-8.70948,-4.88,-2.19,-4.856887168923949
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)cc1F,C44714511_decoy,TRY1,Decoy,0,-8.72388,-6.8,-1.88,-5.949772464397774
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)cc1C,C44714589_decoy,TRY1,Decoy,0,-8.82835,-7.16,-3.04,-5.846712072371897
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)c(C)c1,C44714633_decoy,TRY1,Decoy,0,-8.51519,-6.81,-1.7,-7.047471439335672
Cc1ccc2c(c1)[C@@]1(C(=O)N2)[C@]2(C#N)C(N)=[NH+]C(ON=C3CCCCC3)(ON=C3CCCCC3)[C@@]21C#N,C12462568_decoy,TRY1,Decoy,0,-9.19344,-6.32,-1.38,-5.836611797202838
Cc1ccc2c(c1)[C@]1(C(=O)N2)[C@]2(C#N)C(N)=[NH+]C(ON=C3CCCCC3)(ON=C3CCCCC3)[C@@]21C#N,C12462569_decoy,TRY1,Decoy,0,-8.71986,-5.67,-1.36,-5.561039859162671
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(F)ccc(Cl)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737649_decoy,TRY1,Decoy,0,-9.72706,-7.22,-1.22,-7.098682182217668
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(Cl)cc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C39695684_decoy,TRY1,Decoy,0,-8.57014,-6.78,-3.28,-5.490168589026801
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(Cl)cccc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C39695707_decoy,TRY1,Decoy,0,-10.0129,-8.76,-1.82,-8.973207924576881
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(Cl)cc(Cl)c4)CC34CC[NH2+]CC4)[nH]c2c1,C39695737_decoy,TRY1,Decoy,0,-8.73674,-8.6,-3.63,-7.995949957032534
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(F)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695779_decoy,TRY1,Decoy,0,-9.82244,-8.93,-2.44,-11.00205847911001
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695784_decoy,TRY1,Decoy,0,-9.75215,-6.58,-2.06,-6.619279684570455
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(C)c(F)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737309_decoy,TRY1,Decoy,0,-8.64535,-7.64,-2.0,-6.507792409625064
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(Cl)cc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C39695685_decoy,TRY1,Decoy,0,-9.70366,-7.56,-2.95,-6.870134111553099
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(Cl)cc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44736960_decoy,TRY1,Decoy,0,-9.95362,-9.17,-1.44,-7.06363400154248
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(Cl)cccc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44737046_decoy,TRY1,Decoy,0,-8.89895,-6.34,-3.65,-5.737631944487808
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(Cl)cc(Cl)c4)CC34CC[NH2+]CC4)[nH]c2c1,C39695736_decoy,TRY1,Decoy,0,-10.1901,-7.42,-1.58,-6.561411015239887
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cccc(Cl)c4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44737274_decoy,TRY1,Decoy,0,-10.2609,-6.25,-2.43,-5.593055396162553
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(F)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695778_decoy,TRY1,Decoy,0,-8.1897,-8.65,-2.26,-8.806028136712392
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(F)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737281_decoy,TRY1,Decoy,0,-9.58338,-6.88,-0.87,-6.598639833824901
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(Cl)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695780_decoy,TRY1,Decoy,0,-8.85382,-6.75,-2.14,-5.76533507393523
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(Cl)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737290_decoy,TRY1,Decoy,0,-9.53822,-8.41,-2.06,-7.385612962609103
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695785_decoy,TRY1,Decoy,0,-8.31489,-7.94,-3.21,-6.225514316708766
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737300_decoy,TRY1,Decoy,0,-10.0734,-9.07,-1.51,-8.715294637683442
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C)c(F)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695786_decoy,TRY1,Decoy,0,-8.24072,-7.52,-4.8,-6.990900644077654
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C)c(F)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695787_decoy,TRY1,Decoy,0,-9.62955,-9.01,-1.93,-8.289058203310852
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(Cl)ccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737405_decoy,TRY1,Decoy,0,-8.5678,-9.38,-1.49,-8.256613893381378
Cc1sc2nc(C[NH+]3CCN(CC(=O)NC(=O)Nc4ccc5c(c4)OCO5)CC3)[nH]c(=O)c2c1C,C22925416_decoy,TRY1,Decoy,0,-10.1421,-9.04,-2.52,-9.574063208627916
CC(=O)Nc1ccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C64199017_decoy,TRY1,Decoy,0,-9.47732,-8.51,-2.33,-6.7321396764377
O=C(Nc1ccccc1O)C1CC[NH+](Cc2nc3scc(-c4ccco4)c3c(=O)[nH]2)CC1,C08755507_decoy,TRY1,Decoy,0,-8.42826,-8.37,-1.61,-6.095661827338098
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@@H]([C@@H](C)O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C08789384_decoy,TRY1,Decoy,0,-6.73753,-6.94,-1.85,-5.369308971600307
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2c(C)cccc21,C08791571_decoy,TRY1,Decoy,0,-8.03508,-8.82,-1.78,-6.645403043541223
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccccc21,C08791729_decoy,TRY1,Decoy,0,-6.94368,-7.05,-1.91,-5.860321098742947
CCOc1ccccc1-n1c(=O)[nH]c(O)c([C@@H]2c3[nH]c4ccccc4c3CC[NH+]2CC)c1=O,C08876241_decoy,TRY1,Decoy,0,-7.84798,-7.01,-1.49,-5.984548382162537
COc1ccc(CCn2c(=O)[nH]c(O)c([C@H]3c4[nH]c5ccccc5c4CC[NH+]3C)c2=O)cc1,C08876323_decoy,TRY1,Decoy,0,-7.99019,-7.05,-2.25,-6.007191507586786
CC[NH+](CC)[C@H](CNC(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2)c1ccccc1Cl,C09536177_decoy,TRY1,Decoy,0,-8.36224,-6.2,-1.99,-5.452733255897234
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCC[C@@H]3c3ccc4c(c3)OCCCO4)n2)cc1,C09716688_decoy,TRY1,Decoy,0,-9.77302,-8.76,-3.21,-7.527567228703155
CCOc1cc([C@H]2[NH+]=C(Nc3nc4ccccc4o3)NC3=C2C(=O)CC(C)(C)C3)ccc1O,C09971122_decoy,TRY1,Decoy,0,-7.59687,-6.24,-1.78,-5.259952723988217
Cc1ccccc1Nc1nc(N)nc(C[NH+]2CCC[C@@H]2c2ccc3c(c2)OCCCO3)n1,C09127260_decoy,TRY1,Decoy,0,-8.31749,-7.17,-3.8,-6.171840868161181
CC[NH+]1CCc2c([nH]c3ccccc23)[C@@H]1c1c(O)nc(O)n(CCc2ccccc2)c1=O,C09059055_decoy,TRY1,Decoy,0,-7.80217,-8.78,-1.76,-6.870226271676607
COCCN1C(=O)[C@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C09041906_decoy,TRY1,Decoy,0,-8.80998,-8.56,-1.47,-7.1441627763892255
CC(C)NC(=O)NC(=O)CN1CC[NH+](CC(=O)Nc2ccccc2C(F)(F)F)CC1,C20795303_decoy,TRY1,Decoy,0,-7.05769,-6.3,-3.14,-5.673094292277352
Cc1c(C#N)c(NC(=O)C[NH+]2Cc3ccccc3C[C@H]2C(N)=O)n(C2CCCCC2)c1C,C21672078_decoy,TRY1,Decoy,0,-7.67551,-5.87,-3.18,-5.306949031482572
C[C@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+]1CCN(Cc2ccc(Cl)s2)CC1,C27359166_decoy,TRY1,Decoy,0,-8.75837,-7.06,-3.41,-5.631511183755552
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[NH+]1CCN(c2ccc(C(N)=O)cn2)CC1,C32916299_decoy,TRY1,Decoy,0,-7.74204,-6.89,-1.34,-5.619819067718768
C[C@@H](NC(=O)COc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12,C24986498_decoy,TRY1,Decoy,0,-9.64947,-7.33,-1.59,-6.896407664539563
COc1cc(/C=C/C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C)C3)cc(OC)c1OC,C36628695_decoy,TRY1,Decoy,0,-8.80956,-5.98,-3.8,-5.627542971275935
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39597886_decoy,TRY1,Decoy,0,-8.32112,-7.19,-2.65,-5.855930410043584
COc1c(C(=O)N2C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)csc1Cl,C39631864_decoy,TRY1,Decoy,0,-10.6866,-5.04,-4.29,-6.922325731581595
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631888_decoy,TRY1,Decoy,0,-9.95602,-5.7,-1.74,-6.31090270118863
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4ccccc4Cl)CC34CC[NH2+]CC4)c[nH]c12,C39684042_decoy,TRY1,Decoy,0,-8.14242,-7.5,-3.91,-6.493048527699059
Nc1c(Nc2ccc(Cl)cc2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40782196_decoy,TRY1,Decoy,0,-8.64055,-9.14,-1.67,-7.907493171556526
Nc1c(Nc2ccc(F)c(Cl)c2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40797637_decoy,TRY1,Decoy,0,-9.23506,-7.35,-2.59,-6.020656665518977
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C44713600_decoy,TRY1,Decoy,0,-8.96247,-7.56,-1.42,-6.138803768569565
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C44713708_decoy,TRY1,Decoy,0,-7.83377,-6.97,-2.39,-5.673624762197785
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C44713749_decoy,TRY1,Decoy,0,-7.26089,-5.45,-3.32,-4.770176922761189
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C44714207_decoy,TRY1,Decoy,0,-8.6858,-8.29,-1.57,-6.782534528014689
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cccnc2Cl)CC12CC[NH2+]CC2,C44714465_decoy,TRY1,Decoy,0,-9.2382,-8.31,-1.04,-8.227613404658129
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2ccc3ccccc3n2)CC12CC[NH2+]CC2,C44714658_decoy,TRY1,Decoy,0,-8.7908,-9.03,-1.97,-7.0223347361591175
C[NH+](C)CCCCNS(=O)(=O)c1c(Br)cc(N)cc1Br,C45665368_decoy,TRY1,Decoy,0,-7.17241,-5.76,-4.23,-5.284436008901902
NC(=O)c1c(NC(=O)C[NH+]2CCn3cccc3[C@@H]2c2ccccc2)sc2c1CCCC2,C46865172_decoy,TRY1,Decoy,0,-10.2573,-7.78,-3.05,-6.799799103495873
Nc1cc(Br)cc(Br)c1S(=O)(=O)NCC[NH+]1CCCCC1,C49574475_decoy,TRY1,Decoy,0,-8.37267,-6.68,-2.25,-5.466815829044672
[NH3+][C@H](COc1cncc(-c2ccc3c(c2)/C(=C/C2=NC=CC2)C(=O)N3)c1)Cc1ccccc1,C52634714_decoy,TRY1,Decoy,0,-9.28214,-8.03,-4.47,-6.72935917265263
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(-c5ccccc5)o4)CC34CC[NH2+]CC4)[nH]c2c1,C39695844_decoy,TRY1,Decoy,0,-9.06226,-7.56,-3.03,-6.36900237030644
NC(=O)C1CC[NH+]([C@@H](c2ccccc2Cl)c2sc3nc(-c4ccco4)nn3c2O)CC1,C09807623_decoy,TRY1,Decoy,0,-7.51226,-5.11,-1.05,-4.475681177213395
O=C1CN(c2ccc(NC(=O)NC[C@H](c3ccco3)[NH+]3CCCC3)cc2Cl)CCN1,C57885568_decoy,TRY1,Decoy,0,-8.89113,-7.22,-2.89,-6.369961751026632
Cc1ccc([C@@H]2C[C@@H](C(F)(F)F)N3NC=C(C(=O)Nc4cccc([C@H](C)O)c4)C3=[NH+]2)cc1,C12850819_decoy,TRY1,Decoy,0,-8.83381,-8.7,-1.95,-7.674176543703599
C[C@H](O)c1ccc(NC(=O)C2=CNN3C2=[NH+][C@H](c2ccc(F)cc2)C[C@@H]3C(F)(F)F)cc1,C13387865_decoy,TRY1,Decoy,0,-8.62825,-7.84,-1.87,-6.476399765668181
C[C@H](NC(=O)COc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C20573751_decoy,TRY1,Decoy,0,-10.0175,-8.71,-1.29,-8.040926032771186
CC(=O)Nc1cccc(NC(=O)CCNC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@@H]3C2)c1,C63389156_decoy,TRY1,Decoy,0,-7.98568,-8.13,-2.31,-5.807197579734981
Cc1ccc2c(c1)=C(CCNC(=O)[C@@H]1C=C3NC(=C4CC4)C=C(C(F)(F)F)N3N1)C[NH+]=2,C63547119_decoy,TRY1,Decoy,0,-8.55209,-6.82,-2.3,-6.283120314746989
COc1ccc2c(c1)=C(CCNC1=N[C@@H](c3ccccc3)N3C(=O)C[C@H](C)N[C@H]3N1)C[NH+]=2,C63633441_decoy,TRY1,Decoy,0,-9.53167,-7.26,-2.19,-6.683831280611971
COc1ccccc1[C@H]1N=C(NCCC2=c3ccccc3=[NH+]C2)N[C@@H]2N[C@H](C)CC(=O)N21,C63633451_decoy,TRY1,Decoy,0,-8.13586,-7.76,-2.56,-6.44517856110125
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)NC(=O)NC12CC3CC(CC(C3)C1)C2,C38719980_decoy,TRY1,Decoy,0,-10.0413,-10.21,-3.61,-9.702251904555034
CC1=CC(=O)N2[C@H](N=C(NCCC3=c4ccccc4=[NH+]C3)N[C@H]2c2ccc(Cl)cc2)N1,C63980137_decoy,TRY1,Decoy,0,-7.85499,-8.06,-1.75,-6.687922722733034
CC1=CC(=O)N2[C@@H](c3ccc(Cl)cc3)NC(NCCC3=c4ccccc4=[NH+]C3)=N[C@H]2N1,C63980149_decoy,TRY1,Decoy,0,-8.50546,-7.01,-0.81,-5.668440300285058
COc1ccccc1Nc1nc(N)nc(CN2CCC(C3=c4ccccc4=[NH+]C3)CC2)n1,C64076600_decoy,TRY1,Decoy,0,-9.52653,-6.09,-2.35,-6.754339279666563
CC[C@@H]1CC2=c3ccccc3=[NH+][C@H]2[C@H]([C@H]2C(=O)N(Cc3ccc(OC)cc3)[C@@H](O)N=C2O)N1,C64600383_decoy,TRY1,Decoy,0,-8.70635,-8.3,-1.46,-8.700167363057112
C[C@H]1c2c(O)cc(O)cc2OC(=O)[C@H]1CC(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C64600476_decoy,TRY1,Decoy,0,-8.92443,-7.63,-2.2,-6.387385122465731
COc1ccc(CN2C(=O)[C@@H]3[C@@H]([C@@H](C)O)[NH2+][C@]4(C(=O)Nc5c(C)cc(Cl)cc54)[C@@H]3C2=O)cc1,C02126846_decoy,TRY1,Decoy,0,-8.36635,-5.76,-3.62,-5.147406064876651
Cc1ccc(-c2csc3[nH]c(C[NH+]4Cc5ccccc5C[C@H]4C(N)=O)nc(=O)c23)s1,C08728310_decoy,TRY1,Decoy,0,-8.1594,-7.96,-1.64,-5.346908278655341
COc1cc2c(cc1OC)[C@@H](c1c(O)nc(O)n(-c3ccccc3Cl)c1=O)[NH2+]CC2,C08767867_decoy,TRY1,Decoy,0,-7.42404,-5.85,-1.59,-5.100015618244423
Cc1cc(C)c2c(c1)[C@@]1([NH2+][C@@H]([C@@H](C)O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08790108_decoy,TRY1,Decoy,0,-7.84541,-5.76,-1.88,-5.165266452977391
Nc1nc(C[NH+]2CCN(c3ccccc3F)CC2)[nH]/c(=N/c2ccc3c(c2)OCCO3)n1,C09108610_decoy,TRY1,Decoy,0,-9.31725,-8.62,-2.14,-8.292115600849664
COc1cc2[nH]c3c(N4CCC(C(N)=O)([NH+]5CCCCC5)CC4)ncnc3c2cc1OC,C02425159_decoy,TRY1,Decoy,0,-7.85983,-5.61,-2.8,-5.984143392350614
CC1(C)Cc2c(c(N3CCCC3)[nH+]c3sc(C(=O)Nc4ccccc4[N+](=O)[O-])c(N)c23)CO1,C09334755_decoy,TRY1,Decoy,0,-7.98906,-7.56,-3.42,-5.785632517027882
CCCC/[NH+]=C/[C@]12CC[C@@H](O)C[C@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H]([C@H]3C=CC(=O)O3)CC[C@@]12O,C12657981_decoy,TRY1,Decoy,0,-9.48453,-5.78,-1.71,-6.22515429118496
COc1ccc(CN2C(=O)[C@@H]3[C@@H]([C@@H](C)O)[NH2+][C@]4(C(=O)Nc5c4ccc(C)c5C)[C@@H]3C2=O)cc1,C12875278_decoy,TRY1,Decoy,0,-7.43755,-5.91,-2.97,-4.943224660730299
COc1ccccc1CN1C(=O)[C@@H]2[C@@H]([C@@H](C)O)[NH2+][C@]3(C(=O)Nc4c(C)cc(C)cc43)[C@@H]2C1=O,C12876083_decoy,TRY1,Decoy,0,-7.55515,-8.73,-3.77,-7.362716084466362
CC[C@@H](C)N1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@]3(C(=O)Nc4ccc(C)cc43)[C@@H]2C1=O,C12886950_decoy,TRY1,Decoy,0,-8.37209,-6.1,-0.69,-5.3409067488104665
O=C(NCCC(=O)N1CCC2(CC1)[NH2+]CCc1[nH]cnc12)c1ccc(Br)cc1,C09409571_decoy,TRY1,Decoy,0,-8.47976,-6.49,-1.73,-5.623573608499428
CC(=O)c1c(C)c2cnc(Nc3ccc(N4CC[C@H]([NH3+])C4)cn3)nc2n(C2CCCC2)c1=O,C13641699_decoy,TRY1,Decoy,0,-9.25263,-8.69,-4.24,-6.145817937976656
COc1ccc2[nH]c(C)c([C@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3cc(C)ccc3O4)c2c1,C19219210_decoy,TRY1,Decoy,0,-8.85901,-6.66,-1.64,-5.493346553920098
COc1ccc2c(c1)OC1(CC[NH+](C[C@H](O)c3c(C)[nH]c4cc(C)ccc34)CC1)C[C@H]2O,C19219622_decoy,TRY1,Decoy,0,-7.63416,-7.5,-2.04,-5.186376941327665
[NH3+]CCCC(=O)O[C@@H]1N=C(c2ccccc2Cl)c2cc(Br)ccc2NC1=O,C01819584_decoy,TRY1,Decoy,0,-8.88047,-7.19,-1.82,-7.3281141711479645
COc1cc2cc3c(N)c(C(=O)Nc4sc(C)c(C)c4C#N)sc3[nH+]c2cc1OC,C08667193_decoy,TRY1,Decoy,0,-8.9394,-6.15,-2.66,-4.889351464904144
Cc1ccc(-c2cc(C(=O)NNC3=c4cc(Br)ccc4=[NH+]C3=O)n[nH]2)s1,C06017008_decoy,TRY1,Decoy,0,-8.89794,-6.95,-1.42,-5.812409017921445
N#Cc1nc2c(nc1C#N)N(CCc1ccccc1)[C@@H]([NH3+])[C@H]2c1nc2ccccc2c(=O)[nH]1,C38827307_decoy,TRY1,Decoy,0,-7.90143,-7.18,-1.45,-5.801296642606843
O=C(NCCc1c[nH]c2ccccc12)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39597806_decoy,TRY1,Decoy,0,-10.0866,-6.78,-2.05,-6.470264105794632
Cc1cc(C(=O)N2C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)ccc1F,C39631662_decoy,TRY1,Decoy,0,-8.53914,-7.03,-3.88,-6.730982118471039
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631886_decoy,TRY1,Decoy,0,-9.88023,-5.19,-2.14,-6.815008867165489
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674053_decoy,TRY1,Decoy,0,-8.16779,-8.57,-2.99,-6.138763593054229
CC1(C)C[C@H]([NH2+]C2CCOCC2)[C@@]2(CCC(=O)NCc3ccco3)CC[C@](C)(O)C[C@@H]12,C12531703_decoy,TRY1,Decoy,0,-8.48132,-5.73,-1.86,-5.935202921448692
C[NH+]1CCN(Nc2ncnc(Oc3ccc(Br)c4cccnc34)c2N)CC1,C40756984_decoy,TRY1,Decoy,0,-7.63173,-7.3,-1.8,-5.134096350048458
COc1ccccc1Nc1ncnc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1N,C40781575_decoy,TRY1,Decoy,0,-8.90181,-6.65,-1.99,-5.608288982981519
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C44713616_decoy,TRY1,Decoy,0,-9.84361,-7.32,-2.78,-6.3269940759081615
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C44713707_decoy,TRY1,Decoy,0,-9.32458,-5.89,-2.77,-6.04304369352422
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C44713724_decoy,TRY1,Decoy,0,-10.5501,-8.16,-1.59,-6.925543065989854
NC(=O)c1c(NC(=O)C[NH+]2CCn3cccc3[C@H]2c2ccccc2)sc2c1CCCC2,C46865171_decoy,TRY1,Decoy,0,-8.30983,-9.33,-1.0,-6.740100562275145
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccccc4C)CC34CC[NH2+]CC4)[nH]c2c1,C39695690_decoy,TRY1,Decoy,0,-7.52426,-8.63,-0.86,-6.697259876771764
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(C)c(F)c4)CC34CC[NH2+]CC4)[nH]c2c1,C44737258_decoy,TRY1,Decoy,0,-9.92236,-9.17,-2.13,-7.592848683715452
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cccn4C)CC34CC[NH2+]CC4)[nH]c2c1,C44737334_decoy,TRY1,Decoy,0,-8.02231,-8.92,-1.44,-8.078807087027078
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)[C@H]4CC=CCC4)CC34CC[NH2+]CC4)[nH]c2c1,C39695834_decoy,TRY1,Decoy,0,-9.19124,-6.71,-2.76,-6.085311434171098
CCCCn1nc(C)c([C@@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)c1Cl,C19354137_decoy,TRY1,Decoy,0,-8.63242,-5.78,-2.88,-4.780826467338841
CCCCn1nc(C)c([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)c1Cl,C19354139_decoy,TRY1,Decoy,0,-8.65565,-5.84,-2.15,-5.062343958889172
COc1cccc([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)c1OC(F)F,C12506912_decoy,TRY1,Decoy,0,-8.24725,-6.23,-3.1,-5.004259280619235
CCOc1c(Cl)cc([C@@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc1OC,C12549650_decoy,TRY1,Decoy,0,-9.56296,-5.7,-2.45,-5.087211587343695
COc1cc([C@@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)ccc1OC(F)F,C19354082_decoy,TRY1,Decoy,0,-9.14753,-6.46,-2.06,-6.925283633781368
CCN(CCC#N)c1ccc([C@@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)c(C)c1,C12741251_decoy,TRY1,Decoy,0,-9.28241,-5.35,-3.19,-5.779065588573572
CCOc1c(Cl)cc([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc1OC,C12549652_decoy,TRY1,Decoy,0,-8.66436,-5.85,-2.02,-4.909085640835117
CCOc1cc(Cl)c(Cl)c([C@@H]2N=C(O)c3c(sc4c3CC[NH+](CC)C4)N2)c1O,C15947408_decoy,TRY1,Decoy,0,-9.76327,-8.11,-1.51,-11.205377515633987
NC(=O)C1CCN(C(=O)CCNC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@@H]3C2)CC1,C63303047_decoy,TRY1,Decoy,0,-8.95969,-6.74,-2.46,-6.164175124665281
NC(=O)C1CCN(C(=O)CCNC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@H]3C2)CC1,C63303048_decoy,TRY1,Decoy,0,-7.26536,-5.75,-2.53,-5.307768045515767
CC(=O)Nc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@@H]2Nc2ccc(O)cc2)cc1,C39984094_decoy,TRY1,Decoy,0,-8.60219,-7.17,-1.49,-5.646078798784545
CC[C@H]1CC2=c3ccccc3=[NH+][C@H]2[C@H](c2c([O-])n(-c3ccc(OC)cc3)c(=O)[nH]c2=O)[NH2+]1,C63385755_decoy,TRY1,Decoy,0,-8.3537,-7.86,-0.68,-5.977278545191428
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N([C@@H](C)c4ccccc4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63985161_decoy,TRY1,Decoy,0,-8.14413,-9.29,-3.18,-8.87370784359971
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N([C@H](C)c4ccccc4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63985162_decoy,TRY1,Decoy,0,-8.82358,-8.47,-1.94,-7.337933159533978
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N([C@H](C)c4ccccc4)[C@@H](O)N=C3O)[C@H]1[NH+]=2,C63985164_decoy,TRY1,Decoy,0,-7.40898,-8.97,-0.36,-6.064755961813606
O=c1c([C@@H]2[NH2+]CCC3=c4cc(Cl)ccc4=[NH+][C@H]32)c([O-])[nH]c(=S)n1CCc1ccccc1,C64416882_decoy,TRY1,Decoy,0,-8.3128,-7.35,-1.44,-5.716869249049144
CCCc1cc(N2CC[NH+](C)CC2)[nH+]c2sc(C(N)=O)c(N)c12,C03928166_decoy,TRY1,Decoy,0,-8.22639,-6.68,0.06,-12.351873423476038
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)[nH]c(=O)[nH]c1=O,C02131725_decoy,TRY1,Decoy,0,-6.68431,-6.97,-1.19,-5.0221140184023385
Cc1cc(C)c(O)c(C[NH2+]CCC[NH2+]Cc2cc(C)cc(C)c2O)c1,C01718688_decoy,TRY1,Decoy,0,-7.43019,-7.02,-1.74,-5.590974314743948
C=CCc1cc(-c2cc(CC=C)c(O)c(C[NH2+]C)c2)cc(C[NH2+]C)c1O,C01622178_decoy,TRY1,Decoy,0,-8.29606,-6.17,-1.68,-7.624058519634911
C[C@H]([NH2+]Cc1cc(O)c(C[NH2+][C@H](C)c2ccccc2)cc1O)c1ccccc1,C01680967_decoy,TRY1,Decoy,0,-7.40171,-7.49,-2.34,-5.895064020824842
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2c(O)[nH]c(=O)[nH]c2=O)[NH2+]1,C08764279_decoy,TRY1,Decoy,0,-7.26909,-8.76,-0.54,-7.67229303398116
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@@H]12,C11592618_decoy,TRY1,Decoy,0,-7.66151,-7.5,-3.02,-5.057178956644287
[NH3+]CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C05192427_decoy,TRY1,Decoy,0,-9.22651,-5.85,-0.76,-6.9754383768776975
CC1(C)CC(NC(=O)CSc2nnc(NN)n2N)CC(C)(C)[NH2+]1,C20922500_decoy,TRY1,Decoy,0,-8.05045,-7.96,-0.87,-8.34161978503488
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3[NH3+])ccc12,C22064030_decoy,TRY1,Decoy,0,-7.64978,-5.96,-1.05,-5.241079957790861
Cc1ccc2nc3c4c(O)c5ccccc5c(O)c4/c(=[NH+]/CC[NH3+])cc-3oc2c1,C22079535_decoy,TRY1,Decoy,0,-9.415,-8.27,-1.18,-6.903537954889011
COc1cccc([C@@H]2c3c([nH][nH+]c3C)Nc3[nH]c(=O)[nH]c(=O)c32)c1O,C31809853_decoy,TRY1,Decoy,0,-6.77729,-5.71,-1.9,-3.900411821952853
O=C(Nc1cc2[nH]c(=O)[nH]c2cc1Br)[C@H]1C[C@@H](O)C[NH2+]1,C37034052_decoy,TRY1,Decoy,0,-7.25591,-6.17,0.27,-4.963958566599636
C[C@H](NS(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl)C(N)=O,C37581767_decoy,TRY1,Decoy,0,-9.32582,-6.01,-2.68,-7.307942964383159
NC(=O)C[C@@H]([NH3+])C(=O)Nc1c(Cl)cc(Br)cc1Cl,C37626079_decoy,TRY1,Decoy,0,-9.70049,-4.84,-1.06,-6.220901342225848
CC(C)=CCS[C@@H]1NN[C@@H]([C@@H]([NH3+])Cc2c[nH]c3ccccc23)O1,C39016299_decoy,TRY1,Decoy,0,-8.41549,-5.66,-1.96,-5.282927552914017
Cc1c(Cl)cccc1Nc1[nH+]cnc(NNc2ccccc2)c1N,C40701543_decoy,TRY1,Decoy,0,-7.71845,-5.35,-1.78,-5.521602798098862
Cc1ccc2c(Nc3ncnc(NN4CC[NH+](C)CC4)c3N)cccc2[nH+]1,C40757079_decoy,TRY1,Decoy,0,-8.44654,-7.5,-1.62,-8.690119191193457
CC1(C)CC(Nc2ncnc(Nc3nccs3)c2N)CC(C)(C)[NH2+]1,C40760734_decoy,TRY1,Decoy,0,-8.62581,-7.25,-3.76,-8.782391095658069
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)cc1,C42951497_decoy,TRY1,Decoy,0,-6.58995,-6.92,-0.78,-7.38271137454171
C[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+]1CCC(C(N)=O)CC1,C42952436_decoy,TRY1,Decoy,0,-7.44745,-4.76,-2.82,-4.654671501342299
CC[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](CCO)CCO,C42954098_decoy,TRY1,Decoy,0,-8.26726,-4.0,-4.77,-5.230893527168991
CCCC[NH+](CC(N)=O)[C@@H](c1ccc(Br)cc1)[C@H]([NH3+])CC,C42955568_decoy,TRY1,Decoy,0,-7.86303,-5.17,-1.83,-5.716874784508215
CC[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)cc1,C42959851_decoy,TRY1,Decoy,0,-9.09613,-6.91,-0.88,-8.037656257306027
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(Cl)c1,C43019696_decoy,TRY1,Decoy,0,-7.80581,-6.69,-2.45,-7.660591084530909
CC[C@H]([NH3+])[C@@H](c1cccc(Br)c1)[NH+](CCO)CCO,C43021076_decoy,TRY1,Decoy,0,-7.23792,-4.44,-2.25,-4.522934158338001
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1Cl,C43090167_decoy,TRY1,Decoy,0,-7.07757,-6.89,-2.83,-9.983525350820765
CC[C@H]([NH3+])[C@@H](c1ccccc1Br)[NH+](CCO)CCO,C43092465_decoy,TRY1,Decoy,0,-7.02724,-4.18,-2.18,-4.909189266188083
CC[C@H]([NH3+])[C@H](c1ccccc1Br)[NH+](CC(N)=O)C(C)C,C43093233_decoy,TRY1,Decoy,0,-6.65128,-3.42,-2.61,-4.570423938019895
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1ccccc1Br,C43096454_decoy,TRY1,Decoy,0,-9.34365,-7.38,-0.57,-9.235675349746124
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)s1,C43258316_decoy,TRY1,Decoy,0,-7.80812,-6.4,-2.82,-7.448766109697246
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](CC(N)=O)C(C)C,C43262660_decoy,TRY1,Decoy,0,-7.96393,-4.64,-0.83,-5.508373083214034
CCCC[NH+](CC(N)=O)[C@H](c1ccc(Br)s1)[C@H]([NH3+])CC,C43263035_decoy,TRY1,Decoy,0,-7.85432,-3.38,-2.28,-5.45759119658482
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](CC(N)=O)CC(C)C,C43263045_decoy,TRY1,Decoy,0,-7.71638,-4.74,-4.05,-5.250667065619041
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](CC(N)=O)C(C)C,C43287308_decoy,TRY1,Decoy,0,-8.89531,-3.99,-2.3,-5.638689735425761
NC(=O)C[C@@H]([NH3+])c1cc(Br)cc(OC(F)(F)F)c1O,C44256170_decoy,TRY1,Decoy,0,-7.58662,-6.8,-0.2,-8.835717288685611
[NH3+][C@H](CO)CCc1ccccc1-c1ccccc1CC[C@H]([NH3+])CO,C44464396_decoy,TRY1,Decoy,0,-8.83324,-6.21,-2.04,-9.455201641245695
Cc1cc(C[C@H]([NH3+])CO)sc1-c1sc(C[C@@H]([NH3+])CO)cc1C,C44466725_decoy,TRY1,Decoy,0,-11.0594,-5.19,-1.99,-6.252101998532522
NC(=O)c1sc2[nH+]c3c(c(-c4ccc(O)cc4)c2c1N)CCC3,C04739986_decoy,TRY1,Decoy,0,-8.36844,-6.01,0.86,-4.614333292099634
[NH3+]C1CCC([NH2+][C@H]2C(=O)Nc3ccc(Br)cc32)CC1,C51693008_decoy,TRY1,Decoy,0,-8.70912,-4.67,-1.6,-4.296880551315871
Cc1cc(Br)cc2c1NC(=O)[C@H]2[NH2+]C1CCC([NH3+])CC1,C51694557_decoy,TRY1,Decoy,0,-8.83311,-6.34,-0.79,-5.821251757729075
COc1cc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(O)c1O,C12507328_decoy,TRY1,Decoy,0,-9.11465,-7.47,-3.23,-5.749521803063147
CC[C@@H]([NH3+])Cc1c(N)nc(N)c(C[C@@H]([NH3+])CC)c1-c1ccccc1,C44410058_decoy,TRY1,Decoy,0,-6.17809,-4.61,-0.6,-4.111387781234055
CC1=C(c2ccc(Cl)cc2)[C@H]([NH3+])N(C2[NH+]=c3ccccc3=[NH+]2)N1,C63425295_decoy,TRY1,Decoy,0,-6.55836,-7.57,-0.66,-5.982910028905019
CC[NH+]1CCN(c2cc(CNc3cc(C)[nH+]c(N)n3)cc[nH+]2)CC1,C64550400_decoy,TRY1,Decoy,0,-12.9488,-6.61,-1.09,-7.186977125773085
O=C(C[NH2+]C[C@H]1NN=C2CCCCCN21)NC1[NH+]=c2ccccc2=[NH+]1,C65371761_decoy,TRY1,Decoy,0,-6.71384,-7.58,-1.16,-5.499581637238901
Cc1n[nH]c(C)c1[C@H]([NH3+])C(=O)NC[C@H]1C=c2cc(Cl)ccc2=[NH+]1,C65393911_decoy,TRY1,Decoy,0,-7.80494,-5.4,-1.5,-4.844364979611004
Cc1ccc2c(c1C)=[NH+][C@H](C[NH2+]C[C@H]1NN[C@H]3CCCCCN31)[NH+]=2,C65405729_decoy,TRY1,Decoy,0,-8.1131,-6.08,-2.14,-4.87929467665084
O[C@@H]1C[NH2+]C[C@H]1Nc1nc(-c2cccnc2)nc2c1CC[NH2+]CC2,C65467693_decoy,TRY1,Decoy,0,-8.49738,-5.09,0.04,-5.052198861792698
Nc1nc(N2CCC[C@H](Cn3cc(C[NH3+])nn3)C2)c2cn[nH]c2n1,C67514658_decoy,TRY1,Decoy,0,-9.19955,-7.63,-1.82,-7.322858150793489
Nc1c(SCC[NH3+])cc(O)c2c1C(=O)c1ccccc1C2=O,C04822265_decoy,TRY1,Decoy,0,-10.6109,-6.71,-1.48,-8.459503935418146
CC1(C)Cc2c(c(N3CCOCC3)[nH+]c3sc(C(=O)NN)c(N)c23)CO1,C00903730_decoy,TRY1,Decoy,0,-8.35093,-7.49,-0.66,-7.439725002583607
CC1(C)CC(NC(=O)CSc2n[nH]c(N)n2)CC(C)(C)[NH2+]1,C20568241_decoy,TRY1,Decoy,0,-7.89276,-7.73,0.44,-13.86531973538444
[NH3+]CCC[NH2+]CCCNc1c2c([nH+]c3ccccc13)CCCC2,C21987043_decoy,TRY1,Decoy,0,-8.59293,-5.33,-1.5,-5.069185950255329
COc1ccc(C([NH3+])(c2ccc(OC)cc2)[C@H]([NH3+])C(C)C)cc1,C22029154_decoy,TRY1,Decoy,0,-7.09071,-5.28,-1.47,-4.691798998767043
COc1ccc(C([NH3+])(c2ccc(OC)cc2)[C@@H]([NH3+])C(C)C)cc1,C22029158_decoy,TRY1,Decoy,0,-7.81424,-5.33,-2.11,-4.976345272856912
C[C@@H]1CCCC[C@@H]1[NH+](CC(=O)NC(N)=O)CC(=O)NC(N)=O,C31468891_decoy,TRY1,Decoy,0,-6.71491,-5.09,-1.79,-5.137632320513548
C[C@H]1CCCC[C@@H]1[NH+](CC(=O)NC(N)=O)CC(=O)NC(N)=O,C31468896_decoy,TRY1,Decoy,0,-6.63328,-4.96,-3.04,-4.753560587747614
COc1cccc([C@H](C[NH3+])[NH+](C)CCO)c1OCC[NH+](C)C,C32069794_decoy,TRY1,Decoy,0,-8.49216,-4.06,-3.3,-5.301932432518815
COc1ccc([C@@H](C[NH3+])[NH+](C)CCO)c(OCC[NH+](C)C)c1,C32069804_decoy,TRY1,Decoy,0,-7.73312,-4.43,-2.22,-5.592399410830867
COc1ccc([C@H](C[NH3+])[NH+](C)CCO)c(OCC[NH+](C)C)c1,C32069808_decoy,TRY1,Decoy,0,-8.41674,-3.67,-1.73,-4.779082669711127
[NH3+]CCC(=O)Nc1ccc(NC23CC4CC(CC(C4)C2)C3)[nH+]c1,C31961273_decoy,TRY1,Decoy,0,-8.97999,-4.98,-1.32,-6.427309634601933
C[C@@H]([NH3+])CC(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37608466_decoy,TRY1,Decoy,0,-6.55829,-5.07,-0.4,-4.026747251199966
NC(=O)C[C@@H]([NH3+])C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2,C37628242_decoy,TRY1,Decoy,0,-8.83855,-5.02,-1.75,-4.979666107450205
NC(=O)C[C@H]([NH3+])C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2,C37628244_decoy,TRY1,Decoy,0,-7.35971,-6.61,-1.24,-6.583193791973921
C[C@@H](C[NH3+])C[NH+]1CCN(c2ccc(S(N)(=O)=O)cc2)CC1,C37674214_decoy,TRY1,Decoy,0,-8.73033,-4.9,-1.78,-5.371603070012917
C[C@H](C[NH3+])C[NH+]1CCN(c2ccc(S(N)(=O)=O)cc2)CC1,C37674215_decoy,TRY1,Decoy,0,-8.49482,-4.75,-1.13,-5.306612446289864
C[C@@H](C[NH3+])C[NH+]1CCN(c2ccc(S(N)(=O)=O)cn2)CC1,C37674218_decoy,TRY1,Decoy,0,-8.54768,-4.45,-1.87,-5.202546297979334
C[C@H](C[NH3+])C[NH+]1CCN(c2ccc(S(N)(=O)=O)cn2)CC1,C37674219_decoy,TRY1,Decoy,0,-8.4171,-6.42,-3.07,-5.590886246405363
NS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@@H]2[NH3+])c([N+](=O)[O-])c1,C38050722_decoy,TRY1,Decoy,0,-7.15077,-6.03,-2.14,-12.411971771669116
NS(=O)(=O)c1ccc(N[C@H]2CCCC[C@@H]2[NH3+])c([N+](=O)[O-])c1,C38050723_decoy,TRY1,Decoy,0,-8.24867,-5.46,-1.57,-4.902468795032674
NS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@H]2[NH3+])c([N+](=O)[O-])c1,C38050724_decoy,TRY1,Decoy,0,-8.94813,-5.85,-1.85,-8.528813433306466
Cc1ccc2c(c1)=C(NNC(=O)c1nc(N)nc(N)n1)C(=O)[NH+]=2,C05618812_decoy,TRY1,Decoy,0,-7.55785,-6.04,-3.26,-5.541618900378835
Cc1cccc(Nc2nc[nH+]c(NN3CC[NH+](C)CC3)c2N)n1,C40685456_decoy,TRY1,Decoy,0,-7.59092,-6.96,-1.26,-6.722275303753095
Cc1ccnc(Nc2nc[nH+]c(NN3CC[NH+](C)CC3)c2N)c1,C40701313_decoy,TRY1,Decoy,0,-6.79441,-5.4,-1.07,-5.168011713156699
C[NH+]1CCN(Nc2[nH+]cnc(NNc3ccccc3)c2N)CC1,C40756830_decoy,TRY1,Decoy,0,-6.14976,-6.26,-0.61,-4.358868131668978
Cc1cccnc1Nc1nc[nH+]c(NN2CC[NH+](C)CC2)c1N,C40756834_decoy,TRY1,Decoy,0,-6.78253,-5.86,-0.51,-6.307702102881984
Nc1c(NC2CCCCCC2)nc[nH+]c1NNc1ccccc1,C40757627_decoy,TRY1,Decoy,0,-7.48443,-5.57,-1.03,-4.463067358310435
CC[C@@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+](CC(N)=O)CC(C)C,C42947094_decoy,TRY1,Decoy,0,-7.96463,-3.59,-1.43,-4.943579172007751
CC[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](C)CC(N)=O,C42953045_decoy,TRY1,Decoy,0,-7.51821,-4.12,-1.31,-4.379876191680168
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](C)CC(N)=O,C42953048_decoy,TRY1,Decoy,0,-7.85611,-5.64,-3.04,-7.064876338625434
CC[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](C)CC(N)=O,C42953054_decoy,TRY1,Decoy,0,-7.27339,-4.05,-1.25,-4.4154099995042175
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(Br)c1,C43025248_decoy,TRY1,Decoy,0,-8.36499,-7.04,-2.42,-7.608054141259238
CCCC[NH+](CC(N)=O)[C@@H](c1ccccc1Cl)[C@H]([NH3+])CC,C43052866_decoy,TRY1,Decoy,0,-6.8235,-4.91,-2.78,-5.311076713667787
CCCC[NH+](CC(N)=O)[C@H](c1ccccc1Cl)[C@H]([NH3+])CC,C43052869_decoy,TRY1,Decoy,0,-7.06233,-5.05,-2.68,-5.32756012000558
C[C@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)s1,C43258292_decoy,TRY1,Decoy,0,-10.2021,-7.13,-1.51,-8.562407089412755
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)s1,C43258298_decoy,TRY1,Decoy,0,-8.96259,-6.92,-2.65,-7.320088004360788
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)s1,C43258301_decoy,TRY1,Decoy,0,-7.93774,-6.05,-0.86,-8.213997697024078
Cn1cc([C@H](O)c2ccc(Cl)cc2Cl)cc1[C@H](N)C[NH3+],C44469887_decoy,TRY1,Decoy,0,-9.45554,-6.55,-1.28,-8.955259205778878
Cn1cc([C@H](O)c2ccc(Cl)cc2Cl)cc1[C@@H](N)C[NH3+],C44469890_decoy,TRY1,Decoy,0,-9.05885,-6.6,-2.33,-10.228053288773166
Cn1cc([C@@H](O)c2ccc(Cl)cc2Cl)cc1[C@H](N)C[NH3+],C44469893_decoy,TRY1,Decoy,0,-9.31136,-6.47,-2.23,-8.040187590141288
Cn1cc([C@@H](O)c2ccc(Cl)cc2Cl)cc1[C@@H](N)C[NH3+],C44469896_decoy,TRY1,Decoy,0,-9.63149,-6.67,-1.5,-9.456667737284116
CC(C)[NH+]1CC[C@H](CNc2ccc(S(N)(=O)=O)cc2N)C1,C45118602_decoy,TRY1,Decoy,0,-8.22422,-5.05,-2.29,-4.377098867272065
CC(C)[NH+]1CC[C@H](CNc2cc(N)cc(S(N)(=O)=O)c2)C1,C45118715_decoy,TRY1,Decoy,0,-8.70246,-6.59,-3.13,-7.421583736207445
CC(C)[NH+]1CC[C@@H](CNc2cc(N)cc(S(N)(=O)=O)c2)C1,C45118717_decoy,TRY1,Decoy,0,-7.3672,-4.99,-2.43,-4.670345551498226
CCC[NH+]1CCC(Nc2cc(N)cc(S(N)(=O)=O)c2)CC1,C49554975_decoy,TRY1,Decoy,0,-7.78801,-6.23,-3.52,-6.476160728709402
[NH3+][C@H]1[C@H](C2[NH+]=c3ccccc3=[NH+]2)NNN1c1ccccc1Cl,C63521216_decoy,TRY1,Decoy,0,-5.65699,-7.37,-1.89,-5.196902125743323
[NH3+][C@@H]1[C@H](C2[NH+]=c3ccccc3=[NH+]2)NNN1c1ccccc1Cl,C63521222_decoy,TRY1,Decoy,0,-6.55053,-6.08,-0.73,-4.004491027392251
NC(=[NH2+])NC[C@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl,C64202693_decoy,TRY1,Decoy,0,-7.51731,-6.1,-1.14,-4.684961211607631
NC(=[NH2+])NC[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl,C64202694_decoy,TRY1,Decoy,0,-8.26975,-5.48,-2.12,-5.520624306584194
COc1cc([C@@H]2c3cc4c(cc3[C@@H](O[C@@H]3O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]3O)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O,C03938684_decoy,TRY1,Decoy,0,-8.83335,-8.67,-3.53,-10.313737488416663
C[C@@H](NS(=O)(=O)c1cccc2nsnc12)C(=O)OCC(=O)c1c(N)n(C)c(=O)n(C)c1=O,C03422047_decoy,TRY1,Decoy,0,-7.40695,-6.61,-3.32,-5.817337757153136
COc1cccc([C@@H]2[NH2+][C@@](C)(C(=O)[O-])[C@H]3C(=O)N(c4cccc(C(F)(F)F)c4)C(=O)[C@H]23)c1O,C08869853_decoy,TRY1,Decoy,0,-7.38802,-8.32,-1.7,-6.903592257605213
CNS(=O)(=O)c1ccc(C2=C[C@](C)(c3ccc(S(=O)(=O)NC)cc3)Nc3ncnn32)cc1,C09683015_decoy,TRY1,Decoy,0,-9.29174,-7.58,-1.84,-7.466464451440984
CCn1c(SCC(=O)Nc2cc(OC)c(OC)cc2C(=O)OC)nnc1-c1nonc1N,C12413679_decoy,TRY1,Decoy,0,-8.32117,-7.53,-1.84,-7.330483956913005
Cn1c(C[C@@H]2CCS(=O)(=O)C2)nnc1SCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C13163706_decoy,TRY1,Decoy,0,-12.1649,-5.78,-3.98,-7.824708339474628
CCn1nc(C(=O)NNC(=O)[C@@H](NC2=NS(=O)(=O)c3ccccc32)C(C)C)c2ccccc2c1=O,C16231229_decoy,TRY1,Decoy,0,-8.6193,-8.94,-1.85,-7.376150632236799
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)OCC(=O)Nc1sccc1C(N)=O,C16580872_decoy,TRY1,Decoy,0,-8.8743,-7.1,-3.45,-6.091557182979383
CCOc1ccc(-n2c(Cc3cc(=O)[nH]c(=O)[nH]3)nnc2SCC(=O)Nc2cc(C)on2)cc1,C17315168_decoy,TRY1,Decoy,0,-8.48252,-7.3,-2.07,-7.368172267835601
CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(N/N=C/c3cn(C)nc3C)n2)c(C#N)c1C,C20424100_decoy,TRY1,Decoy,0,-10.0169,-6.9,-4.1,-7.385041862341534
CCn1c(Cn2nnc(-c3ccccc3)n2)nn([C@H]2C/C(=N/NC(N)=S)[C@H]3OC[C@@H]2O3)c1=S,C20598165_decoy,TRY1,Decoy,0,-10.2363,-8.16,-2.84,-8.524647793048977
C[C@H](OC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O)C(=O)Nc1ncnc2nc[nH]c12,C22187672_decoy,TRY1,Decoy,0,-8.4504,-9.1,-2.97,-7.906797750244501
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)C1,C31807666_decoy,TRY1,Decoy,0,-8.10657,-6.98,-1.91,-5.758136375417301
O=C(C[C@@H]1SC(=O)NC1=O)NNC(=O)Cn1nc(-c2ccccn2)n(-c2ccccc2)c1=O,C32597860_decoy,TRY1,Decoy,0,-7.78931,-6.98,-2.31,-5.821768835877613
CSCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1c[nH]c3ccccc13)(C(=O)[O-])[NH2+][C@H]2c1nccs1,C33601853_decoy,TRY1,Decoy,0,-9.64621,-6.22,-1.72,-7.238046641701828
CCc1cccc(CC)c1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CO)(C(=O)[O-])[NH2+][C@H]2c1ccc2c(c1)OCCO2,C33623423_decoy,TRY1,Decoy,0,-9.0014,-7.66,-2.36,-6.370706441975196
CCc1cccc(CC)c1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CO)(C(=O)[O-])[NH2+][C@H]2c1ccc(Cl)s1,C33638974_decoy,TRY1,Decoy,0,-9.30072,-7.03,-1.8,-7.387694783817336
CCCCN1C(=O)[C@H]2[C@@H](c3cc(Cl)cc(Cl)c3Cl)[NH2+][C@](C(=O)[O-])([C@@H](C)O)[C@@H]2C1=O,C34255985_decoy,TRY1,Decoy,0,-9.77818,-4.97,-2.37,-6.539047481212879
C[C@@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cccc3ccccc23)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C34259767_decoy,TRY1,Decoy,0,-7.09736,-6.93,-1.45,-5.311342512100814
C[C@H](O)[C@]1(C(=O)[O-])[NH2+][C@@H](c2cccc3ccccc23)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C34259769_decoy,TRY1,Decoy,0,-7.13142,-5.59,-1.69,-4.792049991033976
COc1ccc(Br)cc1[C@@H]1[NH2+][C@@](C(=O)[O-])([C@@H](C)O)[C@H]2C(=O)N(C(C)(C)C)C(=O)[C@H]12,C34262050_decoy,TRY1,Decoy,0,-7.39987,-4.51,-2.52,-5.631338470348606
Cc1c(C(=O)NN)sc2c1c(=O)n(CC(=O)N1CCOCC1)c(=O)n2CC(=O)N1CCCCC1,C34783012_decoy,TRY1,Decoy,0,-8.51472,-6.79,-1.84,-8.710250611819099
COCCCN1C(=O)[C@@H]2[C@@H]([C@H](O)c3ccc(Cl)cc3)N[C@@]3(C(=O)Nc4ccccc43)[C@H]2C1=O,C35883632_decoy1,TRY1,Decoy,0,-9.29086,-7.74,,-9.15349262676824
CC[N+](CC)=c1c(O)c(O)/c1=N\[C@@H](Cc1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1)C(=O)[O-],C36080002_decoy,TRY1,Decoy,0,-8.43883,-6.41,-3.66,-5.5059476622799615
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccccc2O)N(Cc2ccco2)C(=O)CO)cc1,C36503768_decoy,TRY1,Decoy,0,-7.98505,-7.57,-3.62,-6.920084470415347
O=C(N[C@H]1CS(=O)(=O)C[C@@H]1NC(=S)N[C@@H]1C=CS(=O)(=O)C1)C(Cl)(Cl)Cl,C37531739_decoy,TRY1,Decoy,0,-9.22128,-4.63,-1.03,-5.4886490823057175
Cn1c(N)c(C(=O)COC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c(=O)n(C)c1=O,C12542288_decoy,TRY1,Decoy,0,-7.52047,-8.13,-1.87,-6.504864931402529
COc1cccc(N2[C@@H](SCC(=O)Nc3nnc(C)s3)N=N[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39362095_decoy,TRY1,Decoy,0,-8.35391,-7.75,-4.03,-7.762185089945
Cc1nnc(NC(=O)CS[C@@H]2N=N[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)s1,C39362873_decoy,TRY1,Decoy,0,-9.05645,-6.69,-2.5,-6.69842703011401
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)NCCCC(=O)[O-])C2(CC[NH2+]CC2)C1,C39663552_decoy,TRY1,Decoy,0,-8.18544,-5.89,-2.01,-6.417146897252187
C=CCn1c(S[C@H](C)C(=O)Nc2nccs2)nnc1[C@H](CO)NC(=O)c1ccccc1F,C39772306_decoy,TRY1,Decoy,0,-10.633,-7.75,-3.73,-8.034893276409726
O=C([O-])[C@H]1[NH+]=c2ccccc2=C1C(C1=c2ccccc2=[NH+][C@H]1C(=O)[O-])c1cc(Br)ccc1O,C39967921_decoy,TRY1,Decoy,0,-5.60068,-6.14,-2.53,-4.8159852613072704
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc(O)cc1)(C(=O)[O-])[NH2+][C@H]2c1ccc(Cl)s1,C33888402_decoy,TRY1,Decoy,0,-9.20906,-6.37,-1.96,-6.910422708361085
CC(=O)Oc1ccc([C@H]2[NH2+][C@](CO)(C(=O)[O-])[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@@H]23)cc1,C33923509_decoy,TRY1,Decoy,0,-5.98768,-5.96,-2.07,-4.583588798589306
C[C@@H](O)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc3c(c2)OCCO3)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C43221053_decoy,TRY1,Decoy,0,-6.72492,-7.57,-1.6,-5.296766322855222
C[C@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(Cl)s2)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C43221082_decoy,TRY1,Decoy,0,-7.10602,-5.67,-1.32,-5.018497239526669
C=CCN(C)C(=O)C[C@@H]1c2nc(NC(=O)COC)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553358_decoy,TRY1,Decoy,0,-9.3769,-5.36,-1.8,-5.99221317712771
CSCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NC[C@@H](O)c1cccc(Cl)c1,C46689471_decoy,TRY1,Decoy,0,-9.69735,-7.73,-2.29,-8.428366207700979
COc1cc([C@@H]2C(C(=O)Nc3cccnc3)=C(C)Nc3nc(CCCO)nn32)cc(OC)c1OC,C06144560_decoy,TRY1,Decoy,0,-8.29585,-5.42,-1.77,-5.877981867950297
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(-c3ccco3)cc(C(=O)Nc3ccccc3C(N)=O)c12,C57307353_decoy,TRY1,Decoy,0,-7.62832,-6.71,-3.61,-5.464137021992508
Nc1c(C(=O)CN2CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)c(=O)[nH]c(=O)n1C1CC1,C30262338_decoy,TRY1,Decoy,0,-9.32849,-5.8,-3.6,-5.828040964474148
COc1cccc([C@@H]2[NH2+][C@](C)(C(=O)[O-])[C@@H]3C(=O)N(c4cccc(C(F)(F)F)c4)C(=O)[C@@H]32)c1O,C12402073_decoy,TRY1,Decoy,0,-7.28676,-6.65,-2.15,-5.317141026957484
COc1cc(/C=N/Nc2nc(SCCC(=O)Nc3nncs3)n[nH]2)cc(OC)c1OC,C59830850_decoy,TRY1,Decoy,0,-9.76857,-7.5,-3.57,-7.837549101873382
CC(C)c1nnc(CNC(=O)CSc2n[nH]c(N/N=C/c3ccc(Br)cc3)n2)o1,C59879197_decoy,TRY1,Decoy,0,-9.64439,-7.64,-2.75,-6.590126794204199
CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)CO[C@H]1N1C(=O)/C(=N\NC(N)=S)c2ccccc21,C36239910_decoy,TRY1,Decoy,0,-6.07287,-6.22,-2.81,-7.797010433032434
Cc1cc(=O)n2nc(CN(C)CC(=O)N(C)c3c(N)n(Cc4ccccc4)c(=O)[nH]c3=O)sc2n1,C62736120_decoy,TRY1,Decoy,0,-7.98328,-8.87,-2.35,-7.374798126585971
CC(C)C[C@@H](C(=O)N[C@H](C(=O)[O-])[C@H](C)O)N1C(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3[C@@]2(C)C1=O,C63374641_decoy,TRY1,Decoy,0,-6.88054,-5.87,-2.21,-5.141668837700762
COCCCN1C(=O)[C@H]2[C@@H]([C@H](O)c3ccc(Cl)cc3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C35883632_decoy2,TRY1,Decoy,0,-8.28563,-7.6,,-6.067057924462686
COCCN1C(=O)[C@H]2[C@@H]([C@H](O)c3ccc(Cl)cc3)N[C@@]3(C(=O)Nc4ccc([N+](=O)[O-])cc43)[C@@H]2C1=O,C18203841_decoy,TRY1,Decoy,0,-7.91036,-7.84,-1.26,-7.055814678108708
CC(=O)Nc1ccc(NC(=O)CCS(=O)(=O)c2ccc3c(c2)NC(=O)C[C@@H](C)S3)cc1,C65078061_decoy,TRY1,Decoy,0,-10.7925,-7.49,-1.81,-6.914951756363948
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)O)[NH+](C)C1,C03977950_decoy,TRY1,Decoy,0,-7.37828,-4.79,-1.84,-4.900878352272479
C[C@H](c1ccccc1)n1c(=O)[nH]c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C03985248_decoy,TRY1,Decoy,0,-7.33614,-7.58,-1.04,-5.765073141636978
CC(C)[NH+]1CCN(c2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C02024313_decoy,TRY1,Decoy,0,-7.70593,-7.46,-1.26,-8.176754339155988
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(-c2ccc(Cl)cc2Cl)o1,C07539057_decoy,TRY1,Decoy,0,-7.8814,-8.22,-2.27,-6.539220332865741
C[NH+](C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(F)cc3)S[C@@H]21,C08300828_decoy,TRY1,Decoy,0,-8.97634,-6.25,-3.53,-5.535302598952342
CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@@H]([NH+](C)C)C(O)=C(C(N)=O)C(=O)[C@]3(O)C(O)=C1C2=O,C06566166_decoy,TRY1,Decoy,0,-7.83165,-8.77,-3.33,-4.969397763897683
Cc1ccc2c(c1)[C@@]1([NH2+][C@H](CCC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C08790751_decoy,TRY1,Decoy,0,-8.62974,-6.4,-1.76,-6.348900474455433
CC(C)[C@@H]([NH2+]CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc2c(c1)OCCCO2,C09513731_decoy,TRY1,Decoy,0,-8.62808,-7.99,-2.98,-7.87076768584058
CC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O,C11678097_decoy,TRY1,Decoy,0,-10.1973,-10.06,-3.23,-7.176260896950864
Cc1ccc2c(c1)[C@]1([NH2+][C@H](Cc3c[nH]c4ccc(O)cc34)[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]31)C(=O)N2,C12902062_decoy,TRY1,Decoy,0,-9.37069,-9.39,-3.14,-7.235997939342306
Cn1c(=O)c2c(ncn2CCC[NH2+]C[C@@H](O)c2ccc(O)c(CO)c2)n(C)c1=O,C13207391_decoy,TRY1,Decoy,0,-7.8831,-8.06,-3.54,-7.249047005363754
CC(C)N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@@H]2C[NH+](C)CCN32)C1=O,C09451734_decoy,TRY1,Decoy,0,-6.93992,-7.25,-3.12,-4.76074640696482
CN1C(=O)C(C(=O)C[C@H]([NH2+]C(CO)(CO)CO)c2cccs2)=C(O)[C@@H]2C=CC=C[C@H]21,C04261477_decoy,TRY1,Decoy,0,-8.08616,-5.75,-1.61,-5.809495951879646
CCCN1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@@H]2C[NH+](C)CCN32)C1=O,C09348621_decoy,TRY1,Decoy,0,-7.28198,-7.26,-2.71,-5.129442901311053
NC1=[NH+][C@H](c2cccc(NC(=O)c3ccccc3Cl)c2)n2c(nc3cc4c(cc32)OCCCO4)N1,C19357226_decoy,TRY1,Decoy,0,-10.2985,-7.97,-2.02,-6.924138803795514
COc1cc(NC(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2N2CC[NH+](C)CC2)cc(OC)c1,C20465177_decoy,TRY1,Decoy,0,-7.95921,-6.46,-1.38,-6.577030364764448
[NH3+]CCSC[C@@H]1O[C@H](n2cnc3c(NCc4ccc([N+](=O)[O-])cc4)ncnc32)[C@@H](O)[C@@H]1O,C22066461_decoy,TRY1,Decoy,0,-9.41629,-6.72,-3.06,-7.315777838151446
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](NC(=O)NC3CCCCC3)[C@@H]2O)CC1,C20463921_decoy,TRY1,Decoy,0,-7.38838,-5.71,-1.16,-4.995297442541931
CC1(C)[NH+]=C(N)N=C(N)N1c1ccc(OCCCc2ccccc2)c([N+](=O)[O-])c1,C17040125_decoy,TRY1,Decoy,0,-8.53725,-7.25,-2.34,-7.939927642028994
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C03830581_decoy,TRY1,Decoy,0,-6.99657,-4.74,-3.34,-4.303488255348228
Nc1ncnc2c1nc(NNC1=c3ccccc3=[NH+]C1=O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975231_decoy,TRY1,Decoy,0,-7.3271,-8.03,-1.44,-7.209033490770218
CCc1nnc(NC(=O)CS[C@@H]2N[NH2+]NN2c2ccc(C)c(Cl)c2)s1,C39029530_decoy,TRY1,Decoy,0,-11.282,-7.85,-1.17,-7.617246848088143
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)nn1C,C39661915_decoy,TRY1,Decoy,0,-8.57104,-7.12,-3.35,-6.085111561041463
CC1=C(C(=O)N2C[C@@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@H](c2cc(C)on2)ON1,C39671539_decoy,TRY1,Decoy,0,-8.64967,-7.86,-1.46,-7.997218230633285
Cc1cccc(Nc2[nH+]cnc(Nc3ncc(C(F)(F)F)cc3Cl)c2N)n1,C40685847_decoy,TRY1,Decoy,0,-7.95571,-6.6,-3.32,-5.644598113779396
COc1c(Br)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1Br,C40744425_decoy,TRY1,Decoy,0,-7.20215,-5.48,-2.21,-5.65922185873925
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1ccc(OC(F)(F)F)cc1,C40756445_decoy,TRY1,Decoy,0,-6.93037,-5.87,-1.84,-5.103713501831551
C[NH+]1CCN(Nc2ncnc(Nc3ccc(Br)cc3F)c2N)CC1,C40756988_decoy,TRY1,Decoy,0,-8.94568,-6.41,-0.91,-5.809295597146546
C[C@@H]1CCc2noc(Nc3nc(NCCCn4cc[nH+]c4)nc(N)c3[N+](=O)[O-])c2C1,C41301369_decoy,TRY1,Decoy,0,-7.1719,-7.09,-3.73,-6.991569676439844
CC1(C)CC(NC(=O)NNC(=O)c2ccc(S(C)(=O)=O)cc2)CC(C)(C)[NH2+]1,C42909120_decoy,TRY1,Decoy,0,-7.47397,-5.63,-4.1,-4.366911380482491
CC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@H]([NH3+])[C@@H](O)[C@H](C)O2)C1)C(=O)c1ccccc1C3=O,C44021025_decoy,TRY1,Decoy,0,-9.83436,-8.98,-2.03,-6.870171311953598
CSc1cccc(Nc2nnc(-c3coc([C@@H]([NH3+])Cc4ccc(O)cc4)n3)o2)c1,C44163266_decoy,TRY1,Decoy,0,-9.86498,-8.29,-2.54,-9.399243705464045
NC(=O)C[C@@H]([NH3+])c1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,C44253861_decoy,TRY1,Decoy,0,-7.66512,-7.68,-2.2,-5.9391871578713005
CC[C@H](C)N1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@@H]2C[NH+](C)CCN32)C1=O,C09510677_decoy,TRY1,Decoy,0,-7.54104,-7.41,-2.4,-5.415186884044726
C[C@@]([NH3+])(CCOc1c(Br)cc([N+](=O)[O-])cc1Br)C(N)=O,C50441525_decoy,TRY1,Decoy,0,-8.14487,-4.48,-1.21,-5.573384271722588
COc1cc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(OC)c1O,C12507608_decoy,TRY1,Decoy,0,-8.49148,-6.15,-2.16,-4.570736979243857
CC(C)CNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55028992_decoy,TRY1,Decoy,0,-8.66401,-5.49,-2.46,-5.261016251904552
Nc1nc(N)nc(C[NH+]2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)n1,C23292023_decoy,TRY1,Decoy,0,-7.76893,-8.53,-1.43,-11.482618814567664
CC1(C)CC(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2N)CC(C)(C)[NH2+]1,C59791095_decoy,TRY1,Decoy,0,-7.70291,-6.08,-2.05,-5.375561116994824
NC1=NON[C@@H]1N1N=N[C@H](c2n[nH]c(-c3ccncc3)n2)[C@@H]1C[NH+]1CCCCC1,C28529682_decoy1,TRY1,Decoy,0,-7.60905,-8.18,,-6.19837015606352
O=C(CC[C@H]1NN[C@@H](C(=O)Nc2ccccc2)S1)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63686266_decoy,TRY1,Decoy,0,-9.69466,-7.11,-1.49,-6.147675004316004
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1sccc1C(N)=O,C39995868_decoy,TRY1,Decoy,0,-9.26043,-8.06,-2.08,-9.343007687436494
Cc1ccc(N2N=C(C(=O)NNC(=O)NCCCn3cc[nH+]c3)NCC2=O)cc1,C64886095_decoy,TRY1,Decoy,0,-7.88025,-7.9,-1.59,-6.398040056033712
CNC(=O)C[NH+]1CCC(NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)CC1,C67162495_decoy,TRY1,Decoy,0,-8.54609,-5.55,-2.68,-5.580529675059327
Nc1nc(NCC[NH+]2CCOCC2)nc(NCc2ccccc2)c1[N+](=O)[O-],C05111626_decoy,TRY1,Decoy,0,-6.88486,-7.31,-1.21,-7.112420328389809
CCOc1cc(C[NH2+][C@@H](CC)CO)cc(Br)c1OCC(N)=O,C08326260_decoy,TRY1,Decoy,0,-9.20228,-5.31,-3.88,-7.381862422156518
C[NH+](C)CCNC(=O)C[C@@H]1O[C@H](CNC(=O)Nc2ccccc2)[C@@H](O)[C@@H]1O,C08643327_decoy,TRY1,Decoy,0,-6.81029,-6.53,-1.53,-6.798203928896629
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccccc3)C[NH+]12)NCc1cccs1,C12530501_decoy,TRY1,Decoy,0,-8.35926,-6.16,-0.47,-5.682693294610931
CC(C)(CO)[NH2+]C[C@@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21,C05521163_decoy,TRY1,Decoy,0,-8.19941,-5.22,-4.15,-5.445460806984747
CNC(=O)c1nc[nH]c1/N=C(/NCC[NH+]1CCOCC1)Nc1ccccc1,C04817928_decoy,TRY1,Decoy,0,-7.28979,-5.87,-0.79,-5.6613103180103215
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NC3CC3)C[NH+]12)NCc1cccnc1,C15707943_decoy,TRY1,Decoy,0,-7.39059,-5.7,-3.5,-5.222286152744464
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NC3CC3)C[NH+]12)NCc1cccs1,C15708012_decoy,TRY1,Decoy,0,-8.97205,-6.26,-1.45,-6.863688832103946
C[NH+](Cc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccc(F)cc1F,C20465948_decoy,TRY1,Decoy,0,-7.10339,-7.97,-1.69,-6.837013295611119
C[C@@H](O)CNCC[NH2+]Cc1cc(Cl)ccc1OCC(=O)NC(C)(C)C,C20873530_decoy,TRY1,Decoy,0,-9.73735,-6.56,-2.8,-9.907476539176258
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+](CC(N)=O)C(C)C)C1=O,C26922817_decoy,TRY1,Decoy,0,-6.84293,-6.19,-1.88,-6.543551616417373
CCCNC(=O)C[NH+]1CCC(NC(=O)NC[C@H](O)c2ccc(OC)cc2)CC1,C41450569_decoy,TRY1,Decoy,0,-7.74382,-5.09,-2.5,-5.48341822051894
Cc1c(NC(=O)C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cccc1C(N)=O,C41648925_decoy,TRY1,Decoy,0,-8.09186,-7.29,-2.41,-6.696204374910122
Cc1c(NC(=O)C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cccc1C(N)=O,C41648930_decoy,TRY1,Decoy,0,-8.83943,-6.05,-2.42,-6.3142130454423
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41730246_decoy,TRY1,Decoy,0,-8.20022,-7.74,-3.4,-6.918415829722315
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C41730444_decoy,TRY1,Decoy,0,-9.17962,-7.22,-1.44,-7.432439206320604
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C41730453_decoy,TRY1,Decoy,0,-9.39875,-6.81,-3.81,-7.715987581550925
CCC(CC)(CNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)[NH+](C)C,C41885776_decoy,TRY1,Decoy,0,-9.33414,-5.02,-4.16,-6.756078561298316
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)[NH+](C)C)nc1,C43189560_decoy,TRY1,Decoy,0,-7.54452,-6.07,-3.63,-5.613822245538944
NC(=O)C[C@@H]([NH3+])c1cc([N+](=O)[O-])ccc1Oc1ccccc1C(F)(F)F,C44254038_decoy,TRY1,Decoy,0,-7.41759,-6.52,-2.79,-8.54006769796607
NC(=O)C[C@H]([NH3+])c1cc([N+](=O)[O-])ccc1Oc1ccccc1C(F)(F)F,C44254041_decoy,TRY1,Decoy,0,-7.38231,-6.97,-2.19,-7.631867491748506
Cc1cccc(NC(=O)C[NH+]2CCN(CC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)CC2)c1C,C45606227_decoy,TRY1,Decoy,0,-7.83835,-6.5,-2.75,-6.553156557777636
NC(=O)N[C@@H](CC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1F,C46917833_decoy,TRY1,Decoy,0,-7.99757,-7.17,-2.33,-7.906851502378327
NC(=O)N[C@H](CC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1F,C46917839_decoy,TRY1,Decoy,0,-8.14331,-7.61,-2.05,-7.978370881131791
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)Cc1ccc(C)cc1,C47613643_decoy,TRY1,Decoy,0,-8.22923,-5.82,-2.28,-6.001286785193423
CC(C)[NH+](CCNC(=O)NCCc1ccc(S(N)(=O)=O)cc1)C(C)C,C47617308_decoy,TRY1,Decoy,0,-8.61627,-5.65,-1.87,-6.399247297902321
CN(C)c1[nH+]cccc1CNC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C47617549_decoy,TRY1,Decoy,0,-8.3688,-7.16,-2.77,-6.980501321536127
NC(=O)CCOc1ccccc1NC(=O)NC1CCN(c2cccc[nH+]2)CC1,C47878535_decoy,TRY1,Decoy,0,-8.27957,-7.26,-4.82,-8.280947030898593
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccccc1,C48850862_decoy,TRY1,Decoy,0,-8.64439,-5.38,-1.21,-5.725355995111567
NC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1,C48852611_decoy,TRY1,Decoy,0,-8.29669,-7.56,-1.86,-6.787207922382988
Cc1c(NC(=O)C(=O)NCc2ccccc2C[NH+]2CCCC2)cccc1C(N)=O,C49392636_decoy,TRY1,Decoy,0,-8.45518,-7.83,-1.45,-6.817879333368812
CCC[C@@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C51055905_decoy,TRY1,Decoy,0,-7.97104,-6.68,-1.18,-7.805017694892867
CCC[C@@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C51055909_decoy,TRY1,Decoy,0,-8.68261,-6.3,-1.24,-9.46259812006836
C[C@@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1cccc(S(N)(=O)=O)c1,C53526073_decoy,TRY1,Decoy,0,-9.42035,-5.39,-1.97,-5.731857521054053
Cc1c(C[NH2+]CCc2n[nH]c(-c3ccncc3)n2)c2ccccc2n1CC(N)=O,C55168430_decoy,TRY1,Decoy,0,-8.69657,-6.58,-1.64,-6.203505682525627
CSc1ccccc1NC(=O)C[NH+](C)CC(=O)Nc1ccccc1C(N)=O,C31039728_decoy,TRY1,Decoy,0,-6.74101,-7.37,-2.3,-6.935235587926819
C[NH+](CCC(=O)NC(N)=O)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C31161372_decoy,TRY1,Decoy,0,-6.4566,-6.78,-1.53,-6.469559935781888
CCc1ccccc1NC(=O)C[NH+](C)CC(=O)c1c(N)n(CC)c(=O)[nH]c1=O,C60993300_decoy,TRY1,Decoy,0,-6.65683,-7.17,-3.09,-6.980134237036092
NC(=O)CSc1ccccc1NC(=O)NC1CC[NH+](CC(F)F)CC1,C61750901_decoy,TRY1,Decoy,0,-8.1807,-4.98,-1.7,-6.210896080876357
COCC[NH+](C)CCCNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(N)=O,C63744462_decoy,TRY1,Decoy,0,-7.84361,-6.49,-2.32,-5.91297395064033
C[C@@H](CNC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])[NH+](C)C,C63769288_decoy,TRY1,Decoy,0,-7.96848,-5.27,-3.51,-5.465742397134315
NS(=O)(=O)c1ccc(CCNC(=O)NC2CC[NH+](CC(F)F)CC2)cc1,C64256253_decoy,TRY1,Decoy,0,-7.91224,-6.64,-3.79,-5.337655847493478
Cc1ccc(N2N[NH2+]N[C@H]2SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])cc1C,C64684689_decoy,TRY1,Decoy,0,-9.98189,-8.32,-2.35,-7.028088188646492
Cc1ccc(NC(=O)C(=O)N[C@@H](C)CO)cc1NC(=O)C[NH+]1CCCCC1,C65556178_decoy,TRY1,Decoy,0,-8.18943,-5.34,-2.0,-5.456081336616407
CC[NH+](CC)[C@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)c1ccco1,C65602332_decoy,TRY1,Decoy,0,-8.68685,-6.82,-3.68,-7.59454738972184
COc1cccc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)c1OCCC(C)C,C66115432_decoy,TRY1,Decoy,0,-7.63042,-5.69,-1.63,-5.813521507335053
CCCNC(=O)C[NH+]1CCC(NC(=O)NNC(=O)Cc2ccccc2F)CC1,C66909016_decoy,TRY1,Decoy,0,-7.15494,-6.13,-3.61,-5.132945262517468
CC[NH+](C)CCNC(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C66987427_decoy,TRY1,Decoy,0,-7.44141,-6.72,-1.95,-5.727768082733928
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccccc2SCC(N)=O)CC1,C67542464_decoy,TRY1,Decoy,0,-8.38413,-6.95,-3.46,-10.9629036791855
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)Cc2ccc(F)cc2)CC1,C67638418_decoy,TRY1,Decoy,0,-8.17031,-5.77,-4.39,-5.406852077202425
C[NH2+][C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2ccc(NCCO)c(=O)cc21,C02944437_decoy,TRY1,Decoy,0,-8.54332,-5.7,-1.48,-5.334096207835258
COc1ccc(N2CC[NH+](Cc3nc4c(c(=O)[nH]c(=O)n4C)n3CC(N)=O)CC2)cc1,C04019757_decoy,TRY1,Decoy,0,-8.11008,-7.81,-1.95,-8.903559430592235
NS(=O)(=O)c1ccc(CC[NH2+][C@H]2CC(=O)N(Cc3cccs3)C2=O)cc1,C02211100_decoy,TRY1,Decoy,0,-9.42353,-7.14,-3.41,-9.184819614815998
CCOC(=O)[C@H]1CCC[NH+]([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1,C08319128_decoy,TRY1,Decoy,0,-9.74026,-6.85,-1.55,-6.611005851656594
CSc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)cc1,C02375002_decoy,TRY1,Decoy,0,-9.04665,-7.12,-2.91,-6.614134508579524
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1cccc(F)c1F)NCCN1CCNC1=O,C12303716_decoy,TRY1,Decoy,0,-7.82669,-5.76,-1.9,-5.071361121619299
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1cccc(F)c1F)NCCN1CCNC1=O,C12303717_decoy,TRY1,Decoy,0,-8.0377,-7.7,-1.8,-7.706102789275496
CCc1ccc2c(c1)[C@]1([NH2+][C@H]([C@@H](C)O)[C@H]3C(=O)N(CCCOC)C(=O)[C@H]31)C(=O)N2,C12901575_decoy,TRY1,Decoy,0,-7.15757,-5.95,-1.43,-5.697141094960186
O=C1NC[C@@H](CCC(=O)N2CCCCC2)[NH+]2C[C@@H](NC(=S)NC3CC3)C[C@@H]12,C15708542_decoy,TRY1,Decoy,0,-8.54045,-4.82,-1.24,-5.208848169594882
CC[NH+]1CCN(c2nc(NCCCN3CCOCC3)nc(N)c2[N+](=O)[O-])CC1,C20357658_decoy,TRY1,Decoy,0,-7.66361,-5.25,-1.06,-4.891092012342828
[NH3+]CCCCNc1ncnc2c1sc1nc(N3CCOCC3)c3c(c12)CCC3,C20357900_decoy,TRY1,Decoy,0,-10.274,-6.58,-1.6,-6.47999227391203
O=C(NCCN1CC[NH2+]CC1)/C(=C/c1ccc([N+](=O)[O-])o1)NC(=O)c1ccco1,C26805653_decoy,TRY1,Decoy,0,-8.64095,-7.28,-1.27,-7.183507078161135
CC1(C(=O)N2C[C@@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)CCCCC1,C39601721_decoy,TRY1,Decoy,0,-7.91402,-5.82,-3.27,-5.598684239115341
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39602007_decoy,TRY1,Decoy,0,-7.12198,-5.83,-2.52,-4.788369836773693
C[NH+]1CCN(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])CC1,C40623633_decoy,TRY1,Decoy,0,-7.37017,-7.21,-2.15,-7.088545627163141
Cc1ccc(C(=O)NNc2ncnc(NCCCn3cc[nH+]c3)c2[N+](=O)[O-])cc1,C40657544_decoy,TRY1,Decoy,0,-6.79154,-7.18,-3.54,-5.7618781029145145
O=C(Cc1ccccc1)NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-],C40659449_decoy,TRY1,Decoy,0,-6.22161,-7.49,-1.31,-6.367189297616129
COc1ccc(S(=O)(=O)c2c(C[C@H]([NH3+])CO)c(-c3ccccc3)nn2C)cc1,C44466463_decoy,TRY1,Decoy,0,-7.13798,-6.33,-2.23,-5.407414077371794
CC(C)CNC(=O)NC(=O)[C@H](C)N1CC[NH+](CCNC(=O)c2ccco2)CC1,C46765916_decoy,TRY1,Decoy,0,-8.63199,-6.41,-2.38,-6.740402440840441
CC[NH+]1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NCCNC(C)=O)CC1,C48736723_decoy,TRY1,Decoy,0,-8.9143,-6.68,-0.45,-8.23049755503262
CC(C)c1ccc(N2C(=O)/C(=C/NCCN3CC[NH2+]CC3)C(=O)NC2=S)cc1,C19994875_decoy,TRY1,Decoy,0,-8.56929,-5.35,-0.39,-5.703315193334504
NS(=O)(=O)c1ccc(CC[NH2+][C@@H]2CC(=O)N(Cc3cccs3)C2=O)cc1,C18105623_decoy,TRY1,Decoy,0,-9.15329,-6.18,-2.18,-5.677150776987912
Cc1ncsc1C(=O)NC1CC[NH+]([C@@H](C)C(=O)NC(=O)NCC(C)C)CC1,C51099664_decoy,TRY1,Decoy,0,-8.5638,-5.81,-0.96,-6.812337714784863
CCS(=O)(=O)NCCCNC(=O)NCC[NH+]1CCN(c2ncccn2)CC1,C51710195_decoy,TRY1,Decoy,0,-7.70553,-5.92,-1.9,-5.463042302481889
CCCNC(=O)C[NH+](CCC)CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O,C53366727_decoy,TRY1,Decoy,0,-7.74009,-6.51,-2.96,-6.57330002988729
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C55711279_decoy,TRY1,Decoy,0,-8.22429,-7.63,-1.71,-6.589682928955871
CC(C)Cn1c(N)c(C(=O)CN2CC[NH+](CCC(C)(C)C)CC2)c(=O)[nH]c1=O,C55934183_decoy,TRY1,Decoy,0,-7.44993,-6.1,-4.67,-5.427125955386221
C[NH+]1CCN(c2ccc(/C=N\NC(=O)Cc3nnc(N)s3)cc2[N+](=O)[O-])CC1,C33626631_decoy,TRY1,Decoy,0,-6.32955,-6.44,-1.29,-5.361108527515372
COCCCNC(=O)C1CC[NH+]([C@@H](C)C(=O)NC(=O)NCC(F)(F)F)CC1,C60494232_decoy,TRY1,Decoy,0,-6.64045,-6.38,-2.72,-6.188608109084592
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2ccc(OCCOC)nc2)CC1,C57505273_decoy,TRY1,Decoy,0,-8.22739,-4.68,-1.82,-5.610189518489171
C[NH+](C)Cc1ccccc1CNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2,C61964686_decoy,TRY1,Decoy,0,-9.51803,-6.68,-1.4,-6.121747248401483
CS(=O)(=O)N[C@H]1N/C(=C\C(=O)NCCC2=c3cc(F)ccc3=[NH+]C2)CS1,C63293998_decoy,TRY1,Decoy,0,-7.90979,-7.34,-2.29,-5.658591446043405
CC[NH+]1CCN(CCCNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]23)CC1,C63704233_decoy,TRY1,Decoy,0,-8.45073,-5.69,-1.34,-5.29971701383225
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)NCCCn2cc[nH+]c2)c1C,C64375837_decoy,TRY1,Decoy,0,-6.52841,-7.42,-4.27,-6.127284207367983
N#Cc1cccnc1N1CCC[NH+](CCC(=O)Nc2sccc2C(N)=O)CC1,C64633153_decoy,TRY1,Decoy,0,-9.16754,-7.09,-1.66,-6.136539126474129
CN(C)c1nc2sc(C(=O)NNC(=O)NCCCn3cc[nH+]c3)cc2s1,C64885819_decoy,TRY1,Decoy,0,-8.04934,-4.34,-2.84,-5.701298001778
CN(CC(=O)NNC(=O)NCCCn1cc[nH+]c1)S(=O)(=O)c1ccccc1,C64886104_decoy,TRY1,Decoy,0,-6.78804,-7.58,-4.59,-6.781779760900306
O=S(=O)(NC[C@@H]1[NH+]=C(c2cccc(-c3ccn[nH]3)c2)NO1)c1ccc(F)cc1,C65137084_decoy,TRY1,Decoy,0,-8.65831,-8.89,-1.59,-6.752944156271929
CCn1ncnc1[C@@H]1[C@H](c2ccccc2)NC[NH+]1CCNc1nc(C)cc(=O)[nH]1,C65410950_decoy,TRY1,Decoy,0,-7.11457,-6.91,-2.07,-6.510819592391935
Cn1cc[nH+]c1CCNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1,C66233791_decoy,TRY1,Decoy,0,-8.30808,-7.7,-2.96,-7.184967753630128
CC[NH+](CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NC(=O)C2CCOCC2)o1,C66828758_decoy,TRY1,Decoy,0,-8.52049,-5.68,-2.73,-6.179538762203807
NC(=O)c1ccsc1NC(=O)CC[NH+]1CCN(c2ccc(Cl)cn2)CC1,C66869155_decoy,TRY1,Decoy,0,-8.01359,-6.61,-1.04,-5.266568491987597
O=C(NCCCn1cc[nH+]c1)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1,C66982512_decoy,TRY1,Decoy,0,-6.20028,-6.12,-3.95,-4.843863926746576
CCNc1nc(NCC)[n+]2c(n1)SC[C@]2(O)Nc1cccc(Cl)c1Cl,C67321186_decoy,TRY1,Decoy,0,-7.95998,-4.89,-1.64,-4.667822428285088
CCNc1nc(NCC)[n+]2c(n1)SC[C@]2(O)Nc1cc(Cl)ccc1Cl,C67321239_decoy,TRY1,Decoy,0,-8.00482,-6.64,-1.79,-6.860017274580966
CCCC[NH+](CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O)[C@@H]1CCS(=O)(=O)C1,C67399916_decoy,TRY1,Decoy,0,-7.51584,-6.38,-1.41,-7.484016516755783
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCc3cccc(NC(C)=O)c3)c2C1,C67495911_decoy,TRY1,Decoy,0,-8.91485,-7.8,-3.38,-7.410508285149692
C[NH+]1CCN(C(C)(C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67612187_decoy,TRY1,Decoy,0,-8.52664,-6.58,-0.87,-5.579167384903959
CC[NH+]1CCN(CCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC1,C67613141_decoy,TRY1,Decoy,0,-10.0229,-5.15,-1.3,-6.9780229207599005
CC[NH+]1CCN(CCCNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67613145_decoy,TRY1,Decoy,0,-9.34007,-6.46,-2.34,-6.967311477577952
[NH2+]=C(CSc1ncc(C(F)(F)F)cc1Cl)NNC(=O)c1ccncc1,C01401265_decoy,TRY1,Decoy,0,-8.01709,-6.39,-1.8,-5.559796400671996
Cc1cc2cc(CN(CCO)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2cc1C,C04132959_decoy,TRY1,Decoy,0,-7.63409,-6.64,-3.49,-6.536900602285594
CC(=O)C1=C(O)C(=O)N(CCC[NH2+]CCO)[C@H]1c1ccc(Cl)cc1Cl,C04453682_decoy,TRY1,Decoy,0,-8.16656,-4.56,-1.73,-5.760059114984889
CCn1c(N)c(C(=O)C[NH+](C)Cc2ccc(Cl)c(Cl)c2)c(=O)[nH]c1=O,C07976283_decoy,TRY1,Decoy,0,-7.68493,-6.86,-3.62,-6.874542006555682
COc1ccc(SCC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C)C3)cc1,C10022424_decoy,TRY1,Decoy,0,-9.61085,-6.55,-5.44,-6.021590069516637
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1ccccc1F)NCc1n[nH]c2c1CCC2,C11820158_decoy,TRY1,Decoy,0,-8.07197,-7.15,-1.96,-6.378387027610335
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccccc1F)NCc1n[nH]c2c1CCC2,C11820159_decoy,TRY1,Decoy,0,-7.24798,-8.11,-1.96,-7.241483230885606
CC(C)(C)[C@@H]1CCc2onc(C(=O)NCCC[NH+]3CCC(C(N)=O)CC3)c2C1,C19715937_decoy,TRY1,Decoy,0,-8.56088,-6.9,-3.06,-6.038171700118046
Cc1cc(C)c2nc(NCCNC(=S)NCCC[NH+](C)C)c(C#N)cc2c1,C20151266_decoy,TRY1,Decoy,0,-7.64897,-4.73,-2.54,-4.8742025763627215
Cc1ccccc1C[NH+]1CCN([C@@H](C)C(=O)Nc2sccc2C(N)=O)CC1,C22932408_decoy,TRY1,Decoy,0,-7.84166,-6.56,-1.55,-8.307879755203016
C[C@H]1CCc2c(sc(NC(=O)CN3CC[NH+](Cc4ccc(F)cc4)CC3)c2C(N)=O)C1,C19641497_decoy,TRY1,Decoy,0,-8.53472,-7.27,-1.65,-7.174374301210731
CC(C)S(=O)(=O)c1ccc([C@@H](CNBr)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534449_decoy,TRY1,Decoy,0,-7.32857,-6.74,-3.21,-6.926842229803243
CC(C)S(=O)(=O)c1ccc([C@H](CNBr)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534450_decoy,TRY1,Decoy,0,-8.52488,-6.79,-2.28,-6.071186134946435
O=C(NCCNc1ccccc1)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39655419_decoy,TRY1,Decoy,0,-9.00675,-6.81,-1.27,-6.463137530139232
CC(=O)N1C[C@@H](C(=O)NCc2ccccc2Sc2ccccc2CO)C2(CC[NH2+]CC2)C1,C39657670_decoy,TRY1,Decoy,0,-8.91147,-7.42,-3.29,-6.82381679096381
C[NH+](C)[C@@H](CNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccco1,C43138322_decoy,TRY1,Decoy,0,-9.17194,-7.06,-3.79,-6.449264150786305
CC(=O)Nc1cc(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1F,C44016078_decoy,TRY1,Decoy,0,-8.37942,-7.03,-1.28,-6.171681117484642
COc1ccccc1C1CCN(c2ccc([C@H]([NH3+])CCO)cc2[N+](=O)[O-])CC1,C44235168_decoy,TRY1,Decoy,0,-9.54006,-7.18,-3.35,-6.372145321616613
COc1ccccc1C1CCN(c2ccc([C@@H]([NH3+])CCO)cc2[N+](=O)[O-])CC1,C44235172_decoy,TRY1,Decoy,0,-9.77582,-6.73,-2.56,-5.994901320591041
COC(=O)c1ccccc1Sc1c(C[C@@H]([NH3+])CO)c(-c2ccccc2)nn1C,C44464814_decoy,TRY1,Decoy,0,-6.98511,-6.71,-2.35,-7.095694001720344
CCOc1ccc(Nc2c(C)c(NC[C@H]3CC[NH2+]C3)c(C#N)c3ccnn23)cc1,C45244982_decoy,TRY1,Decoy,0,-7.71194,-7.61,-0.94,-7.015466911042789
CC(C)NC(=O)Cc1ccc(NC(=O)NCCC[NH+](C)CC(F)(F)F)cc1,C46005737_decoy,TRY1,Decoy,0,-7.07857,-4.53,-2.07,-4.867295580413827
CN(C)c1[nH+]cccc1CNC(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1,C47589588_decoy,TRY1,Decoy,0,-8.04193,-7.32,-2.07,-7.12787093089993
CNC(=O)c1cc(NC(=O)C(=O)NCCC[NH+]2C[C@H](C)C[C@H](C)C2)ccc1F,C50165547_decoy,TRY1,Decoy,0,-8.56179,-6.79,-3.92,-5.831615851847676
CCN(CC)C(=O)Nc1ccc([C@H](C)NC(=O)N[C@@H]2CCC[NH+](CC)C2)cc1,C52550017_decoy,TRY1,Decoy,0,-7.95075,-5.1,-2.58,-5.28876656280986
CCc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccc(F)cc2)[NH+](C)C)cc1,C54920586_decoy,TRY1,Decoy,0,-7.95278,-5.77,-1.84,-5.546190014202268
CC(=O)Nc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)cc1,C54946474_decoy,TRY1,Decoy,0,-8.1508,-7.6,-3.38,-6.01499070206119
CC(=O)Nc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)cc1,C54946476_decoy,TRY1,Decoy,0,-7.66966,-7.54,-2.73,-5.985457865392511
C[C@H]1CCC[NH+](Cc2ccccc2CN[C@@H](C)C(=O)NC(=O)NC(C)(C)C)C1,C56156157_decoy,TRY1,Decoy,0,-7.68522,-7.32,-2.18,-6.972102465273585
CC(C)CNC(=O)NC(=O)C[NH+](C)CC(=O)Nc1ccc(Cl)c(Cl)c1,C08065518_decoy,TRY1,Decoy,0,-7.22336,-6.68,-1.84,-6.550697652616199
Cc1ccccc1OCC[NH+](C)CC(=O)Nc1ccccc1SCC(N)=O,C15099703_decoy,TRY1,Decoy,0,-8.0862,-7.01,-3.02,-6.764187308663192
C[NH+](C)[C@@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1,C47727867_decoy,TRY1,Decoy,0,-7.41936,-5.96,-2.0,-5.757848713659649
O=C(NC[C@H](O)c1ccccc1F)C(=O)Nc1ccccc1C[NH+]1CCCC1,C62132206_decoy,TRY1,Decoy,0,-8.27594,-7.95,-1.69,-8.325139160491519
O=C(NCc1cccc(C[NH+]2CCCC2)c1)Nc1cc(C(F)(F)F)c[nH]c1=O,C63162105_decoy,TRY1,Decoy,0,-9.04584,-5.96,-2.49,-5.437454258140249
CC[C@@H]1Nc2ccccc2N1CC(=O)NNC(=O)CCC1=c2ccccc2=[NH+]C1,C63195039_decoy,TRY1,Decoy,0,-8.72849,-7.1,-1.35,-6.640361869307757
CCCC(=O)Nc1cccc(NC(=O)C(=O)NC2CC[NH+](C3CC3)CC2)c1C,C63203951_decoy,TRY1,Decoy,0,-9.29941,-6.49,-1.46,-6.646718519048775
C#CCNC(=O)CCNC(=O)NCc1ccc(N2CCc3ccccc3C2)[nH+]c1,C64643278_decoy,TRY1,Decoy,0,-8.35518,-7.3,-1.34,-6.320649290823849
CC(=O)Nc1cc(NC(=O)C(=O)NC[C@H](C)[NH+]2CCC(C)CC2)c(F)cc1F,C65601352_decoy,TRY1,Decoy,0,-7.91426,-6.4,-3.18,-5.105568684461244
Cc1cccc(OC[C@H](O)CNC(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)c1,C66334117_decoy,TRY1,Decoy,0,-8.46632,-7.25,-2.4,-6.660971117009649
CC(C)c1c(C(=O)N[C@@H]2CCC[NH+](CC(N)=O)C2)cnn1-c1ccc(F)cc1,C66448512_decoy,TRY1,Decoy,0,-8.09617,-4.87,-2.15,-5.204586339000855
Cc1ccc(Sc2ncccc2C(=O)N[C@H]2CCC[NH+](CC(N)=O)C2)c(C)c1,C66448855_decoy,TRY1,Decoy,0,-9.02449,-6.17,-2.58,-5.589245101427937
CCC[NH+]1Cc2cccc(NC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)c2C1,C66514531_decoy,TRY1,Decoy,0,-8.0328,-7.29,0.32,-5.896287370548544
Cc1nn(CCO)c(C)c1C[NH2+]C[C@@H](O)COc1ccc(C(F)(F)F)cc1,C67254998_decoy,TRY1,Decoy,0,-7.08243,-5.47,-1.78,-4.795823646918688
CNC(=O)c1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2CCC[C@H](C)C2)c(C)c1,C67392814_decoy,TRY1,Decoy,0,-8.29487,-6.93,-1.48,-6.408667557878054
CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NCC(C)(C)[NH+]2CCC[C@H](C)C2)c1,C67392835_decoy,TRY1,Decoy,0,-8.043,-6.91,-2.13,-6.26002535088519
CCC(=O)Nc1ccc(NC(=O)C(=O)NCC(C)(C)[NH+]2CCC[C@@H](C)C2)cc1,C67392967_decoy,TRY1,Decoy,0,-8.79024,-6.94,-3.72,-6.511864303520111
CC(=O)Nc1cc(NC(=O)C(=O)NCC(C)(C)[NH+]2CCC[C@H](C)C2)ccc1F,C67393021_decoy,TRY1,Decoy,0,-7.93083,-6.8,-1.54,-5.61549867756666
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NC[C@H](O)c3ccccc3F)c2C1,C67498128_decoy,TRY1,Decoy,0,-8.27512,-6.94,-2.3,-6.012621111559005
Cc1cc(N2CCOCC2)ccc1NC(=O)NC[C@H](O)C[NH+]1CCC(C)CC1,C67542107_decoy,TRY1,Decoy,0,-8.76417,-7.42,-1.36,-6.272333735291165
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)CC1,C67582149_decoy,TRY1,Decoy,0,-8.52346,-5.37,-1.52,-5.267208276582746
COC(=O)c1ccc(-c2ccc(C[NH2+]CCNC(=O)c3nonc3N)o2)cc1,C05324085_decoy,TRY1,Decoy,0,-7.62027,-7.27,-3.16,-6.431238989330314
CCOc1cc(C[NH2+][C@H](CC)CO)cc(Br)c1OCC(N)=O,C08327005_decoy,TRY1,Decoy,0,-8.31827,-4.56,-2.75,-5.111512118511536
C[C@@H](C(=O)NCCc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1,C09376697_decoy,TRY1,Decoy,0,-9.82135,-8.19,-2.13,-6.950052623727469
C[C@H](C(=O)NCCc1ccc(S(N)(=O)=O)cc1)[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1,C09376698_decoy,TRY1,Decoy,0,-7.63134,-8.81,-4.36,-5.901987994155943
CC(C)(CO)[NH2+]C[C@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21,C05521160_decoy,TRY1,Decoy,0,-8.23274,-6.42,-2.49,-5.812182691053565
NC(=O)CCS(=O)(=O)CC[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C15043744_decoy,TRY1,Decoy,0,-7.88743,-6.79,-2.63,-6.919214719274871
C[NH+](CCc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccsc1,C20465797_decoy,TRY1,Decoy,0,-8.24104,-5.46,-2.32,-6.3966468119998
NC(=O)c1cc(NC(=O)C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)cc(C(N)=O)c1,C12996012_decoy,TRY1,Decoy,0,-8.96849,-8.42,-1.27,-6.408974919269946
CCC(CC)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661780_decoy,TRY1,Decoy,0,-9.97237,-5.22,-1.37,-6.81053253247181
CCC(CC)C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661781_decoy,TRY1,Decoy,0,-7.86377,-7.91,-1.21,-11.593921117670565
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1cccc(C(N)=O)c1C)CC(C)C,C41333852_decoy,TRY1,Decoy,0,-7.97234,-4.94,-3.19,-5.667256292772583
CCCNC(=O)C[NH+]1CCC(NC(=O)NC[C@@H](O)c2ccc(OC)cc2)CC1,C41450572_decoy,TRY1,Decoy,0,-7.35976,-5.33,-3.97,-5.754561537906675
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41730242_decoy,TRY1,Decoy,0,-9.14608,-7.4,-1.59,-8.244018417284993
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41730250_decoy,TRY1,Decoy,0,-8.22395,-7.83,-1.11,-7.832109502695281
C[C@@H]1C[C@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41730469_decoy,TRY1,Decoy,0,-9.24763,-6.86,-1.19,-6.718401194001001
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C41730477_decoy,TRY1,Decoy,0,-9.97417,-7.74,-1.41,-9.559218671979243
NC(=O)N[C@@H](CC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1F,C46917836_decoy,TRY1,Decoy,0,-8.37486,-5.9,-2.4,-6.096996768435758
NC(=O)N[C@H](CC(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccccc1F,C46917842_decoy,TRY1,Decoy,0,-8.08624,-6.69,-2.37,-6.036570586094225
CCNC(=O)NC(=O)C[NH+](CCc1ccccc1F)CC(=O)NC(=O)NCC,C47614031_decoy,TRY1,Decoy,0,-7.94897,-5.96,-3.03,-6.954642054919326
CCCNC(=O)C[NH+]1CCC(NC(=O)Nc2cc(NC(C)=O)ccc2C)CC1,C48271411_decoy,TRY1,Decoy,0,-7.76097,-6.04,-2.47,-6.0564677996266445
CC[NH+](CC)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccccc1,C48850865_decoy,TRY1,Decoy,0,-7.368,-6.89,-2.89,-5.980154679241436
NC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@@H](c1ccccc1)[NH+]1CCCC1,C48852613_decoy,TRY1,Decoy,0,-7.92141,-8.0,-4.24,-9.047533876957996
CCC[C@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C51055907_decoy,TRY1,Decoy,0,-8.54712,-6.55,-2.95,-6.310308801350766
CCC[C@H](C)NC(=O)[C@H]1CCC[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C51055911_decoy,TRY1,Decoy,0,-8.24281,-6.23,-4.8,-5.787584270009934
C[C@H](NC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1cccc(S(N)(=O)=O)c1,C53526069_decoy,TRY1,Decoy,0,-8.50464,-7.31,-4.63,-6.781967784581702
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)NCCc3ccc(S(N)(=O)=O)cc3)sc2[nH+]1,C29033408_decoy,TRY1,Decoy,0,-9.32593,-7.64,-1.98,-6.404102406934453
CCCNC(=O)NC(C)(C)C(=O)NCc1cccc(NC(=O)C[NH+](C)C)c1,C58379128_decoy,TRY1,Decoy,0,-6.34913,-6.25,-3.82,-5.003027011414657
CSCC[C@H](NC(N)=O)C(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1,C41399776_decoy,TRY1,Decoy,0,-8.38573,-6.46,-4.18,-8.019787145543932
C[NH+](C)[C@@H](CNC(=O)Nc1ccccc1OCCC(N)=O)c1cccs1,C47876998_decoy,TRY1,Decoy,0,-8.38779,-6.44,-4.15,-6.693424682801187
C[NH+](C)[C@H](CNC(=O)Nc1ccccc1OCCC(N)=O)c1cccs1,C47876999_decoy,TRY1,Decoy,0,-8.5686,-6.41,-2.34,-8.068613456652468
NC(=O)Cc1ccccc1NC(=O)C(=O)NC1CC[NH+](CC2CCCC2)CC1,C63433994_decoy,TRY1,Decoy,0,-8.20905,-6.63,-0.72,-5.960936554302479
CCC(CC)[C@H](CNC(=O)C(=O)Nc1cc(C(N)=O)ccc1C)[NH+]1CCCC1,C63825706_decoy,TRY1,Decoy,0,-8.57503,-6.74,-3.78,-7.40489132502529
Cc1ccc(N2N[NH2+]N[C@H]2SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c(C)c1,C64683775_decoy,TRY1,Decoy,0,-8.18164,-8.17,-2.19,-6.457031934253438
Cc1ccc(N2N[NH2+]N[C@@H]2SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c(C)c1,C64683778_decoy,TRY1,Decoy,0,-9.40487,-7.89,-3.36,-6.964619769322294
CCCCNC(=O)[C@H]1CC[C@@H](C)[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C64995413_decoy,TRY1,Decoy,0,-8.86878,-6.47,-3.35,-8.91960213621057
CCCNC(=O)C[NH+]1CCC(NC(=O)NCC(=O)Nc2cccc(F)c2)CC1,C51271729_decoy,TRY1,Decoy,0,-7.52331,-6.47,-4.13,-5.836845629900406
COc1cccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)c1OCCC(C)C,C66115431_decoy,TRY1,Decoy,0,-7.85448,-4.78,-4.61,-5.1272191355899706
NC(=O)c1ccsc1NC(=O)C[NH+]1CCC(NC(=O)CC2CCCC2)CC1,C66875230_decoy,TRY1,Decoy,0,-8.31421,-7.14,-2.86,-6.7672639002362445
Cc1n[nH]c(C)c1CNC(=O)Nc1cccc(NC(=O)CC[NH+]2CCCCC2)c1,C66953242_decoy,TRY1,Decoy,0,-9.28858,-7.81,-2.18,-7.214258964107162
C[C@@H](O)CNC(=O)C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C67490029_decoy,TRY1,Decoy,0,-7.60975,-6.38,-4.35,-5.128197566598834
Cc1ccc(NC(=O)C(=O)NCc2ccccc2C[NH+]2CCCC2)cc1C(N)=O,C67493783_decoy,TRY1,Decoy,0,-8.77381,-7.52,-1.41,-6.189931417560665
Cc1ccc(NC(=O)C(=O)NC[C@@H](C(C)C)[NH+]2CCCCCC2)cc1C(N)=O,C67495476_decoy,TRY1,Decoy,0,-9.20423,-7.31,-2.86,-5.941103609306093
Cc1ccc(NC(=O)C(=O)NC[C@H](C(C)C)[NH+]2CCCCCC2)cc1C(N)=O,C67495479_decoy,TRY1,Decoy,0,-9.16376,-7.15,-1.53,-6.104558175015312
CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(C(N)=O)c2)c[nH+]1,C67496268_decoy,TRY1,Decoy,0,-8.68995,-6.46,-2.43,-6.836709113740264
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccccc2SCC(N)=O)CC1,C67542463_decoy,TRY1,Decoy,0,-9.37863,-6.63,-2.86,-7.085758812297788
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NC[C@@H](O)C[NH+]1CCC(C)CC1,C67542954_decoy,TRY1,Decoy,0,-8.22453,-6.7,-3.0,-5.804849776323887
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)c2ccccc2Cl)CC1,C67614969_decoy,TRY1,Decoy,0,-9.11185,-5.41,-2.8,-5.370798164710543
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)c2ccccc2F)CC1,C67631778_decoy,TRY1,Decoy,0,-8.2712,-7.25,-4.16,-7.555774761512364
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)Cc2ccc(F)cc2)CC1,C67638416_decoy,TRY1,Decoy,0,-8.86302,-6.23,-2.88,-6.189893581085776
Cc1ccc(Oc2ncccc2CNC(=O)[C@@H]([NH3+])Cc2c[nH]cn2)c(F)c1F,C67643425_decoy,TRY1,Decoy,0,-7.49124,-7.99,-1.45,-7.0625304011433565
CC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)Nc1nccs1,C04222261_decoy,TRY1,Decoy,0,-9.72981,-6.78,-3.49,-7.412994927776262
COC(=O)C1=C(CSc2nnc(N)s2)NC(=O)N[C@@H]1c1cc(C)ccc1C,C04436491_decoy,TRY1,Decoy,0,-9.00724,-6.47,-0.13,-7.605597142137042
CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccccc2OC)cc(Cl)c1O,C00814122_decoy,TRY1,Decoy,0,-8.59321,-6.06,-2.88,-6.916716334314919
O=C(NNC(=S)Nc1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1O,C16345698_decoy,TRY1,Decoy,0,-8.04506,-6.06,-2.87,-5.273657869033352
COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Br)cc(OC)c1O,C16606775_decoy,TRY1,Decoy,0,-7.56907,-4.76,-1.51,-5.647484781097191
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CSCc2ccc(Cl)cc2)[C@H](O)[C@H]1O,C16952902_decoy,TRY1,Decoy,0,-8.04058,-8.0,-0.64,-11.65854932385681
O=C(CCCCCn1c(=S)[nH]c2ccccc2c1=O)NNC(=O)c1ccccc1O,C17576025_decoy,TRY1,Decoy,0,-7.53199,-7.93,-2.95,-6.059342083255455
Nc1nc(N)nc(CSc2nc3sc4c(c3c(=O)n2CCc2ccccc2)CCCC4)n1,C17660807_decoy,TRY1,Decoy,0,-9.48497,-9.51,-0.46,-9.668366491100594
[H]/N=C([N-]S(=O)(=O)c1ccc(/N=C/c2ccccc2O)cc1)\[NH+]=C\c1ccccc1O,C06102956_decoy,TRY1,Decoy,0,-8.29946,-6.47,-2.09,-6.648903905279429
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1c(Cl)cccc1Cl,C20906225_decoy,TRY1,Decoy,0,-9.64708,-8.57,-2.11,-8.06695677380867
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1cccc(Cl)c1Cl,C20906341_decoy,TRY1,Decoy,0,-10.874,-7.11,-2.68,-7.431797778737858
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1ccc(Cl)cc1Cl,C20906467_decoy,TRY1,Decoy,0,-10.0592,-9.27,-5.36,-8.307475366601189
O=C(CCSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)Nc1ccc(Cl)cc1,C21078135_decoy,TRY1,Decoy,0,-9.76939,-5.89,-1.11,-6.2838293548468025
CCOc1cc(/C=N/Nc2nnc(SCc3cccc(C)c3)n2N)ccc1O,C21326497_decoy,TRY1,Decoy,0,-9.50788,-7.2,-1.37,-7.253661259144076
C[C@H](OC(=O)c1nc(Cl)c(Cl)c(N)c1Cl)C(=O)NC(=O)NC(C)(C)C,C16766222_decoy,TRY1,Decoy,0,-9.34699,-6.42,-3.93,-5.6290068024638265
N#Cc1c(CCCCCNc2nc(-c3ccncc3)nc3ccccc23)n[nH]c1N,C23055012_decoy,TRY1,Decoy,0,-9.36674,-8.14,-1.41,-7.9226448051692895
CCc1nc(SCC(=O)NC(=O)NCCOC)nc(N)c1-c1ccc(Cl)cc1,C25588842_decoy,TRY1,Decoy,0,-8.26074,-6.82,-3.46,-6.108315757442036
C=C1CC[C@@H](C(C)C)[C@H](O[C@H]2O[C@@H](COC(C)=O)[C@@H](O)[C@@H](O)[C@H]2O)/C=C(\C)CC[C@H]1O,C35455523_decoy,TRY1,Decoy,0,-7.58466,-6.39,-3.59,-6.5755557082525895
O=C(NC1CCCCC1)[C@@H](c1cccc(O)c1)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500461_decoy,TRY1,Decoy,0,-8.89624,-6.72,-1.32,-7.1777042577247565
CCCC(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36503006_decoy,TRY1,Decoy,0,-7.15169,-7.12,-1.03,-8.376374151521969
C=C(C)C(=O)N(Cc1ccco1)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36505023_decoy,TRY1,Decoy,0,-7.60276,-5.75,-2.37,-5.814996347447251
CN(C(=O)c1ccco1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36529209_decoy,TRY1,Decoy,0,-7.64233,-7.7,-2.97,-8.191603715891345
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@@H](C(=O)NC(C)(C)C)c2ccc(O)cc2)o1,C36597661_decoy,TRY1,Decoy,0,-8.3948,-7.02,-1.44,-7.99500564169146
COCCNC(=O)NC(=O)CSc1nc(N)c2c3c(sc2n1)C[C@@H](C)CC3,C36821053_decoy,TRY1,Decoy,0,-8.08693,-6.86,-2.27,-5.970430611384777
CC(=O)OC[C@@H]1O[C@H](O[C@@H]2/C=C(\C)CC[C@@H](O)/C(C)=C/C[C@H]2C(C)C)[C@H](O)[C@H](O)[C@@H]1O,C37538765_decoy,TRY1,Decoy,0,-6.7164,-5.36,-3.31,-4.674768619332555
CCOC(=O)[C@H]1C2=C(CCCCC2)S[C@@H]1NC(=O)CSc1n[nH]c(N)n1,C38798556_decoy,TRY1,Decoy,0,-9.32845,-7.19,-1.81,-8.42732935943544
CCOC(=O)C1=C(C)Nc2sc(C(=O)Nc3cc(C)on3)c(N)c2[C@H]1c1ccccc1,C39326999_decoy,TRY1,Decoy,0,-8.44022,-6.29,-2.3,-5.472133644654051
O/N=C(Nc1nc(SCc2ccccc2Cl)n[nH]1)\C(=N\O)c1ccccc1,C33592511_decoy,TRY1,Decoy,0,-8.18731,-7.54,-1.5,-6.048494435530908
COc1ccccc1C(=O)NNc1ncnc(N2C[C@]3(C)C[C@H]2CC(C)(C)C3)c1N,C40735123_decoy,TRY1,Decoy,0,-7.72827,-6.07,-2.07,-4.953803440982518
Nc1c(NNC(=O)c2ccc(F)cc2)ncnc1Oc1ccc(Br)c2cccnc12,C40784614_decoy,TRY1,Decoy,0,-8.25388,-8.38,-3.42,-6.049322518547163
Nc1c(NNC(=O)c2ccccc2F)ncnc1Oc1ccc(Br)c2cccnc12,C40784747_decoy,TRY1,Decoy,0,-7.74127,-8.56,-1.87,-5.920012933952584
Nc1c(NNC(=O)c2ccccc2Cl)ncnc1N1CCN(c2ccccc2F)CC1,C40784881_decoy,TRY1,Decoy,0,-8.98197,-5.52,-3.44,-4.991946062366612
CC1(C)C[C@@H](NC(=O)NCc2ccco2)C[C@](C)(CNC(=O)NCc2ccco2)C1,C05415205_decoy,TRY1,Decoy,0,-7.68399,-6.74,-3.38,-6.498549223643635
Cc1ccc([C@@H](CNC(=O)NNC(=S)NC2CCCC2)N2CCOCC2)o1,C45308737_decoy,TRY1,Decoy,0,-9.51339,-6.54,-2.51,-6.933331798048516
CC(C)[C@H](CNC(=O)NNC(=O)C[C@@H]1CCS(=O)(=O)C1)Nc1ccccc1,C45484590_decoy,TRY1,Decoy,0,-7.37275,-5.99,-3.63,-5.369531377224841
C=CCNC(=O)Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc1,C45849436_decoy,TRY1,Decoy,0,-8.3242,-7.77,-1.96,-6.314053193993955
CC[C@H](C)NC(=O)CCNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1,C47552453_decoy,TRY1,Decoy,0,-9.33658,-5.78,-1.83,-6.505792923291503
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c([O-])n(Cc3ccc(OC)cc3)c(=O)[nH]c2=O)[NH2+]1,C20759588_decoy,TRY1,Decoy,0,-8.42837,-6.51,-2.6,-6.167793285552737
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)cc1,C50585033_decoy,TRY1,Decoy,0,-9.22129,-7.93,-1.66,-6.740841645264851
CCOc1ccc(-c2n[nH]c3c2[C@@H](c2cc(Cl)ccc2O)C(C#N)=C(N)O3)cc1OC,C09292257_decoy,TRY1,Decoy,0,-7.62851,-5.97,-1.61,-6.762043614695704
CCCCN1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C16024667_decoy,TRY1,Decoy,0,-8.12146,-4.75,-2.26,-4.769527265395412
CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@@H](c2ccc(O)cc2)n2nc(CCCO)nc2N1,C08437161_decoy,TRY1,Decoy,0,-9.39915,-5.68,-1.4,-5.884661419247391
C[C@H](NC(=O)Nc1cccc2c1OCCO2)c1ccc(NC(=O)NC2CC2)cc1,C56720275_decoy,TRY1,Decoy,0,-7.89685,-5.69,-1.74,-5.443884952028005
COc1ccccc1-c1nnc(S[C@H](C)c2nc(N)c3c(C)c(C)sc3n2)n1N,C10656111_decoy,TRY1,Decoy,0,-9.7622,-5.68,-1.3,-5.510956365189225
C=CCc1cccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)n2N)c1O,C05899289_decoy,TRY1,Decoy,0,-8.97918,-7.39,-3.31,-7.127972406588772
O=C(CSc1n[nH]c(N/N=C/c2ccccc2O)n1)Nc1ccc(Cl)cc1,C06335782_decoy,TRY1,Decoy,0,-8.471,-8.24,-2.89,-7.646646419958399
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)Nc1ccccc1Cl,C59015348_decoy,TRY1,Decoy,0,-9.08128,-8.32,-1.41,-9.974113430380193
C/C(=N\Nc1nc(SCC(=O)Nc2c(F)cccc2F)n[nH]1)c1ccccc1O,C59830379_decoy,TRY1,Decoy,0,-8.1601,-8.6,-4.46,-7.733670444244197
CCOc1cc(NC(=O)NCc2cccc([C@@]3(C)NC(=O)NC3=O)c2)ccc1C,C67345523_decoy,TRY1,Decoy,0,-7.73878,-5.73,-2.18,-4.908721871830031
COc1ccccc1C(=O)NNC(=O)NCCNc1ncc(Cl)cc1Cl,C67483262_decoy,TRY1,Decoy,0,-7.50699,-7.39,-5.71,-6.939263412668066
C=CCNc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCC[NH+]1CCOCC1,C04222550_decoy,TRY1,Decoy,0,-10.9395,-5.48,-2.07,-6.022867014740467
CCCC[NH2+][C@@H](C)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O)C1)C(=O)c1c(OC)cccc1C3=O,C05373339_decoy,TRY1,Decoy,0,-8.47173,-8.43,-1.8,-6.419189813964215
CC1CC[NH+](Cc2c(C(=O)N/N=C/c3ccc(O)cc3)nnn2-c2nonc2N)CC1,C02327008_decoy,TRY1,Decoy,0,-8.88395,-5.79,-3.35,-5.966952745812559
Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccccc2O)c1C[NH+]1CCCC1,C08826715_decoy,TRY1,Decoy,0,-8.61029,-6.25,-2.36,-6.505970485389318
CC1(C)CC(NC(=O)CCNC(=O)N2CC(O)=Nc3ccccc32)CC(C)(C)[NH2+]1,C09165928_decoy,TRY1,Decoy,0,-6.75192,-7.57,-1.51,-5.513091838462414
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H](CC(N)=O)[NH2+][C@@]12C(=O)Nc1ccc(Br)cc12,C16027184_decoy,TRY1,Decoy,0,-8.31638,-5.68,-0.96,-5.919978979567479
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)nc(O)n(-c2ccccc2OC)c1=O,C09014040_decoy,TRY1,Decoy,0,-7.14592,-7.2,-2.48,-5.71851909503623
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1ccc(O)cc1,C19927438_decoy,TRY1,Decoy,0,-8.32515,-6.72,-0.84,-7.8707644573556
CCOC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)CN1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C13758042_decoy,TRY1,Decoy,0,-10.6373,-6.08,-2.7,-6.753522676016973
Nc1nnc(SCCN2CC[NH+](CCSc3nnc(N)s3)CC2)s1,C20506750_decoy,TRY1,Decoy,0,-9.24351,-6.02,-3.41,-6.840728834010739
CC/C(=N\Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1)c1ccccc1,C20835286_decoy,TRY1,Decoy,0,-8.85213,-8.28,-1.56,-8.271953953935695
CC1(C)CC(NC(=O)CSc2nnc(N/N=C/c3c(O)ccc4ccccc34)n2N)CC(C)(C)[NH2+]1,C20916971_decoy,TRY1,Decoy,0,-10.0992,-8.02,-3.16,-6.573529288467519
Cc1ccc(Nc2nc(NC[C@H](c3ccco3)[NH+]3CCCC3)nc(N)c2[N+](=O)[O-])cc1C,C35681956_decoy,TRY1,Decoy,0,-8.20146,-6.94,-1.86,-6.587081701149851
Cc1cc(C)nc(Nc2nc(-c3cnc4c(-c5ccccc5)c(C)[nH]n4c3=[NH2+])n[nH]2)n1,C30874171_decoy,TRY1,Decoy,0,-8.01898,-7.03,-3.39,-5.164741533152967
CCc1nnc(NC(=O)CS[C@H]2N[NH2+]NN2c2ccc(C)c(Cl)c2)s1,C39029531_decoy,TRY1,Decoy,0,-10.2954,-7.66,-2.61,-7.828802993824841
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@H](C)ON1,C39656208_decoy,TRY1,Decoy,0,-8.94685,-7.29,-2.03,-6.221027740488024
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)[C@@H](C)ON1,C39676516_decoy,TRY1,Decoy,0,-9.29401,-7.1,-0.85,-5.75535497124292
O=c1cc(CS[C@@H]2N[NH2+]NN2c2ccc3c(c2)OCCO3)c2ccccc2[nH]1,C39697697_decoy,TRY1,Decoy,0,-6.42206,-8.27,-3.5,-7.209091459705079
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NN2CC[NH+](C)CC2)c1N,C40688687_decoy,TRY1,Decoy,0,-8.25958,-6.17,-2.74,-5.588763029634892
COc1ccc(OC)c(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)c1,C40754138_decoy,TRY1,Decoy,0,-7.70844,-5.28,-1.51,-4.811769349546252
COc1ccc(OC)c(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)c1,C40754376_decoy,TRY1,Decoy,0,-8.73482,-8.44,-2.85,-8.37358174911196
COc1ccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)c(OC)c1,C40754439_decoy,TRY1,Decoy,0,-8.92871,-7.43,-1.9,-6.548719020546119
COc1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)c(OC)c1,C40754690_decoy,TRY1,Decoy,0,-8.92681,-7.45,-2.0,-7.424470027604783
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc1,C40756243_decoy,TRY1,Decoy,0,-8.28555,-5.89,-2.76,-5.869935597453799
Cc1ccc(C(=O)NNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)cc1,C40760796_decoy,TRY1,Decoy,0,-7.76554,-6.22,-2.86,-5.280559858351348
COC(=O)c1ccccc1Nc1ncnc(Nc2cccc3[nH+]c(C)ccc23)c1N,C40761738_decoy,TRY1,Decoy,0,-8.85525,-6.84,-1.42,-6.9637381233094455
Cc1ccc2c(Nc3ncnc(Nc4ccc5c(c4)OCCO5)c3N)cccc2[nH+]1,C40777684_decoy,TRY1,Decoy,0,-9.03659,-8.07,-3.05,-7.5269130808492095
NC(=O)c1c(Nc2nc(NCC[NH2+]CCO)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026323_decoy,TRY1,Decoy,0,-8.50643,-6.8,-2.94,-6.882310068224222
CC[NH+](CC)CCNc1nc(N)c([N+](=O)[O-])c(Nc2onc3c2C[C@H](C)CC3)n1,C41301350_decoy,TRY1,Decoy,0,-7.89604,-6.81,-2.12,-7.582162332945198
CC[NH+](CC)CCNc1nc(N)c([N+](=O)[O-])c(Nc2cccc3cccnc23)n1,C41333973_decoy,TRY1,Decoy,0,-7.60747,-6.82,-1.35,-8.598281798038542
CC1(C)CC(NC(=O)N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C42895952_decoy,TRY1,Decoy,0,-8.37243,-5.73,-1.32,-5.9388496810140525
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OCC[NH2+]CCc3ccc(OC)cc3)c21,C45202293_decoy,TRY1,Decoy,0,-9.37016,-7.34,-1.69,-8.099302166289032
[H]/N=C(\N/N=C/c1ccc2nc(/C=N/NC(=[NH2+])N3CCCC3)cn2c1)N1CCCC1,C52541561_decoy,TRY1,Decoy,0,-9.06495,-8.28,-1.08,-6.499379224971391
CCCCn1c(N)c(N(CC)C(=O)C[NH2+]C(C)(C)CC(C)(C)C)c(=O)[nH]c1=O,C53123674_decoy,TRY1,Decoy,0,-7.4808,-5.96,-3.75,-5.194218358366303
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(C)c(Cl)c2)NCCc2c[nH]c[nH+]2)n1,C14729887_decoy,TRY1,Decoy,0,-11.2608,-7.5,-2.32,-9.369167935310688
CC(C)CNC(=O)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55028994_decoy,TRY1,Decoy,0,-8.18885,-7.03,-2.48,-6.71551564539556
COc1ccccc1NC(=S)/N=C(/Nc1nc(C)cc(C)n1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C14158001_decoy,TRY1,Decoy,0,-8.68246,-6.39,-3.48,-7.236095702129563
CCOc1cc(/C=N/[NH+]=C(\N)c2nonc2N)cc(Br)c1OCc1ccc(Cl)cc1,C13647989_decoy1,TRY1,Decoy,0,-9.08415,-5.66,,-6.22646108873954
CC(C)[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)NC(N)=O,C39763438_decoy,TRY1,Decoy,0,-7.89585,-5.48,-2.59,-5.640105055452382
CC1(C)CC(NC(=O)NC[C@H](O)COc2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C63294506_decoy,TRY1,Decoy,0,-7.77446,-6.66,-1.79,-6.526512101466459
Cc1ccc(/N=C2/NC(CSc3nnc(-c4ccncc4)o3)=[NH+][C@@H](N)N2)cc1,C38975052_decoy,TRY1,Decoy,0,-8.30741,-6.62,-1.3,-5.151439453000163
COc1ccc2c(c1)=C(CCNC(=O)[C@@H]1N[C@@H](CC(=O)Nc3ccc(F)cc3F)NO1)C[NH+]=2,C63796066_decoy,TRY1,Decoy,0,-7.79339,-8.3,-3.14,-7.48009050004231
CCCCNC(=O)NC1(C(=O)NC2CC[NH+](CC(=O)NC)CC2)CCCCC1,C57432572_decoy,TRY1,Decoy,0,-8.96374,-4.88,-1.61,-6.885444031995038
NC(=O)c1ccc(/[NH+]=c2\oc3cc(O)ccc3cc2C(=O)NCc2ccco2)cc1,C67299207_decoy,TRY1,Decoy,0,-8.14057,-9.61,-0.54,-13.397857146840115
CC(C)NC(=O)C[C@@H]1c2nc(NC(=O)C3CCC3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222455_decoy,TRY1,Decoy,0,-9.93918,-6.8,-2.13,-6.730471996598101
CC(C)OC(=O)[C@]1(C#N)[C@@H](c2ccc(Cl)cc2)[C@@H](C(N)=O)N2C=C(C(N)=O)C=C[C@@H]21,C06190582_decoy,TRY1,Decoy,0,-8.1069,-4.59,-2.26,-4.883794131768514
COc1ccc(Br)cc1C(=O)NC(=S)Nc1ccc(NC(=S)NC(C)=O)cc1,C02052454_decoy,TRY1,Decoy,0,-9.53528,-6.28,-1.97,-7.70871293927297
O=C(CNC(=O)c1cccs1)NNC(=S)NC(=O)c1ccc(Cl)cc1Cl,C08696071_decoy,TRY1,Decoy,0,-9.1773,-5.48,-2.53,-5.464509919874735
CCOC(=O)[C@](NC(=O)CCl)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C02198875_decoy,TRY1,Decoy,0,-8.53267,-5.84,-1.36,-8.65085147750291
CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1=O,C03367156_decoy,TRY1,Decoy,0,-9.68288,-7.63,-3.0,-7.212387416214252
COc1ccc(C(=O)NC(=S)NNC(=O)c2cc(C)n[nH]2)cc1I,C12502981_decoy,TRY1,Decoy,0,-8.18816,-7.23,-3.37,-8.813510232674
C#Cc1cccc(NCC(=O)N(CC(C)C)c2c(N)n(Cc3ccccc3)c(=O)[nH]c2=O)c1,C12607654_decoy,TRY1,Decoy,0,-6.70011,-6.88,-3.44,-5.6822968213946
COc1cc([C@@H]2NC(=S)NC(C)=C2C(C)=O)cc(Br)c1OCC(N)=O,C13914767_decoy,TRY1,Decoy,0,-7.78631,-4.9,-3.34,-4.871954999841717
NS(=O)(=O)c1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1,C15040103_decoy,TRY1,Decoy,0,-8.49245,-7.6,-2.06,-7.14092558115468
Nc1nc(N)nc(CN(Cc2ccccc2Cl)S(=O)(=O)c2ccccc2F)n1,C15553712_decoy,TRY1,Decoy,0,-8.81383,-7.92,-3.58,-10.261028726054104
CNc1nnc(SCC(=O)Nc2c(Cl)cc(S(N)(=O)=O)cc2Cl)s1,C17979686_decoy,TRY1,Decoy,0,-10.9842,-7.16,-1.75,-12.249021276234751
O=C(NCCN1CCOCC1)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3cccc(C(F)(F)F)c3)[C@@H]21,C20504104_decoy,TRY1,Decoy,0,-9.23249,-7.28,-3.59,-10.875497825419258
O=C(NCCN1CCOCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N/C(=N\c3cccc(C(F)(F)F)c3)S[C@@H]21,C20504124_decoy,TRY1,Decoy,0,-9.23657,-6.58,-1.1,-6.119305715175605
NC(=O)N[C@H](CC(=O)OCC(=O)NCc1ccccc1Cl)c1ccccc1Cl,C21136936_decoy,TRY1,Decoy,0,-7.68549,-7.61,-3.25,-7.622686408251066
NC(=O)N[C@@H](CC(=O)OCC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1Cl,C21139064_decoy,TRY1,Decoy,0,-8.2996,-7.16,-4.64,-6.140976912295344
C[C@H](OC(=O)CNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1sccc1C(N)=O,C21601866_decoy,TRY1,Decoy,0,-8.54757,-7.36,-2.28,-8.685079733093003
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)c1cc(Br)c[nH]1,C24122688_decoy,TRY1,Decoy,0,-7.65205,-5.09,-3.17,-5.110041869641616
O=C(NNC(=S)NC[C@H]1CCCO1)c1cccc(S(=O)(=O)NCC(F)(F)F)c1,C25262094_decoy,TRY1,Decoy,0,-8.60403,-5.53,-2.32,-5.292340384921354
COc1ccc([C@@]2(O)NC(=O)N[C@@H](c3ccc(O)c(OC)c3)[C@@H]2C(=O)C(F)(F)F)cc1,C27754044_decoy,TRY1,Decoy,0,-8.48041,-6.48,-1.73,-5.847519102080093
COc1ccc([C@]2(O)NC(=O)N[C@@H](c3ccc(O)c(OC)c3)[C@@H]2C(=O)C(F)(F)F)cc1,C27754052_decoy,TRY1,Decoy,0,-8.04852,-5.99,-1.13,-6.03699382784397
NC(=O)c1cc(-c2csc(NC(=O)CSc3ccc(Br)cc3)n2)c[nH]1,C30981540_decoy,TRY1,Decoy,0,-9.55019,-8.76,-2.43,-8.980212858809086
CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2nc(C)c(SCC(N)=O)s2)c1,C31799605_decoy,TRY1,Decoy,0,-9.29043,-6.25,-2.87,-5.942610966360122
COc1ccc([C@@]2(O)NC(=O)N[C@@H](c3ccc(O)c(OC)c3)[C@H]2C(=O)C(F)(F)F)cc1,C35099356_decoy,TRY1,Decoy,0,-7.44465,-6.92,-3.77,-5.965267586522661
CCN(CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1nc2ccccc2c(=O)[nH]1,C12746256_decoy,TRY1,Decoy,0,-8.48304,-7.8,-3.41,-6.368749720766039
CS(=O)(=O)NCCNS(=O)(=O)c1c(N)cc(Br)cc1Br,C35797254_decoy,TRY1,Decoy,0,-8.23146,-6.17,-1.53,-5.641674614574492
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)Sc1nnc(SCC(N)=O)s1,C36235359_decoy,TRY1,Decoy,0,-9.14466,-5.36,-3.19,-5.65282735081788
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)CCl,C36599969_decoy,TRY1,Decoy,0,-8.62421,-5.23,-3.49,-6.39543421106474
O=C(NC[C@H](O)CO)c1ccncc1Nc1ccc(I)cc1F,C38226009_decoy,TRY1,Decoy,0,-7.83804,-7.93,-2.16,-8.180387141961587
NN1C(SCC(=O)Nc2ccccc2C(F)(F)F)=NN[C@H]1[C@H]1N=NC2=C1CCC2,C39012229_decoy,TRY1,Decoy,0,-8.41431,-8.38,-2.1,-7.9757919635099235
CCCC[C@@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(F)cc34)C2)S1,C39252251_decoy,TRY1,Decoy,0,-8.27621,-7.2,-2.56,-6.602254086542129
NS(=O)(=O)c1ccc(/N=C/c2ccc(/C=N/c3ccc(S(N)(=O)=O)cc3)cc2)cc1,C03110053_decoy,TRY1,Decoy,0,-8.29132,-6.33,-2.95,-5.675812746121704
Nc1c(Cl)c(Cl)nc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1Cl,C39561027_decoy,TRY1,Decoy,0,-9.19835,-7.67,-2.58,-8.781691395068265
Cc1ccc(OCCn2c(S[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)nc3ccccc32)cc1,C39915972_decoy,TRY1,Decoy,0,-6.95774,-8.54,-1.56,-6.695806868064558
Cc1ccccc1NC(=O)C[C@@H]1NN[C@H](SCc2nc3ccccc3c(=O)[nH]2)N1C,C39969309_decoy,TRY1,Decoy,0,-8.15598,0.09,-2.52,-3.7937319445704727
COc1cc(Br)c([C@H](O)COc2c(N)cc(CO)cc2OC)cc1OC,C40352300_decoy,TRY1,Decoy,0,-8.67266,-7.17,-2.67,-9.763033115778002
CCCCc1ccnc(C(=O)N[C@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)c1,C40676507_decoy,TRY1,Decoy,0,-7.2716,-5.45,-1.58,-5.41830121677788
CS[C@@H]1O[C@H]([C@H](NC(=O)c2cc(C(C)(C)C)ccn2)[C@@H](C)Cl)[C@H](O)[C@H](O)[C@@H]1O,C40685591_decoy,TRY1,Decoy,0,-6.98104,-6.22,-3.03,-6.356209783522171
CCCCn1c(N)c(N(C)CC(=O)Nc2ccccc2Br)c(=O)[nH]c1=O,C10043983_decoy,TRY1,Decoy,0,-7.12685,-5.76,-2.13,-5.947433478588494
Cc1nc(S[C@@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)sc1CC(N)=O,C45698645_decoy,TRY1,Decoy,0,-9.31516,-7.92,-1.75,-7.869433609547815
Cc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1C,C46772481_decoy,TRY1,Decoy,0,-7.3914,-7.89,-2.52,-6.6526182513623935
Cc1ccc2c(c1)[C@@]1(N[C@H](CCC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C15959801_decoy,TRY1,Decoy,0,-9.74591,-7.7,-1.06,-11.182743960867931
COc1ccc([C@H]2[NH2+][C@H](C(=O)[O-])Cc3[nH]cnc32)cc1CSc1nc2ccccc2[nH]1,C20805383_decoy,TRY1,Decoy,0,-8.61088,-5.78,-2.31,-6.39399411022637
COc1cc([C@@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2CCCO)ccc1O,C05690902_decoy,TRY1,Decoy,0,-7.66974,-5.15,-2.94,-5.083796505970114
C[C@H](NC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O)c1ccc(NC(=O)C2CC2)cc1,C58916579_decoy,TRY1,Decoy,0,-7.43479,-6.32,-2.2,-5.624752892726226
Cc1cc(C(=O)NNC(=S)NC(=O)COc2ccc(Br)cc2Cl)[nH]n1,C13978767_decoy,TRY1,Decoy,0,-8.33899,-8.24,-3.25,-7.4762753961194415
OCCSc1n[nH]c(N/N=C/c2cc(Br)c(O)c(Br)c2)n1,C59818960_decoy,TRY1,Decoy,0,-9.55705,-5.89,-3.51,-6.81630090188781
CC(C)C(=O)NNC(=O)[C@H](C)Sc1nnc(-c2ccc(Br)cc2)n1N,C59845378_decoy,TRY1,Decoy,0,-8.59653,-6.89,-4.1,-6.140926615548849
CC[NH+](CC)c1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1,C16598523_decoy,TRY1,Decoy,0,-7.77879,-6.84,-4.26,-6.496476561157786
Cc1ccc(N[C@H]2NN=C(SCC(=O)N[C@@H](CC3=c4ccccc4=[NH+]C3)C(=O)[O-])S2)cc1,C64684068_decoy,TRY1,Decoy,0,-9.48039,-7.71,-1.34,-7.870485784677876
C[NH+](C)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C06198512_decoy,TRY1,Decoy,0,-8.23294,-4.84,-1.94,-5.328280480331141
CC[NH+](CC)CCn1c(=[NH2+])n(C[C@@H](O)COc2ccc(Cl)cc2Cl)c2ccccc21,C08817355_decoy,TRY1,Decoy,0,-9.12981,-6.67,-3.62,-6.899469236745655
COc1ccc(-c2coc3c(C[NH+]4CCC[C@H](C)C4)c(O)c(C[NH+]4CCC[C@H](C)C4)c(O)c3c2=O)cc1,C09034086_decoy,TRY1,Decoy,0,-9.56135,-8.25,-1.49,-8.604754497672895
Cc1csc([C@H](C)[NH2+]C2CCN(c3ccc(C(=O)NCC[NH+]4CCOCC4)cc3)CC2)n1,C12159376_decoy,TRY1,Decoy,0,-7.97204,-7.6,-2.5,-7.724140431993982
O=C(NCC[NH+]1CCOCC1)c1ccc(N2CCC([NH2+]Cc3ccc(Cl)s3)CC2)cc1,C12152492_decoy,TRY1,Decoy,0,-10.2907,-7.31,-1.47,-6.123777137101861
CC[NH+]1CCN(CCCNC(=O)CCC(=O)Nc2ccc3nc(N4CC[NH+](C)CC4)cc(C)c3c2)CC1,C20136276_decoy,TRY1,Decoy,0,-9.6133,-5.8,-1.98,-5.943929115067822
C[NH+]1CCN(C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNC(=S)Nc2ccc(-n3cccn3)cc2)CC1,C20503861_decoy,TRY1,Decoy,0,-10.1037,-5.53,-1.64,-5.560299449616765
CC[NH+]1CCN(CCCNC(=O)c2cnn(-c3ccccc3Cl)c2C2CC[NH2+]CC2)CC1,C21231927_decoy,TRY1,Decoy,0,-9.20689,-7.09,-3.29,-6.140744626310732
Cc1ccc(-n2ncc(C(=O)NCC[NH+]3CCc4ccccc4C3)c2C2CC[NH2+]CC2)cc1C,C08595040_decoy,TRY1,Decoy,0,-7.7302,-7.26,-3.8,-5.690872869560321
COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@]31CCN(c1cc[nH+]c(NCCC[NH+](C)C)n1)C2,C39293298_decoy,TRY1,Decoy,0,-8.10817,-5.46,-1.91,-5.303915553041785
O=C(NC[C@@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39594252_decoy,TRY1,Decoy,0,-9.45587,-7.44,-1.75,-7.412498571756797
O=C(NC[C@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39594259_decoy,TRY1,Decoy,0,-9.06395,-7.54,-0.55,-6.768142556870336
O=C(NC[C@@H](c1cccnc1)[NH+]1CCCC1)[C@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39594733_decoy,TRY1,Decoy,0,-9.69429,-7.4,-2.1,-7.71667038478465
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NC[C@@H](c2cccnc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39595128_decoy,TRY1,Decoy,0,-9.16102,-6.29,-0.94,-7.174973953396845
Cc1ccsc1C(=O)N1C[C@H](C(=O)NC[C@@H](c2cccnc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39595206_decoy,TRY1,Decoy,0,-9.49782,-5.65,-1.8,-5.560918533766989
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)N[C@@H]3CC[NH+](Cc4ccccc4)C3)C3(CC[NH2+]CC3)C2)no1,C39608700_decoy,TRY1,Decoy,0,-9.13763,-6.87,-2.25,-6.219922096659667
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)NCC[NH+](C)C)C4(CC[NH2+]CC4)C3)cccc12,C39626485_decoy,TRY1,Decoy,0,-9.64511,-6.44,-1.72,-5.790065876164457
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)NCC[NH+](C)C)C3(CC[NH2+]CC3)C2)cc1Cl,C39626494_decoy,TRY1,Decoy,0,-9.41555,-5.26,-0.94,-5.768830366982527
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39626609_decoy,TRY1,Decoy,0,-8.59334,-4.93,-0.68,-5.888016705966489
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCC[NH+](CC)CC)C2(CC[NH2+]CC2)C1,C39626915_decoy,TRY1,Decoy,0,-8.82433,-6.26,-2.5,-7.896799681386843
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39627079_decoy,TRY1,Decoy,0,-9.97617,-7.45,-2.0,-6.995421551257037
C[NH+](C)CCCNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39627337_decoy,TRY1,Decoy,0,-8.88059,-7.04,-0.61,-6.089261035001677
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)NCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)cc1Cl,C39627664_decoy,TRY1,Decoy,0,-9.5159,-7.25,-2.18,-7.669536158481698
Cc1cc(C(=O)N2C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)ccc1F,C39634786_decoy,TRY1,Decoy,0,-8.0532,-5.42,-1.05,-6.01470243111623
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39663898_decoy,TRY1,Decoy,0,-9.07491,-7.63,-1.34,-7.862557444803765
Cc1ccc2[nH+]c(CNC(=O)[C@@H]3CN(C(=O)COc4cccc(Cl)c4)CC34CC[NH2+]CC4)cn2c1,C39670502_decoy,TRY1,Decoy,0,-10.048,-9.04,-2.86,-8.153469233731553
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39674709_decoy,TRY1,Decoy,0,-9.8301,-8.96,-2.71,-7.01177473978195
CSCCC(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674765_decoy,TRY1,Decoy,0,-9.06127,-6.52,-2.48,-7.148557085879757
Cc1ccccc1CC(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674863_decoy,TRY1,Decoy,0,-8.69164,-7.95,-4.02,-6.73612384662183
COCCC(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674880_decoy,TRY1,Decoy,0,-8.57417,-5.14,-2.83,-5.653256332421938
COCCC(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674883_decoy,TRY1,Decoy,0,-8.54866,-5.59,-2.1,-6.399950715542558
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39678892_decoy,TRY1,Decoy,0,-8.28825,-6.71,-2.77,-6.030199948105136
Cc1cc(C(=O)N2C[C@H](C(=O)NCCN3CCC[NH+](C)CC3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39685627_decoy,TRY1,Decoy,0,-9.52224,-5.5,-1.36,-6.064554738160555
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)NCCN2CCC[NH+](C)CC2)C2(CC[NH2+]CC2)C1,C39685632_decoy,TRY1,Decoy,0,-8.6052,-6.39,-1.3,-5.834994891178464
Cc1cc(C(=O)N2C[C@H](C(=O)NCC3CC[NH+](C4CCCC4)CC3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39689226_decoy,TRY1,Decoy,0,-8.86161,-6.06,-2.01,-5.546409687416743
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39695494_decoy,TRY1,Decoy,0,-9.55842,-6.78,-2.15,-6.774504211803697
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NC[C@H]2CCC[NH+]2CC)C2(CC[NH2+]CC2)C1,C39695566_decoy,TRY1,Decoy,0,-9.97434,-5.8,-2.22,-6.632299343141832
COCCNC(=S)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2OC)CC1,C43527370_decoy,TRY1,Decoy,0,-8.85754,-5.62,-1.5,-5.885202267918203
C[NH+]1[C@@H](CCC(=O)NCc2ccco2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1ccc(C(F)(F)F)cc1,C35442366_decoy,TRY1,Decoy,0,-7.47053,-6.11,-0.55,-5.5679715147375335
O/N=C1/[C@H]2CC[C@H](C2)[C@H]1[NH+]1CCC(CCCC2CC[NH+]([C@@H]3/C(=N/O)[C@@H]4CC[C@H]3C4)CC2)CC1,C16138099_decoy,TRY1,Decoy,0,-7.80102,-8.07,-1.51,-6.401567065075067
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)N1CCC(c2[nH]c(-c3ccc(F)c(F)c3)c[nH+]2)CC1,C58178845_decoy,TRY1,Decoy,0,-9.3535,-7.88,-0.98,-6.6019329745262025
COc1ccc(/C=N/NC(=S)Nc2ccccc2)cc1CSC1[NH+]=c2ccccc2=[NH+]1,C63111164_decoy,TRY1,Decoy,0,-8.19946,-7.68,-1.73,-7.575513413155533
CN1C(SCC2[NH+]=c3ccccc3=[NH+]2)=NN[C@@H]1c1ccc(NC(=O)/C=C/c2ccccc2)cc1,C63277057_decoy,TRY1,Decoy,0,-8.88292,-8.05,-2.54,-6.369136301990322
CCOC(=O)C1=C(CS[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)NC(=O)N[C@H]1c1cc(C)ccc1C,C63314263_decoy,TRY1,Decoy,0,-7.59016,-7.59,-3.16,-6.924113226163158
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](NCCc4ccc(Cl)cc4)N3N2)[C@H](C)N=N1,C63494651_decoy,TRY1,Decoy,0,-9.59789,-6.1,-2.69,-6.064261261094486
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1C=C2[NH+]=C(c3ccco3)C=C(C(F)(F)Cl)N2N1,C63513846_decoy,TRY1,Decoy,0,-7.17254,-9.01,-1.97,-6.704904473229787
O=C(CS[C@H]1N=C(c2ccc3c(c2)OCO3)N=C2CC(=O)NN21)NCC1[NH+]=c2ccccc2=[NH+]1,C63648754_decoy,TRY1,Decoy,0,-9.77201,-9.01,-1.87,-7.735982685569216
O=C(N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1)c1cccs1,C63919930_decoy,TRY1,Decoy,0,-10.1289,-6.15,-3.93,-8.613920246222971
COC(=O)[C@H]1[C@H](NC(=O)[C@@H]2CCOC2)c2cc(NCC(C)(C)C)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63985792_decoy,TRY1,Decoy,0,-9.82809,-6.47,-3.51,-6.429871079872881
COCCC(=O)N[C@@H]1c2cc(NC3CCOCC3)c[nH+]c2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1C(=O)OC,C63985903_decoy,TRY1,Decoy,0,-10.1997,-7.19,-1.82,-8.251311728527615
COc1ccc([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)cc1C[NH+]1CCc2cc(OC)c(OC)cc2[C@H]1C,C02109398_decoy,TRY1,Decoy,0,-8.2141,-6.13,-2.65,-6.884508002013979
C[C@@H]1C[NH+](C[C@H](O)COc2ccc(OC[C@@H](O)C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2)C[C@@H](C)O1,C11565513_decoy,TRY1,Decoy,0,-8.96828,-6.58,-1.52,-6.706104195900964
C[NH+](C)CCCN1C(=O)N[C@@](Cc2ccc(F)cc2)(C2CC[NH+](Cc3ccc(CO)o3)CC2)C1=O,C11909053_decoy,TRY1,Decoy,0,-8.12838,-7.44,-1.13,-6.888799315984293
Cc1csc([C@@H](C)[NH2+]C2CCN(c3ccc(C(=O)NCC[NH+]4CCOCC4)cc3)CC2)n1,C12159371_decoy,TRY1,Decoy,0,-10.3368,-6.12,-1.64,-5.913795142883009
C[NH+](Cc1ccc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)c(=O)[nH]1)C[C@@H]1COCCO1,C12205113_decoy,TRY1,Decoy,0,-9.51295,-7.52,-4.03,-6.730578366805422
O/N=C1/[C@H]2CC[C@H](C2)[C@H]1[NH+]1CCC(CCCC2CC[NH+]([C@@H]3/C(=N/O)[C@H]4CC[C@@H]3C4)CC2)CC1,C16138101_decoy,TRY1,Decoy,0,-9.16691,-8.08,-1.83,-6.115925862944003
C[C@@H]1CCC[C@H](C)[NH+]1C[C@@H](O)COc1ccc(OC[C@@H](O)C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1,C13452332_decoy,TRY1,Decoy,0,-9.16789,-5.8,-3.81,-6.02149593170839
COc1ccc(C[NH2+]Cc2ccc(F)cc2F)cc1OC[C@@H](O)C[NH+]1CCCN(C)CC1,C19839636_decoy,TRY1,Decoy,0,-8.90208,-7.58,-2.71,-6.372995321215407
CC[C@@H]1CCCC[NH+]1CCCNC(=S)Nc1ccc2nc(N3CC[NH+](C)CC3)cc(C)c2c1,C20153783_decoy,TRY1,Decoy,0,-9.89258,-6.0,-2.65,-5.848275999911103
COc1ccc(-c2coc3c(CN4CC[NH+](C)CC4)c(O)c(CN4CC[NH+](C)CC4)c(O)c3c2=O)cc1,C20517637_decoy,TRY1,Decoy,0,-9.12495,-7.95,-1.57,-8.884601983658898
CC[NH+]1CCN(C[C@H](O)COc2ccc(OC[C@@H](O)CN3CC[NH+](CC)CC3)cc2)CC1,C27529505_decoy,TRY1,Decoy,0,-10.2293,-5.79,-4.12,-6.293335686699281
Cc1c(Nc2ccc(C[NH2+]CC3([NH+](C)C)CCCCC3)cc2)c(=O)n(-c2ccccc2)n1C,C38344819_decoy,TRY1,Decoy,0,-9.16891,-6.68,-1.92,-5.6793126014676645
O=C(NC[C@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39594747_decoy,TRY1,Decoy,0,-9.06023,-8.35,-3.33,-6.988178606614228
O=C(NC[C@@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39595062_decoy,TRY1,Decoy,0,-8.13014,-8.18,-2.34,-6.49273042278644
O=C(NC[C@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39595069_decoy,TRY1,Decoy,0,-9.18504,-6.24,-1.93,-6.370946771781376
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39627082_decoy,TRY1,Decoy,0,-9.87441,-7.13,-1.91,-7.63640793929004
C[NH+](C)CCCNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39627348_decoy,TRY1,Decoy,0,-8.93778,-5.86,-1.4,-6.275787567815003
C[NH+](C)CCCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39627669_decoy,TRY1,Decoy,0,-9.0413,-5.64,-1.16,-6.210909573425462
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)c1C,C39628038_decoy,TRY1,Decoy,0,-10.0431,-8.22,-1.68,-6.9209401607819565
Cc1cc(C(=O)N2C[C@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39628143_decoy,TRY1,Decoy,0,-8.76658,-5.35,-3.19,-6.129940222264215
O=C(NCCCn1cc[nH+]c1)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39629869_decoy,TRY1,Decoy,0,-8.43021,-6.57,-1.97,-5.512613790790304
O=C(NCCCn1cc[nH+]c1)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CC12CC[NH2+]CC2,C39629953_decoy,TRY1,Decoy,0,-7.97573,-7.82,-0.97,-6.6670427594739365
O=C(NCCCn1cc[nH+]c1)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39630167_decoy,TRY1,Decoy,0,-8.11812,-7.54,-0.1,-6.0108323838010245
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39630542_decoy,TRY1,Decoy,0,-9.9854,-6.78,-1.04,-6.968926461088828
COc1c(C(=O)N2C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)csc1Cl,C39630920_decoy,TRY1,Decoy,0,-8.47319,-5.93,-3.84,-5.756462195734655
Cc1cc(C(=O)N2C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39630962_decoy,TRY1,Decoy,0,-8.25474,-6.94,-2.42,-6.317717067860977
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2)C(C)C,C39634857_decoy,TRY1,Decoy,0,-10.6865,-5.26,-1.38,-6.201641226392156
Cc1ccc2[nH+]c(CNC(=O)[C@H]3CN(C(=O)COc4cccc(Cl)c4)CC34CC[NH2+]CC4)cn2c1,C39670503_decoy,TRY1,Decoy,0,-9.11568,-6.59,-1.81,-6.198153246927134
CC(=O)Oc1ccccc1C(=O)N1C[C@@H](C(=O)NCc2cn3c(C)cccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670646_decoy,TRY1,Decoy,0,-7.68793,-5.96,-2.16,-5.041288038267862
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39674710_decoy,TRY1,Decoy,0,-11.9532,-7.82,-1.42,-7.641373452147228
CSCCC(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674764_decoy,TRY1,Decoy,0,-8.51443,-6.04,-2.83,-6.491864909465155
CSCCC(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674766_decoy,TRY1,Decoy,0,-9.27787,-5.39,-3.1,-6.467361095224387
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39678980_decoy,TRY1,Decoy,0,-9.36334,-6.09,-1.9,-6.783706006774947
Cc1cc(C(=O)N2C[C@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39679056_decoy,TRY1,Decoy,0,-7.79278,-6.5,-5.06,-5.8396238018545485
C[NH+](C)CCCCNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39679119_decoy,TRY1,Decoy,0,-9.68509,-6.84,-1.99,-6.390529194899264
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)c2cccc(OC(C)=O)c2C)CC12CC[NH2+]CC2,C39695563_decoy,TRY1,Decoy,0,-8.28201,-8.21,-2.03,-6.9594162992221
Cc1cccc(CCc2ccc3[nH+]c(NC4CC[NH+](C)CC4)n(Cc4[nH+]c(C)ccc4[O-])c3c2)c1,C29134519_decoy,TRY1,Decoy,0,-8.49147,-8.31,-2.06,-6.376683341400195
Nc1n(C[C@H](O)COc2ccc(Cl)cc2Cl)c2ccccc2[n+]1CC[NH+]1CCCCC1,C36123838_decoy,TRY1,Decoy,0,-9.24541,-5.34,-2.73,-6.482561195386976
COc1ccc([C@H]2C[C@H](C(F)(F)F)N3N[C@@H](C(=O)NCCC4=c5ccccc5=[NH+]C4)CC3=[NH+]2)cc1,C63070805_decoy,TRY1,Decoy,0,-8.34624,-5.87,-2.11,-5.5727707351228295
COc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1ccc([C@H]3Nc4ccc(C)cc4S3)cc1)[NH+]=2,C63083837_decoy,TRY1,Decoy,0,-9.60543,-6.71,-2.09,-6.017601276612458
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)C[NH2+][C@@H]1CCCC2=c3cc([N+](=O)[O-])ccc3=[NH+][C@H]21,C63290960_decoy,TRY1,Decoy,0,-9.02383,-7.85,-2.32,-6.814511688794475
CCOC(=O)C1=C(CS[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)NC(=O)N[C@@H]1c1cc(C)ccc1C,C63314258_decoy,TRY1,Decoy,0,-7.92808,-5.52,-1.66,-6.082352141914669
CCOC(=O)C1=C(CS[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)NC(=O)N[C@@H]1c1cc(C)ccc1C,C63314261_decoy,TRY1,Decoy,0,-8.21587,-7.46,-2.44,-7.905161484509701
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](NCCc4ccc(Cl)cc4)N3N2)[C@@H](C)N=N1,C63494649_decoy,TRY1,Decoy,0,-9.43994,-6.31,-0.86,-5.908805518745001
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1nnc(SCC(=O)NC(C)=O)s1)[NH+]=2,C63547300_decoy,TRY1,Decoy,0,-8.99671,-6.69,-4.37,-5.823260169165673
CC[C@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)N/N=C/c1cc(Br)c(O)c(Br)c1,C63562442_decoy,TRY1,Decoy,0,-9.89525,-7.66,-1.4,-8.350744825771304
COCCC(=O)N[C@H]1c2cc(NC3CCOCC3)c[nH+]c2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1C(=O)OC,C63985904_decoy,TRY1,Decoy,0,-9.86113,-7.06,-2.91,-8.059865212027503
COCC(=O)N[C@@H]1c2cc(N[C@@H](C)COC)c[nH+]c2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1C(=O)OC,C63994201_decoy,TRY1,Decoy,0,-8.95004,-7.08,-1.97,-10.270204396728602
CCC[NH+]1CCN(c2nn3c(NC4CCCCC4)c(-c4ccc(O)c(OC)c4)[nH+]c3s2)CC1,C64450778_decoy,TRY1,Decoy,0,-9.97985,-7.2,-2.75,-7.511982740907626
COc1ccc([C@@H]2NN[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2c2ccccc2)cc1OC,C65548856_decoy,TRY1,Decoy,0,-8.58047,-6.33,-1.93,-7.405377265466456
Cc1cccn2c(=O)c3cc(C(=O)NCC[NH+]4CCOCC4)c(=[NH2+])n(C(C)C)c3nc12,C00794703_decoy,TRY1,Decoy,0,-8.05701,-7.06,-4.71,-5.787944625413242
C=CCn1c(=[NH2+])c(C(=O)NCC[NH+]2CCOCC2)cc2c(=O)n3cccc(C)c3nc21,C00788455_decoy,TRY1,Decoy,0,-8.03806,-7.25,-1.38,-5.563377508577135
C=CCn1c(=[NH2+])c(C(=O)NCC[NH+]2CCOCC2)cc2c(=O)n3cc(C)ccc3nc21,C00788461_decoy,TRY1,Decoy,0,-7.48615,-5.8,-1.73,-4.619871209996142
Cc1cc[nH+]c(-n2c(S[C@H](C)C(=O)NC(=O)Nc3ccc(C)cc3C)[nH+]c3ccccc3c2=O)c1,C22762082_decoy,TRY1,Decoy,0,-6.73364,-8.86,-1.5,-6.624641915239084
Cc1cc[nH+]c(-n2c(S[C@@H](C)C(=O)NC(=O)Nc3ccc(C)cc3C)[nH+]c3ccccc3c2=O)c1,C22762089_decoy,TRY1,Decoy,0,-9.29774,-9.33,-3.51,-7.502653155346432
CC[C@@]1(C)Cc2c(c(N3CCOCC3)[nH+]c3sc4c(c23)NC=[NH+][C@H]4NCc2ccccc2)CO1,C27345065_decoy,TRY1,Decoy,0,-9.80537,-5.85,-1.3,-6.02787530444705
CN(C)C(=O)[C@@H](C1CCC([C@H]2CCc3[nH+]cnn3C2)CC1)[C@H]([NH3+])C(=O)N1CCC(F)(F)C1,C28824565_decoy,TRY1,Decoy,0,-8.67472,-6.34,-2.72,-5.755117519663128
CCOc1ccccc1NC(=O)Nc1ccc(N2CC[NH+](Cc3ccoc3)CC2)[nH+]c1,C35852333_decoy,TRY1,Decoy,0,-8.35851,-5.44,-2.68,-5.191177093996092
O=S(=O)(N/N=C/[C@]1(c2ccc(Cl)cc2)N[NH+]=c2ccccc2=[NH+]1)c1ccccc1,C15776300_decoy,TRY1,Decoy,0,-7.87467,-8.13,-0.33,-6.9871062555950525
COc1c(C(=O)N2C[C@@H](C(=O)NCC[NH+](C)C)C3(CC[NH2+]CC3)C2)csc1Cl,C39626398_decoy,TRY1,Decoy,0,-7.97837,-5.83,-2.07,-5.200028564716652
Cc1cc(C(=O)N2C[C@H](C(=O)NCC[NH+](C)C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39626438_decoy,TRY1,Decoy,0,-8.24604,-6.02,-1.73,-5.7102474641771765
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)CC1,C39628021_decoy,TRY1,Decoy,0,-8.571,-7.86,-1.92,-7.075577110318727
O=C(NCCCn1cc[nH+]c1)[C@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39629982_decoy,TRY1,Decoy,0,-7.63498,-6.88,-2.32,-6.189879780810263
O=C(NCCCn1cc[nH+]c1)[C@@H]1CN(C(=O)c2ccc(F)cc2F)CC12CC[NH2+]CC2,C39629984_decoy,TRY1,Decoy,0,-8.43463,-8.0,-1.33,-7.310906793851531
O=C(NCCCn1cc[nH+]c1)[C@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2,C39630004_decoy,TRY1,Decoy,0,-9.5049,-6.9,-1.18,-6.120419268479981
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCCn3cc[nH+]c3)C3(CC[NH2+]CC3)C2)cc1F,C39630127_decoy,TRY1,Decoy,0,-8.74076,-7.55,-1.37,-6.924091448617423
Cc1ccc(F)cc1C(=O)N1C[C@H](C(=O)NCCCn2cc[nH+]c2)C2(CC[NH2+]CC2)C1,C39630248_decoy,TRY1,Decoy,0,-8.02521,-7.42,-3.83,-8.740382176053407
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)CC1,C39630819_decoy,TRY1,Decoy,0,-8.5086,-5.76,-2.69,-5.716853000867059
COc1ccc([C@@H](CNC(=O)[C@H]2CN(C(=O)c3cc(Cl)ccc3F)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663874_decoy,TRY1,Decoy,0,-11.4845,-7.97,-2.54,-7.705668176654708
COc1ccc([C@@H](CNC(=O)[C@H]2CN(C(=O)c3ccc(F)cc3F)CC23CC[NH2+]CC3)[NH+]2CCCC2)cc1,C39664030_decoy,TRY1,Decoy,0,-9.4213,-8.23,-2.56,-6.896847384013513
Cc1ccn2cc(CNC(=O)[C@@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)[nH+]c2c1,C39670284_decoy,TRY1,Decoy,0,-8.37263,-6.45,-3.35,-5.253110003067594
Cc1ccc2[nH+]c(CNC(=O)[C@H]3CN(C(=O)[C@@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)cn2c1,C39670555_decoy,TRY1,Decoy,0,-9.34248,-10.08,-1.3,-7.819815342719652
Cc1ccc2[nH+]c(CNC(=O)[C@@H]3CN(C(=O)c4c(C)noc4C)CC34CC[NH2+]CC4)cn2c1,C39670598_decoy,TRY1,Decoy,0,-7.03049,-9.1,-2.17,-9.263898981513147
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCc3cn4c(C)cccc4[nH+]3)C3(CC[NH2+]CC3)C2)no1,C39670784_decoy,TRY1,Decoy,0,-7.50009,-7.69,-4.67,-5.30800410670958
CCCCC(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674616_decoy,TRY1,Decoy,0,-11.0518,-6.99,-1.43,-7.435714438545301
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39674661_decoy,TRY1,Decoy,0,-10.1292,-8.78,-3.35,-8.066929736290438
CC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674688_decoy,TRY1,Decoy,0,-9.6584,-6.6,-1.33,-6.672657073785328
C[NH+]1CCCN(CCNC(=O)[C@@H]2CN(C(=O)[C@@H]3COc4ccccc4O3)CC23CC[NH2+]CC3)CC1,C39685633_decoy,TRY1,Decoy,0,-9.68979,-8.09,-1.38,-6.761059310629982
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NCCN4CCC[NH+](C)CC4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39685669_decoy,TRY1,Decoy,0,-9.5943,-8.14,-0.86,-7.331222753724039
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NC3CCN(c4cccc[nH+]4)CC3)C3(CC[NH2+]CC3)C2)no1,C39687473_decoy,TRY1,Decoy,0,-7.97566,-6.61,-4.71,-6.163897409145822
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NC2CCN(c3cccc[nH+]3)CC2)C2(CC[NH2+]CC2)C1,C39687517_decoy,TRY1,Decoy,0,-8.16219,-7.34,-1.3,-6.143210762436763
Cc1cc(C(=O)N2C[C@H](C(=O)NC3CCN(c4cccc[nH+]4)CC3)C3(CC[NH2+]CC3)C2)nn1C,C39687532_decoy,TRY1,Decoy,0,-9.88176,-7.19,-1.52,-5.815467519140811
Cc1cc(C(=O)N2C[C@@H](C(=O)NC3CCN(c4cccc[nH+]4)CC3)C3(CC[NH2+]CC3)C2)nn1C,C39687533_decoy,TRY1,Decoy,0,-9.13043,-5.64,-3.45,-5.258456562536161
Cc1ccc[nH+]c1N1CCC(NC(=O)[C@H]2CN(C(=O)[C@@H]3COc4ccccc4O3)CC23CC[NH2+]CC3)CC1,C39687679_decoy,TRY1,Decoy,0,-9.19305,-6.57,-1.56,-5.731304614735038
Cc1ccc[nH+]c1N1CCC(NC(=O)[C@@H]2CN(C(=O)[C@H]3COc4ccccc4O3)CC23CC[NH2+]CC3)CC1,C39687680_decoy,TRY1,Decoy,0,-10.398,-9.49,-1.96,-7.473131557380581
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCc3[nH+]ccn3C)C3(CC[NH2+]CC3)C2)c1F,C39688930_decoy,TRY1,Decoy,0,-8.68463,-6.38,-2.75,-6.383565731670208
COc1c(C(=O)N2C[C@H](C(=O)NCc3[nH+]ccn3C)C3(CC[NH2+]CC3)C2)csc1Cl,C39688985_decoy,TRY1,Decoy,0,-8.4791,-6.75,-2.2,-5.982499705111109
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)NCc2[nH+]ccn2C)C2(CC[NH2+]CC2)C1,C39688990_decoy,TRY1,Decoy,0,-8.6406,-7.21,-1.86,-6.005863593349554
Cc1cc(C(=O)N2C[C@@H](C(=O)NCc3[nH+]ccn3C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39689003_decoy,TRY1,Decoy,0,-8.94176,-7.33,-1.59,-5.999862067684858
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NC[C@@H]4CC[NH+](C)C4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39689868_decoy,TRY1,Decoy,0,-9.45996,-7.58,-1.92,-6.966110335486775
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)NC[C@H]4CC[NH+](C)C4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39689870_decoy,TRY1,Decoy,0,-9.29574,-6.69,-1.77,-5.682663224581661
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NC[C@H]4CC[NH+](C)C4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39689873_decoy,TRY1,Decoy,0,-9.25932,-7.89,-2.19,-7.383826683409527
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCc2ccc(N3CC[NH+](C)CC3)cc2)C2(CC[NH2+]CC2)C1,C39693995_decoy,TRY1,Decoy,0,-8.51486,-7.76,-3.54,-6.1035664600887
CCCCC[n+]1c(N)c(C(=O)NCC[NH+]2CCCCC2)cc2c(=O)n3cccc(C)c3nc21,C40015441_decoy,TRY1,Decoy,0,-9.41882,-6.4,-1.47,-5.970292470766075
CS(=O)(=O)c1ccc2c(c1)S[C@@H](NC(=O)CSCC1[NH+]=c3ccccc3=[NH+]1)N2,C63295409_decoy,TRY1,Decoy,0,-8.87645,-8.1,-2.35,-7.346515777176206
COc1ccc(CN[C@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=C(C)N=N[C@@H]4C)NN32)cc1,C63494642_decoy,TRY1,Decoy,0,-8.9859,-8.05,-1.83,-8.026511422419533
CC1=C(S(=O)(=O)NCC2[NH+]=c3ccccc3=[NH+]2)[C@@H](C)N([C@@H]2CCS(=O)(=O)C2)N1,C63694411_decoy,TRY1,Decoy,0,-7.71339,-7.6,-1.66,-5.992194218954889
CC1=C(S(=O)(=O)NCC2[NH+]=c3ccccc3=[NH+]2)[C@H](C)N([C@@H]2CCS(=O)(=O)C2)N1,C63694415_decoy,TRY1,Decoy,0,-7.39787,-7.67,-2.24,-5.987247581428349
CC(C)[C@H](NC(=O)CS[C@H]1N=NNN1c1ccccc1F)C1[NH+]=c2ccccc2=[NH+]1,C64197444_decoy,TRY1,Decoy,0,-7.41106,-8.07,-0.88,-9.468760172233456
CCOc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NCCC2=c3ccccc3=[NH+]C2)cc1,C64640316_decoy,TRY1,Decoy,0,-8.147,-8.54,-1.77,-7.675306152907029
N#Cc1ccccc1S(=O)(=O)N1CC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C08981521_decoy,TRY1,Decoy,0,-8.67891,-7.74,-2.63,-6.125582129307838
Cc1oc2c(F)c(F)c(F)c(F)c2c1C(=O)ON[C@H]([NH3+])c1ccc(OS(=O)(=O)N(C)C)cc1,C12368971_decoy,TRY1,Decoy,0,-7.95272,-8.17,-1.68,-6.076186429968651
C[C@H](C(=O)NC(=O)Nc1ccc2c(c1)OCCO2)[NH+](C)CC(=O)Nc1c(Cl)cccc1Cl,C15038157_decoy,TRY1,Decoy,0,-9.68242,-8.86,-2.03,-8.560470701400039
CCCCN(C(=O)C[NH+](C)[C@H](C)c1ccc(-n2cncn2)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C17306135_decoy,TRY1,Decoy,0,-8.60558,-7.54,-2.52,-7.874668000094925
O=S(=O)(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N1CCN(c2cccc[nH+]2)CC1)c1ccc(Cl)cc1,C20465628_decoy,TRY1,Decoy,0,-8.89376,-6.14,-1.49,-6.126565894282953
C[C@H](C(=O)NCCN1CCOCC1)[C@H]1CC[C@@]2(C)Cc3s/c(=N\C(=O)C[NH+](C)C)[nH]c3[C@@H](C)[C@@H]2[C@H]1O,C20504563_decoy,TRY1,Decoy,0,-10.2807,-7.31,-2.89,-7.346833258081431
Cc1cc(-n2c(SCC(=O)Nc3ccc4c(c3)OCCO4)nc3[nH]nc(C)c3c2=[NH2+])ccc1Cl,C04397419_decoy,TRY1,Decoy,0,-11.6762,-5.89,-2.19,-6.932826716757776
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+](C)CC(=O)Nc2ccccc2C(F)(F)F)C1=O,C21580292_decoy,TRY1,Decoy,0,-7.54455,-8.41,-4.45,-8.568207799315033
O=C(NCCc1cn2ccccc2n1)c1cc(S(=O)(=O)NCCc2cn3ccccc3[nH+]2)c[nH]1,C23354755_decoy,TRY1,Decoy,0,-8.50229,-7.74,-1.97,-5.962076015006048
C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)[NH+]1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1,C23827554_decoy,TRY1,Decoy,0,-11.3825,-6.24,-1.2,-6.097719692743375
Cc1ccc(NC(=O)NC(=O)C[NH+]2CCNC(=O)[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c(C)c1,C24215428_decoy,TRY1,Decoy,0,-7.69581,-8.27,-1.83,-7.0262988035371485
Cc1nn(-c2ccccc2)c(C)c1[C@H]1C(=O)NCC[NH+]1CC(=O)Nc1oc(C)c2c(C)n[nH]c(=O)c12,C24840098_decoy,TRY1,Decoy,0,-6.77301,-5.9,-2.19,-5.0053538779224125
Nc1nc(-c2ccncc2)nc2c1ncn2C[C@H](O)CN1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C26576406_decoy,TRY1,Decoy,0,-9.82556,-6.51,-2.5,-6.391677667117045
CCOC(=O)c1c(NC(=O)[C@@H](C)[NH2+]CC(=O)N[C@@H]2CCS(=O)(=O)C2)sc2c1CC[C@H](C)C2,C32927299_decoy,TRY1,Decoy,0,-9.76627,-6.0,-3.02,-6.564160508955571
CC(=O)Nc1cc(NC(=O)C2=CC3=[NH+][C@@H](c4ccc5c(c4)OCO5)C[C@H](C(F)(F)F)N3N2)ccc1C,C01326830_decoy,TRY1,Decoy,0,-7.34191,-8.54,-2.35,-5.982435528974728
Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601743_decoy,TRY1,Decoy,0,-8.58107,-7.16,-3.72,-6.454724664049947
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)no1,C39631876_decoy,TRY1,Decoy,0,-8.83896,-8.5,-3.52,-7.917687731014751
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39632078_decoy,TRY1,Decoy,0,-10.0828,-6.22,-2.03,-7.834784614235032
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)no1,C39655561_decoy,TRY1,Decoy,0,-8.26711,-6.51,-3.38,-6.502252520355892
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)NCCNc4ccccc4)C4(CC[NH2+]CC4)C3)cccc12,C39655626_decoy,TRY1,Decoy,0,-9.28723,-8.01,-2.15,-6.808002888078521
COc1cc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39655938_decoy,TRY1,Decoy,0,-10.1982,-6.74,-2.27,-6.616473449758662
CC1=C([C@H](C)NC(=O)[C@H]2CN(C(=O)C3=C(C)NO[C@@H]3c3cc(C)on3)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674458_decoy,TRY1,Decoy,0,-7.98816,-5.17,-1.69,-4.757504465374928
CC(=O)Oc1ccccc1C(=O)N1C[C@@H](C(=O)NCc2nc3ccccc3c(=O)[nH]2)C2(CC[NH2+]CC2)C1,C39676181_decoy,TRY1,Decoy,0,-9.84842,-8.46,-1.71,-7.386380692222559
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(-c3c(F)cccc3Cl)noc2C)CC12CC[NH2+]CC2,C39683891_decoy,TRY1,Decoy,0,-7.81413,-7.52,-3.47,-6.872678341278252
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39685847_decoy,TRY1,Decoy,0,-8.43375,-5.93,-2.6,-6.706088425012809
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685852_decoy,TRY1,Decoy,0,-9.73334,-7.17,-2.8,-7.300471595944433
COc1ccc([C@H]2NN[C@H](SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N2c2ccccc2)cc1OC,C39923396_decoy,TRY1,Decoy,0,-10.768,-8.77,-2.71,-7.935819122037896
Nc1c(Nc2ccc(Br)cn2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40779937_decoy,TRY1,Decoy,0,-9.37869,-7.92,-1.63,-6.40234457571843
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)no1,C44695555_decoy,TRY1,Decoy,0,-8.86317,-7.01,-1.82,-6.651831208661505
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1C,C44713956_decoy,TRY1,Decoy,0,-8.10302,-7.92,-2.96,-6.03241449571528
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714108_decoy,TRY1,Decoy,0,-8.09275,-6.17,-2.83,-6.034455415500579
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@H]1CN(C(=O)COc2cccc3c(C)cc(=O)oc23)CC12CC[NH2+]CC2,C44714185_decoy,TRY1,Decoy,0,-9.05423,-6.54,-3.37,-6.485299697680222
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714411_decoy,TRY1,Decoy,0,-7.88193,-7.35,-3.07,-6.779255692090023
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)CC1,C44714540_decoy,TRY1,Decoy,0,-9.15709,-7.58,-4.06,-6.649437225669247
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C44714604_decoy,TRY1,Decoy,0,-9.54338,-8.67,-2.78,-7.42282273333853
Cc1noc(C)c1C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccc(C#N)cc23)C2(CC[NH2+]CC2)C1,C44714654_decoy,TRY1,Decoy,0,-8.72682,-6.69,-1.57,-6.069924549284964
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C44714685_decoy,TRY1,Decoy,0,-8.70355,-8.08,-2.99,-7.741179221847317
C[C@H](Sc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C45486293_decoy,TRY1,Decoy,0,-7.63314,-6.21,-1.15,-5.144472733816983
[NH3+]C1CCN(Cc2ccn3ncnc(Nc4ccc(OCc5cccc[n+]5[O-])c(Cl)c4)c23)CC1,C28903188_decoy,TRY1,Decoy,0,-8.25993,-8.07,-1.98,-5.80027643450909
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C44737039_decoy,TRY1,Decoy,0,-7.98151,-5.36,-1.97,-5.084456189106393
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(N5CCOCC5)nc4)CC34CC[NH2+]CC4)[nH]c2c1,C39695831_decoy,TRY1,Decoy,0,-8.7218,-8.53,-4.31,-6.831309000813036
COc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39695758_decoy,TRY1,Decoy,0,-8.61763,-6.49,-2.64,-6.265485284858789
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(C)nn4C(C)(C)C)CC34CC[NH2+]CC4)[nH]c2c1,C39695817_decoy,TRY1,Decoy,0,-9.38587,-8.66,-3.19,-9.625831131099917
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(C)noc4-c4cc(C)on4)CC34CC[NH2+]CC4)[nH]c2c1,C44737447_decoy,TRY1,Decoy,0,-9.29989,-9.15,-3.38,-8.815750934000288
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(C)noc4-c4cc(C)on4)CC34CC[NH2+]CC4)[nH]c2c1,C44737454_decoy,TRY1,Decoy,0,-8.6121,-6.63,-2.35,-5.806700856514912
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(N5CCOCC5)nc4)CC34CC[NH2+]CC4)[nH]c2c1,C44737488_decoy,TRY1,Decoy,0,-10.5659,-6.32,-1.91,-7.649443591185582
Cc1nc(N2CCN(CCO)CC2)cc(Nc2ncc(C(=O)Nc3c(Cl)cccc3Cl)s2)[nH+]1,C33359308_decoy,TRY1,Decoy,0,-11.1839,-6.59,-2.01,-6.536117479570518
CC[C@@H]1CC2=c3ccccc3=[NH+][C@@H]2[C@H](c2c([O-])[nH]c(=O)n(CCc3ccc(OC)c(OC)c3)c2=O)[NH2+]1,C63386252_decoy,TRY1,Decoy,0,-8.28997,-6.75,-2.12,-6.189599138709613
COc1cccc([C@@H]2[NH2+][C@@](CC3=c4ccccc4=[NH+]C3)(C(=O)[O-])[C@@H]3C(=O)N(c4cccc(C)c4)C(=O)[C@@H]32)c1O,C63513993_decoy,TRY1,Decoy,0,-6.47072,-7.54,-1.56,-6.803878226915782
O=C(CS[C@H]1Nc2ccccc2C(=O)N1NC(=O)CCC1=c2ccccc2=[NH+]C1)NC[C@@H]1CCCO1,C63708494_decoy,TRY1,Decoy,0,-10.393,-8.68,-2.79,-9.415857940275846
Cn1c(=O)[nH]c(=O)c2c1nc(NN)n2C[C@@H](O)COc1ccc(Cl)cc1,C00828760_decoy,TRY1,Decoy,0,-8.25758,-7.9,-1.6,-7.469421780240674
COc1ncnc2c1N[C@H](NNC(N)=S)c1cc([N+](=O)[O-])ccc1S2,C03045381_decoy,TRY1,Decoy,0,-8.00179,-6.69,-4.95,-7.685342860175447
Nc1nc(SCc2ccccc2)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04769189_decoy,TRY1,Decoy,0,-7.15161,-6.44,-2.56,-5.180578484635879
Nc1nc(SCc2ccccc2)c2nnn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05341488_decoy,TRY1,Decoy,0,-5.88442,-6.07,-1.64,-4.482073563713552
Nc1nc(SCc2ccccc2)c2nnn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05341490_decoy,TRY1,Decoy,0,-7.42943,-8.06,-1.76,-7.473936261180914
COc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C06143344_decoy,TRY1,Decoy,0,-6.89158,-6.44,-0.96,-5.1516545943316245
COc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C06143345_decoy,TRY1,Decoy,0,-6.62078,-7.63,-1.61,-7.442124644004659
N#C/C(=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)c1n[nH]c(N)c1C#N,C04112917_decoy,TRY1,Decoy,0,-8.20158,-7.76,-1.45,-9.219137068599064
C[C@H](OC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)NC(N)=O,C11440546_decoy,TRY1,Decoy,0,-7.74304,-5.71,-1.44,-5.63500796459861
COc1cc2nc(Cl)nc(N[C@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]3O)c2cc1OC,C11756766_decoy,TRY1,Decoy,0,-7.83708,-6.19,-1.85,-4.885984848048663
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]2C(CO)=CC[C@H]12,C12153585_decoy,TRY1,Decoy,0,-6.74954,-5.54,-3.55,-5.274074797212997
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]2C(CO)=CC[C@H]12,C12153587_decoy,TRY1,Decoy,0,-7.47949,-4.84,-3.53,-4.990256107200307
Nc1nonc1/N=N/N(CC(=O)N/N=C/c1ccccc1F)c1nonc1N,C16449034_decoy,TRY1,Decoy,0,-8.50256,-7.8,-1.27,-7.402089087678677
Nc1nc(SCc2cccnc2)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c2n1,C16991396_decoy,TRY1,Decoy,0,-7.18157,-7.5,-0.81,-6.575338123128573
O=c1[nH]cnc2c1nc(N1CCN(CCO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C19142457_decoy,TRY1,Decoy,0,-8.81281,-4.96,-1.74,-5.612602230056759
O=c1[nH]cnc2c1nc(N1CCN(CCO)CC1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13306048_decoy,TRY1,Decoy,0,-8.49443,-7.24,-0.98,-7.565310949992643
O=c1[nH]cnc2c1nc(N1CCN(CCO)CC1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13306051_decoy,TRY1,Decoy,0,-8.02829,-6.87,-1.57,-7.565297901237044
CC(=O)NNC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20921581_decoy,TRY1,Decoy,0,-8.50323,-5.47,-3.93,-5.673636946570055
NS(=O)(=O)c1ccc(-c2[nH]c(=O)oc2-c2ccc(S(N)(=O)=O)cc2)cc1,C02519676_decoy,TRY1,Decoy,0,-7.62085,-6.26,-5.27,-4.301722406105884
Nc1nc(SCc2cccnc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1,C29058560_decoy,TRY1,Decoy,0,-7.1409,-5.8,-1.64,-4.466700954725672
CC(=O)OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]12,C31166063_decoy,TRY1,Decoy,0,-7.61309,-6.22,-2.05,-5.898928625652816
CN(N=O)C(=O)NCCNC(=O)[C@@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)[C@@H](O)[C@@H]1O,C17121391_decoy,TRY1,Decoy,0,-5.89713,-6.23,-2.16,-5.183153556445669
CN(N=O)C(=O)NCCNC(=O)[C@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)[C@@H](O)[C@@H]1O,C17121393_decoy,TRY1,Decoy,0,-6.20214,-8.02,-2.46,-6.6148548677456045
COC(=O)C1=CO[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C(CO)=CC[C@H]12,C32911546_decoy,TRY1,Decoy,0,-6.78191,-5.2,-3.74,-5.037288615717947
C/C(=C/Cc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CO,C35051316_decoy,TRY1,Decoy,0,-6.8454,-6.74,-2.88,-5.474427634731462
COC(=O)C1=CO[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2C(CO)=CC[C@H]12,C35877581_decoy,TRY1,Decoy,0,-6.92357,-4.68,-1.9,-4.248796403712033
COc1cc(/C=N/NC(=O)CNc2n[nH]c(=O)[nH]c2=O)cc([N+](=O)[O-])c1O,C36092290_decoy,TRY1,Decoy,0,-7.28477,-5.81,-2.16,-5.334956725454497
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]2C(CO)=CC[C@H]12,C08829461_decoy,TRY1,Decoy,0,-6.77456,-5.51,-1.96,-5.286884064165779
Nc1ncnc(NNC(=O)CNC(=O)c2c(F)cccc2Cl)c1[N+](=O)[O-],C09391669_decoy,TRY1,Decoy,0,-6.79929,-8.59,-2.02,-7.418405391201508
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2C(CO)=CC[C@@H]12,C13827713_decoy,TRY1,Decoy,0,-7.71983,-5.31,-3.02,-5.255024253094787
Nc1nc(N2CCCCC2)cc(=[NH2+])n1O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C39937315_decoy,TRY1,Decoy,0,-6.89751,-5.96,-1.18,-4.313258149364636
Cc1sc(NC(=O)[C@@H](C)n2c(N)nnc2SCC#N)c(C(N)=O)c1C,C40173477_decoy,TRY1,Decoy,0,-8.16059,-6.78,-2.31,-6.981462946418203
Cc1sc(NC(=O)[C@H](C)n2c(N)nnc2SCC#N)c(C(N)=O)c1C,C40173478_decoy,TRY1,Decoy,0,-7.01015,-4.41,-2.23,-4.908983590932923
CC(=O)O[C@@]1(C)C[C@@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]21,C43510154_decoy,TRY1,Decoy,0,-5.88763,-5.45,-2.91,-4.631725543673932
CC(=O)OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]12,C43510973_decoy,TRY1,Decoy,0,-6.6816,-4.63,-1.39,-4.4933161723114665
CC(=O)OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]12,C43510975_decoy,TRY1,Decoy,0,-7.52799,-5.35,-3.48,-4.840407118584751
CC(=O)OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]12,C43510976_decoy,TRY1,Decoy,0,-7.21051,-5.81,-2.97,-5.48814606587672
CC(=O)OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]12,C43510979_decoy,TRY1,Decoy,0,-7.20321,-5.73,-2.93,-5.105471473481464
Nc1nc(N2CCCCC2)cc(=[NH2+])n1O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C44963879_decoy,TRY1,Decoy,0,-6.19656,-4.99,-1.11,-4.17744916550492
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)c1cc(Br)c[nH]1,C45696936_decoy,TRY1,Decoy,0,-8.10913,-6.83,-2.58,-5.754144177115154
CC(C)NC(=O)C(=O)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C46773147_decoy,TRY1,Decoy,0,-7.091,-5.85,-2.8,-5.8617655879498205
[H]/N=C(/NC=C1C(=O)NC(=S)NC1=O)Nc1nc(C)c2cc(C)c(C)cc2n1,C09329979_decoy,TRY1,Decoy,0,-9.04056,-8.54,-0.54,-6.66258721615529
O=C(CNc1n[nH]c(=O)[nH]c1=O)N/N=C/c1cc(Br)ccc1O,C01747335_decoy,TRY1,Decoy,0,-8.07957,-7.95,-2.28,-7.300751556776857
C/C(=N\Nc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@@H](O)CO)c1ccccc1O,C09291592_decoy,TRY1,Decoy,0,-8.14494,-6.8,-1.75,-6.966948965938024
CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](C(=O)NCC)[C@H](O)[C@@H]3O)c2n1,C26725761_decoy,TRY1,Decoy,0,-7.04837,-7.13,-2.67,-5.387035106330271
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(NC2CC2)S1,C39939630_decoy,TRY1,Decoy,0,-8.69076,-6.36,-0.92,-6.051396167044245
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(NC2CC2)S1,C39939631_decoy,TRY1,Decoy,0,-8.48766,-7.03,-1.94,-6.102723249191484
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(NC2CC2)S1,C39939632_decoy,TRY1,Decoy,0,-7.95821,-5.87,-2.1,-5.128813795141255
COCCNC(=O)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C64900116_decoy,TRY1,Decoy,0,-7.54345,-6.27,-4.39,-6.148910150363925
C[NH+]1CCN(c2ccccc2NC(=O)NNc2nc([O-])c3c[nH]nc3n2)CC1,C66595499_decoy,TRY1,Decoy,0,-7.08278,-7.43,-0.91,-6.736911679763098
CCCCn1c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c(=O)[nH]c1=S,C03985164_decoy,TRY1,Decoy,0,-7.66426,-6.41,-1.91,-5.392137854666928
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C04097283_decoy,TRY1,Decoy,0,-6.84462,-6.6,-2.57,-6.9051393364102
O=C(C[NH2+][C@@H](c1ccc(F)cc1)c1cccs1)Nc1ccc2[nH]c(=O)[nH]c2c1,C09417841_decoy,TRY1,Decoy,0,-9.9356,-7.85,-1.37,-8.740471834454503
CC1(C)CC(NC(=O)CNC(=O)N2CCc3c([nH]c4ccc(Cl)cc34)C2)CC(C)(C)[NH2+]1,C12390203_decoy,TRY1,Decoy,0,-9.73251,-6.92,-2.1,-6.065805029622318
COc1ccc(NC(=O)[C@H]2C[C@H]([C@H](C)O)[NH2+][C@]23C(=O)Nc2c(C)cc(C)cc23)cc1,C13592113_decoy,TRY1,Decoy,0,-7.64017,-6.12,-1.43,-5.206102108751445
O=C1NC[C@@H](CCC(=O)N2CCC(O)CC2)[NH+]2C[C@@H](NC(=S)Nc3ccc(Cl)cc3)C[C@@H]12,C15708752_decoy,TRY1,Decoy,0,-8.2338,-8.2,-2.95,-8.273872587978557
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)nc(O)n(-c2cc(C)ccc2C)c1=O,C09317501_decoy,TRY1,Decoy,0,-8.38478,-7.11,-2.0,-5.967962554429997
NC(=O)C[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C08996043_decoy,TRY1,Decoy,0,-8.92672,-5.69,0.13,-5.786650437929588
NC1=[NH+][C@@H](c2cccc(NC(=O)c3ccccc3Cl)c2)n2c(nc3cc4c(cc32)OCCCO4)N1,C19357229_decoy,TRY1,Decoy,0,-10.9494,-8.82,-1.85,-6.772420466022572
CCc1cc2c(=O)c(-c3nc(C)cs3)c([C@H](C)[NH3+])oc2cc1OC(=O)[C@@H](C)N,C19703456_decoy,TRY1,Decoy,0,-8.90538,-6.27,-3.03,-6.930975305955427
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C(\C)c1ccc(O)cc1,C19926782_decoy,TRY1,Decoy,0,-8.67199,-6.39,-1.66,-7.800635945221145
CCNc1nc(Nn2c(=S)[nH]c3sc4c(c3c2=O)CCCC4)nc(NCC)[nH+]1,C20755997_decoy,TRY1,Decoy,0,-8.64713,-6.13,-3.57,-7.901101572569732
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(Cl)cc3)n2)CC(C)(C)[NH2+]1,C20833491_decoy,TRY1,Decoy,0,-8.38383,-8.37,-3.46,-7.426088193411091
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C22049019_decoy,TRY1,Decoy,0,-6.90108,-8.17,-2.62,-5.415852608167324
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H]([NH3+])[C@H](O)[C@@H](C)O2)C1)C(=O)c1ccccc1C3=O,C22061345_decoy,TRY1,Decoy,0,-9.60691,-7.06,-2.11,-5.5932908267015335
CC1=C(C(N)=O)[C@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)NCCC[NH+]2CCC(O)(c3ccccc3)CC2)=C(C)N1,C13782498_decoy,TRY1,Decoy,0,-7.87373,-6.45,-1.79,-5.369475126340428
CC(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)C)[C@@H]1CCCC[C@H]1C,C31469415_decoy,TRY1,Decoy,0,-8.43304,-7.09,-2.05,-8.069434581222392
CC(C)c1ccc2c(c1)CC[C@H]1[C@@](C)(CNC(=O)c3coc([C@@H]([NH3+])CO)n3)CCC[C@]21C,C33626643_decoy,TRY1,Decoy,0,-9.29824,-7.27,-1.54,-7.194008687585656
NNc1nc(NN)c2c([nH+]1)CC1=C2C[C@@H](c2ccccc2)S[C@@H]1c1ccccc1,C34789435_decoy,TRY1,Decoy,0,-8.48476,-7.5,-1.97,-7.0436059205690125
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)Cl)[NH+](C)C1,C04245609_decoy,TRY1,Decoy,0,-8.19061,-5.21,-2.61,-5.654871075125795
COc1cccc2c1C(=O)[C@H]1C(O)=C3C(=C(O)[C@H]1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1,C38337255_decoy,TRY1,Decoy,0,-6.88033,-6.65,-3.37,-5.866807606181567
COc1ccc2c(CCNC(=O)CS[C@H]3N[NH2+]NN3c3ccc(Br)cc3)c[nH]c2c1,C38759461_decoy,TRY1,Decoy,0,-9.69911,-8.34,-4.03,-8.127120197888441
C=CC[NH+]1[C@@H](c2ccccc2O)NN[C@H]1SCC(=O)Nc1nnc(CC)s1,C39021585_decoy,TRY1,Decoy,0,-8.99088,-7.37,-2.32,-6.672546001614169
CCCCc1nc2c(o1)NC([NH3+])=C(C#N)[C@]21C(=O)Nc2ccc(Br)cc21,C39323856_decoy,TRY1,Decoy,0,-7.98791,-4.71,-1.86,-4.7827988594206445
N#CC1=C(N)O[C@H]2N=[NH+][C@@H](c3ccc4ccccc4c3)[C@@H]2[C@H]1c1cn(CC(N)=O)nc1-c1ccccc1,C39964303_decoy,TRY1,Decoy,0,-8.32653,-5.91,-2.34,-5.049679072398789
Nc1c(N(Cc2ccccc2)Cc2ccccc2)nc[nH+]c1NNc1ccccc1,C40709496_decoy,TRY1,Decoy,0,-7.81752,-7.92,-1.93,-10.358915781029191
CC1(C)C[C@H]2C[C@](C)(CN2c2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)C1,C40734844_decoy,TRY1,Decoy,0,-7.90207,-5.66,-1.25,-5.467895777119862
CC1(C)CC(Nc2ncnc(Sc3cccc4cccnc34)c2N)CC(C)(C)[NH2+]1,C40760974_decoy,TRY1,Decoy,0,-8.39325,-5.66,-2.73,-4.921525663204567
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(I)cc1,C40782423_decoy,TRY1,Decoy,0,-7.58558,-5.37,-1.27,-5.204902642051394
Cc1ccc(Nc2[nH+]cnc(Nc3ncc(C(F)(F)F)cc3Cl)c2N)nc1,C40798934_decoy,TRY1,Decoy,0,-7.35631,-7.93,-1.81,-6.620373806864963
C[C@@H](O)[C@@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44019208_decoy,TRY1,Decoy,0,-9.95773,-6.74,-1.07,-5.835730746254746
CCOc1ccc(Nc2c(C)c(N[C@H]3CCCC[C@@H]3[NH3+])c(C#N)c3ccnn23)cc1,C45254994_decoy,TRY1,Decoy,0,-8.46561,-8.39,-1.55,-12.228526016645398
C[C@H](C(=O)NC1CC1)[NH+]1CCN([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C45681829_decoy,TRY1,Decoy,0,-9.34623,-7.9,-2.93,-8.390689619045656
C[C@]([NH3+])(COc1c(Br)cc([N+](=O)[O-])cc1Br)C(N)=O,C50441546_decoy,TRY1,Decoy,0,-9.49288,-4.93,-1.87,-6.028967162699587
C[C@H]1CC(=O)N2[C@H](NC(NCCc3c[nH]c4ccccc34)=[NH+][C@H]2c2ccccc2)N1,C39357300_decoy,TRY1,Decoy,0,-8.03949,-7.06,-1.05,-4.9976538558106425
CC(C)(Cc1ccc(O)cc1)NC(=O)CC(=O)NNC1=c2cc(Br)ccc2=[NH+]C1=O,C13523733_decoy,TRY1,Decoy,0,-8.8768,-7.57,-2.2,-6.672614767102408
Nc1nc(CN2C(=O)N[C@H](CC3=c4ccccc4=[NH+]C3)C2=O)nc(Nc2ccccc2)n1,C63187756_decoy,TRY1,Decoy,0,-6.91516,-9.13,-1.66,-7.467625615413892
O=C(NNC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1cccs1)Nc1ccc(Cl)c(Cl)c1,C63266692_decoy,TRY1,Decoy,0,-8.53391,-8.12,-3.66,-7.233512957679236
NC1=NON[C@@H]1N1N=N[C@@H](c2n[nH]c(-c3ccncc3)n2)[C@@H]1C[NH+]1CCCCC1,C28529682_decoy2,TRY1,Decoy,0,-8.53048,-6.99,,-6.022270211030913
O=C(CC[C@@H]1NN[C@@H](C(=O)Nc2ccccc2)S1)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63686268_decoy,TRY1,Decoy,0,-10.2584,-7.9,-3.18,-6.733146769851974
CCc1[nH]c(CNc2cc(C(=O)N[C@H]3CCCCNC3=O)cc(S(=O)(=O)NC(C)C)c2)c(C)[nH+]1,C14744245_decoy1,TRY1,Decoy,0,-8.65621,-7.88,,-7.19801192678941
Cc1cccc2c1c(/N=[NH+]/C(N)=S)c(O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C36231207_decoy,TRY1,Decoy,0,-7.40179,-5.05,-1.92,-4.228310746206759
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@H]1NNS[C@@H]1NC(=O)N1CCOCC1,C65330191_decoy,TRY1,Decoy,0,-8.20282,-6.75,-1.99,-5.683420792502232
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc(-c3nc(C4CC4)n[nH]3)cc2)CC1,C67551471_decoy,TRY1,Decoy,0,-8.86366,-7.05,-1.99,-6.723898625492526
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O,C03830386_decoy,TRY1,Decoy,0,-8.11482,-8.86,-1.83,-7.678380312866436
C[C@@]12CO[C@@H](C[NH3+])O[C@@H]1CC[C@]1(C)[C@@H]2CC[C@@H](O)[C@H]1CC(=O)NCc1cccs1,C04236956_decoy,TRY1,Decoy,0,-9.4728,-7.49,-2.79,-7.503095397756963
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)N4CCOCC4)nc3[C@@H](CC(=O)NCC[NH+]3CCOCC3)[C@]2(C)CC[C@H]1O,C05396974_decoy,TRY1,Decoy,0,-11.1902,-5.97,-2.75,-6.263219738548783
CC(=O)[C@@]1(C)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@H](O)[C@@H](C)O2)C1)C(=O)c1ccccc1C3=O,C05492717_decoy,TRY1,Decoy,0,-7.2535,-7.19,-1.41,-4.799451371707422
CCOc1ccccc1-n1c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)[nH]c1=O,C05673443_decoy,TRY1,Decoy,0,-7.25449,-7.16,-1.84,-6.462673597888016
C/C(=N\NC(N)=O)[C@@H](C[NH+](C)C)[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O,C05832164_decoy,TRY1,Decoy,0,-7.22908,-7.4,-4.24,-8.69408010446088
CC1(C)Cc2c(sc(NC(=O)c3cc(Cl)ccc3Cl)c2C(N)=O)C(C)(C)[NH2+]1,C12378182_decoy,TRY1,Decoy,0,-9.04589,-6.51,-2.27,-5.495773912228873
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/CCCO)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C12660394_decoy,TRY1,Decoy,0,-9.6375,-7.06,-1.0,-6.527762807201311
Cc1[nH]nc(-c2ccc(OCC[NH+]3CCC(C(N)=O)CC3)cc2O)c1-c1ccc(Cl)cc1,C09410451_decoy,TRY1,Decoy,0,-9.15472,-7.44,-3.9,-6.2683885445408425
[NH3+]C1=Cc2ncnn2C(N2N=C(c3ccc(Cl)cc3)C[C@@]2(O)C(F)(F)F)=NN1,C25176659_decoy,TRY1,Decoy,0,-9.89692,-6.63,-1.43,-6.001847540262466
CC1(C)[NH+]=C(N)N=C(N)N1c1ccc(CCCCc2ccc(Cl)cc2Cl)cc1,C17039536_decoy,TRY1,Decoy,0,-10.4154,-6.36,-2.02,-10.353355117453678
COc1cc2c(cc1OC)-c1nc(N)c(C[NH3+])c(-c3ccc(Cl)cc3Cl)c1C2,C27202606_decoy,TRY1,Decoy,0,-7.45955,-7.35,-1.77,-6.1698582246725024
CC1(C)[NH+]=C(N)N=C(N)N1c1cccc(CCCCc2c(Cl)cccc2Cl)c1,C17039685_decoy,TRY1,Decoy,0,-8.85555,-7.7,-2.97,-6.996090801625806
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccc(/C=N/[NH+]=C(N)N)cc3nc2-1,C12952388_decoy,TRY1,Decoy,0,-10.9348,-8.77,-1.77,-8.535991966170027
C[NH+](CCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)CC(=O)Nc1ccc(Cl)c(Cl)c1,C28894579_decoy,TRY1,Decoy,0,-8.99235,-7.62,-4.9,-6.093860209412266
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C35636346_decoy,TRY1,Decoy,0,-8.07679,-9.86,-2.68,-7.368370946535483
[NH3+]CC(=O)NCC(=O)Nc1c(Br)cc(Br)cc1Br,C37626070_decoy,TRY1,Decoy,0,-9.10526,-5.89,-2.5,-8.409873322180319
NC(=O)C[C@@H]([NH3+])C(=O)Nc1c(Br)cc(Br)cc1Br,C37626071_decoy,TRY1,Decoy,0,-9.31828,-4.68,-2.51,-5.847033592750377
NC(=O)C[C@H]([NH3+])C(=O)Nc1c(Br)cc(Br)cc1Br,C37626072_decoy,TRY1,Decoy,0,-8.5589,-4.15,-2.4,-5.210101647753162
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)Cl)[NH+](C)C1,C08552275_decoy,TRY1,Decoy,0,-8.12064,-5.1,-2.03,-5.214401505055966
CC1=C(c2ccc3c(c2)OCCO3)[C@@H](c2ccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[NH+]=N1,C38545704_decoy,TRY1,Decoy,0,-7.58699,-8.03,-2.3,-7.873155341146161
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@H]1NN[C@H](SCc2ccc(Cl)c(Cl)c2)O1,C38965849_decoy,TRY1,Decoy,0,-9.07578,-5.61,-2.08,-5.47021968622291
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c1F,C39661796_decoy,TRY1,Decoy,0,-9.19281,-8.7,-1.79,-7.313499540176702
N#CC1=C(N)O[C@H]2N=[NH+][C@@H](c3ccc4ccccc4c3)[C@@H]2[C@@H]1c1cn(CC(N)=O)nc1-c1ccccc1,C39964304_decoy,TRY1,Decoy,0,-7.97067,-5.35,-2.37,-4.9401818693876
CC[C@@H](C)Nc1cc(-c2nc(SC[C@@H](O)CO)[nH]c2-c2ccc(F)cc2)cc[nH+]1,C40393263_decoy,TRY1,Decoy,0,-9.71773,-7.9,-1.49,-9.493137742157836
[NH3+]C[C@@]12CC(=O)Nc3cccc(c31)N(Cc1ccc3cc4c(cc3n1)C[C@]1(C4)C(=O)Nc3ncccc31)C2=O,C43153540_decoy,TRY1,Decoy,0,-8.57396,-7.76,-1.82,-6.524492480105127
CC(C)c1ccc2c(c1)CC[C@@H]1[C@@](C)(CNC(=O)c3coc([C@@H]([NH3+])[C@H](C)O)n3)CCC[C@]21C,C43218178_decoy,TRY1,Decoy,0,-9.98402,-6.53,-1.76,-6.929957222297472
C[C@@H](O)[C@@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44019211_decoy,TRY1,Decoy,0,-8.23993,-7.84,-1.38,-6.3298129587702885
Cn1nc(C(F)(F)F)c([C@H]([NH3+])CC(N)=O)c1Sc1ccc(Br)cc1,C44255323_decoy,TRY1,Decoy,0,-7.56397,-5.35,-1.32,-5.230359126800876
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+]([C@H](C)C(=O)NC2CC2)CC1,C45681831_decoy,TRY1,Decoy,0,-9.71427,-7.85,-2.76,-8.168521792274648
CC1(C)[NH+]=C(N)N=C(N)N1c1cccc(CCCCc2ccc(Cl)cc2Cl)c1,C17039547_decoy,TRY1,Decoy,0,-9.58216,-8.25,-2.47,-8.19066274590921
NC(=[NH2+])N/N=C/c1cc(I)cc(I)c1O,C59145542_decoy,TRY1,Decoy,0,-8.5469,-6.53,-0.61,-9.211777704721213
C=CCOc1c(I)cc(/C=N/NC(N)=[NH2+])cc1I,C33787790_decoy,TRY1,Decoy,0,-9.50721,-6.46,-0.83,-13.302084995280111
NC1=[NH+]c2nc3cc4c(cc3n2[C@@H](c2ccc(OCCO)cc2Br)N1)OCCCO4,C12507682_decoy,TRY1,Decoy,0,-8.86843,-5.83,-2.41,-5.490228512980087
COc1ccc(/C=N/Nc2n[nH]c(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n2)cc1,C20832282_decoy,TRY1,Decoy,0,-8.17054,-7.8,-2.04,-7.275219607618212
CC1(C)CC(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)CC(C)(C)[NH2+]1,C59795190_decoy,TRY1,Decoy,0,-9.87197,-6.45,-0.84,-6.058534315278555
CCc1[nH]c(C)c(CNc2cc(C(=O)N[C@H]3CCCCNC3=O)cc(S(=O)(=O)NC(C)C)c2)[nH+]1,C14744245_decoy2,TRY1,Decoy,0,-8.86329,-7.88,,-7.113591369904156
CC(C)(Cc1ccc(O)cc1)NC(=O)CC(=O)NNC1=c2ccc(Br)cc2=[NH+]C1=O,C13570697_decoy,TRY1,Decoy,0,-9.8882,-8.14,-3.57,-7.572632304793704
CC(C)NC(=O)CNC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63270466_decoy,TRY1,Decoy,0,-7.90449,-8.71,-1.07,-7.309851344207449
CCOc1cc(/C=N/[NH+]=C(/N)c2nonc2N)cc(Br)c1OCc1ccc(Cl)cc1,C13647989_decoy2,TRY1,Decoy,0,-8.49086,-7.67,,-7.48187235389561
O=C(CC[C@@H]1NN[C@H](C(=O)Nc2ccccc2)S1)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63686269_decoy,TRY1,Decoy,0,-9.29167,-7.75,-1.4,-7.391137906000087
COc1ccc2c(c1)=C(CCNC(=O)[C@H]1N[C@@H](CC(=O)Nc3ccc(F)cc3F)NO1)C[NH+]=2,C63796067_decoy,TRY1,Decoy,0,-8.23274,-8.4,-1.92,-7.33106413410097
COc1ccccc1NC(=O)C[C@H]1NO[C@@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)N1,C63818745_decoy,TRY1,Decoy,0,-8.67614,-7.81,-1.83,-7.15218042821324
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4ccccc4Cl)[C@@H](O)N[C@H]3O)[C@H]1[NH+]=2,C64198047_decoy,TRY1,Decoy,0,-8.24634,-6.75,-2.09,-4.9369748663870405
COc1ccc2[nH+]c(C)cc(NCCCCCCCCCNc3cc(C)[nH+]c4ccc(OC)cc34)c2c1,C04416565_decoy,TRY1,Decoy,0,-10.2222,-5.74,-2.8,-6.865504986426868
CC[NH+](CC)CCC[C@@H](C)Nc1cccc2c1C(=O)c1cccc(N[C@@H](C)CCC[NH+](CC)CC)c1C2=O,C04773563_decoy,TRY1,Decoy,0,-9.01391,-6.4,-2.3,-7.120364399125511
COc1ccc2c(NCCCCCCNc3c4ccccc4[nH+]c4cc(OC)ccc34)c3ccccc3[nH+]c2c1,C05437295_decoy,TRY1,Decoy,0,-10.1603,-10.13,-4.16,-10.1735116499626
Cc1cc(NCCCCCCCCNc2cc(C)[nH+]c3cc(N(C)C)ccc23)c2ccc(N(C)C)cc2[nH+]1,C05390317_decoy,TRY1,Decoy,0,-9.69951,-6.68,-2.04,-7.2664563802832784
C/C(=N/NC(=S)Nc1cccc(C)c1)c1cccc(/C(C)=N/NC(=S)Nc2cccc(C)c2)n1,C05741820_decoy,TRY1,Decoy,0,-9.20863,-6.94,-3.64,-6.483038402532501
CC(C)C[NH+](Cc1c(O)c(C[NH+](CC(C)C)CC(C)C)c2oc(-c3ccccc3)cc(=O)c2c1O)CC(C)C,C09007629_decoy,TRY1,Decoy,0,-8.58842,-5.99,-3.79,-6.456642340928406
Cc1ccc(C)c(NC(=O)CCC(=O)NNC(=S)NC(=O)CCCOc2ccc(Cl)cc2Cl)c1,C12570266_decoy,TRY1,Decoy,0,-10.1644,-8.36,-3.56,-8.16705272496549
Cc1ccc2nc(NC(=S)NCCCCNC(=S)Nc3ccc4cc(C)ccc4n3)ccc2c1,C13208068_decoy,TRY1,Decoy,0,-10.1106,-6.49,-3.29,-7.056700025521218
Cc1ccc2nc(NC(=S)NCCCCCCNC(=S)Nc3ccc4cc(C)ccc4n3)ccc2c1,C05390506_decoy,TRY1,Decoy,0,-8.95263,-7.89,-3.77,-7.497748770036211
CCOCCCNC(=S)NNC(=O)c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc(Cl)cc1)N2,C02794652_decoy,TRY1,Decoy,0,-8.64471,-5.92,-2.73,-5.511459797899039
CCOCCCNC(=S)NNC(=O)c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(Cl)cc1)N2,C02794651_decoy,TRY1,Decoy,0,-9.60572,-6.75,-3.95,-5.951442707410782
CCCC[C@](CC)(CCCNC(=O)Nc1ccc(Cl)cc1)CNC(=O)Nc1ccc(Cl)cc1,C16637595_decoy,TRY1,Decoy,0,-10.1177,-7.68,-3.1,-7.378557392105257
CCOCCCNC(=S)NNC(=O)c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(C)c(C)c1)N2,C02794355_decoy,TRY1,Decoy,0,-9.99723,-6.78,-3.15,-6.238180360101175
C=CCc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3ccc(C(F)(F)F)cc3)n[nH]2)c1O,C20832684_decoy,TRY1,Decoy,0,-8.75309,-9.06,-3.82,-7.20036361195071
C=CCc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3cccc(C(F)(F)F)c3)n[nH]2)c1O,C20832692_decoy,TRY1,Decoy,0,-8.91139,-7.11,-2.23,-7.375624831521847
C=CCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cccc3ccccc23)n1N,C20912507_decoy,TRY1,Decoy,0,-9.76643,-8.65,-1.75,-9.56663729066667
CCCCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cccc3ccccc23)n1N,C20912511_decoy,TRY1,Decoy,0,-9.50535,-7.86,-4.55,-7.013200771176861
C[C@H]([NH2+]CCCCCCCCCC[NH2+][C@H](C)[C@@H]1COc2ccccc2O1)[C@@H]1COc2ccccc2O1,C16576232_decoy,TRY1,Decoy,0,-8.30153,-7.34,-2.74,-7.16997875498591
CCCCC/C=C/C(=O)N(c1cccc(Cl)c1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36481828_decoy,TRY1,Decoy,0,-9.52426,-7.64,-3.37,-10.621669583411796
CCCCC/C=C\C(=O)N(c1cccc(Cl)c1)[C@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36481833_decoy,TRY1,Decoy,0,-7.92483,-5.75,-3.42,-6.395872676326077
CCCCC/C=C/C(=O)N(c1cccc(Cl)c1)[C@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36481834_decoy,TRY1,Decoy,0,-8.46633,-5.92,-1.58,-6.4072219069396
CCCC[C@H](CC)C(=O)N(c1cccc(Cl)c1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36482245_decoy,TRY1,Decoy,0,-7.51783,-5.49,-4.17,-5.756610033443039
CCCC[C@@H](CC)C(=O)N(c1cccc(Cl)c1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36482246_decoy,TRY1,Decoy,0,-8.68623,-6.52,-1.88,-9.624421999295224
CCCC[C@H](CC)C(=O)N(c1cccc(Cl)c1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36482247_decoy,TRY1,Decoy,0,-8.09817,-6.83,-2.78,-9.797978516478612
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)[C@H](CC)CCCC)c1cccc(Cl)c1,C36482252_decoy,TRY1,Decoy,0,-8.4169,-5.45,-3.85,-6.384638930661748
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H](CC)CCCC)c1cccc(Cl)c1,C36482255_decoy,TRY1,Decoy,0,-8.23496,-4.36,-2.19,-6.423267784913945
C[C@H](CC(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O)c1ccccc1,C36501675_decoy,TRY1,Decoy,0,-7.67841,-7.51,-3.72,-7.631586011394472
C[C@H](CC(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O)c1ccccc1,C36501677_decoy,TRY1,Decoy,0,-7.76918,-6.78,-4.31,-7.759178845557286
CCCCCC(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36504049_decoy,TRY1,Decoy,0,-7.78658,-6.91,-2.29,-7.791166609391496
CCCCCCN(C(=O)[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C)[C@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36509371_decoy,TRY1,Decoy,0,-8.18909,-5.93,-4.6,-6.3458772567516215
CCCCCCN(C(=O)CCC1CCCCC1)[C@@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36509538_decoy,TRY1,Decoy,0,-9.22083,-7.12,-3.24,-9.330016493316924
CCCCC/C=C/C(=O)N(CCCCCC)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36509900_decoy,TRY1,Decoy,0,-8.97348,-5.7,-2.18,-6.628843327625331
CCCCCCN(C(=O)Cc1cccc(Cl)c1Cl)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36514989_decoy,TRY1,Decoy,0,-9.37545,-6.86,-1.99,-8.712355643564198
CCCCCCN(C(=O)CCl)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36517314_decoy,TRY1,Decoy,0,-8.03211,-7.89,-3.31,-9.228806502344126
CCCCC/C=C/C(=O)N(c1ccccc1Cl)[C@@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36542060_decoy,TRY1,Decoy,0,-9.12048,-7.35,-3.58,-8.860745087055136
CCCCC/C=C\C(=O)N(c1ccccc1Cl)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36542063_decoy,TRY1,Decoy,0,-7.67668,-5.07,-5.79,-6.034467462618186
CCCC[C@@H](CC)C(=O)N(c1ccccc1Cl)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36542525_decoy,TRY1,Decoy,0,-7.14409,-5.09,-4.34,-5.589062871859103
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@H](CC)CCCC)c1ccccc1Cl,C36542533_decoy,TRY1,Decoy,0,-8.13554,-5.37,-3.89,-6.757599785627234
CCCCCC(=O)N(c1ccccc1Cl)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36547952_decoy,TRY1,Decoy,0,-7.03264,-6.85,-4.63,-8.091007061732888
CCCCCC(=O)N(c1cccc(Cl)c1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36552465_decoy,TRY1,Decoy,0,-8.09194,-5.81,-1.83,-7.124377953941548
CCCN(C(=O)CCC1CCCCC1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36562473_decoy,TRY1,Decoy,0,-8.9429,-6.73,-2.39,-8.310950965839938
CCCCC/C=C\C(=O)N([C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O)C(C)(C)C,C36581984_decoy,TRY1,Decoy,0,-5.39066,-5.73,-4.78,-5.013042217333559
C[C@@H](CC(=O)N([C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O)C(C)(C)C)c1ccccc1,C36587987_decoy,TRY1,Decoy,0,-4.12164,-6.66,-2.8,-4.548861276646531
C=CCc1cccc(/C=N/NC(=O)CCCCCCC(=O)N/N=C/c2cccc(CC=C)c2O)c1O,C12379099_decoy,TRY1,Decoy,0,-8.96348,-6.87,-2.73,-7.184113747612751
CCC[NH+]1CCC(N2C[C@@H]([NH2+]Cc3ccc(F)cc3)C[C@H]2C(=O)NCCc2ccc3c(c2)OCO3)CC1,C23361992_decoy,TRY1,Decoy,0,-10.0337,-8.86,-1.8,-7.902908686131543
O=C(CSc1n[nH]c(N/N=C/c2ccccc2O)n1)Nc1ccccc1SCc1ccccc1,C58997029_decoy,TRY1,Decoy,0,-10.1265,-8.95,-2.94,-8.34883044200887
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(OC)ccc3O)n2)s1,C58998042_decoy,TRY1,Decoy,0,-10.6173,-6.3,-4.35,-7.406104789424704
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cc(Cl)ccc2O)n1,C59018674_decoy,TRY1,Decoy,0,-10.4756,-7.68,-4.21,-8.677741334156444
S=C(NCc1ccc2c(c1)OCO2)NC1CCC(NC(=S)NCc2ccc3c(c2)OCO3)CC1,C59115030_decoy,TRY1,Decoy,0,-10.4914,-6.46,-3.01,-6.897472902382178
CCC1=C(C)c2cc3[nH]c(cc4[nH]c(cc5[nH+]c(cc1[nH+]2)C(C)=C5CC)c(C)c4CCC(=O)OC)c(CCC(=O)OC)c3C,C04683165_decoy,TRY1,Decoy,0,-9.59875,-4.66,-2.34,-5.982269092503331
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C02130545_decoy,TRY1,Decoy,0,-9.14424,-5.92,-0.32,-5.542593788496943
C[C@@]12CO[C@@H](C[NH3+])O[C@@H]1CC[C@]1(C)[C@H]2CC[C@@H](O)[C@H]1CC(=O)NCc1cc(F)cc(F)c1,C04236953_decoy,TRY1,Decoy,0,-9.74077,-7.3,-3.17,-7.646880799869401
C[C@@]12CO[C@@H](C[NH3+])O[C@@H]1CC[C@]1(C)[C@H]2CC[C@@H](O)[C@H]1CC(=O)NCc1cccs1,C04236955_decoy,TRY1,Decoy,0,-10.134,-5.48,-3.01,-6.56189250199827
CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C(O)[C@]3(O)C(=O)C1=C2O,C04574558_decoy,TRY1,Decoy,0,-10.0477,-5.45,-2.88,-5.400374657031114
Cc1c2c(c(O)c3c(O)cccc13)C(=O)[C@@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@@H]1C2,C04113164_decoy,TRY1,Decoy,0,-7.05427,-6.03,-3.62,-3.339138358627616
CNC(=S)NNC(=O)C1=NO[C@@H](CNc2[nH+]cc(C(F)(F)F)cc2Cl)C1,C05209257_decoy,TRY1,Decoy,0,-9.11377,-6.65,-0.99,-5.825478327159422
O=C1c2ccccc2C(=O)c2c3c(cc(NCC[NH2+]CCO)c21)N(CCO)CCN3,C05370857_decoy,TRY1,Decoy,0,-8.82104,-6.51,-1.33,-5.845071402609204
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C(C)=C(C(C)=O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C05573301_decoy,TRY1,Decoy,0,-9.29093,-8.16,-5.34,-0.2864738836358265
COc1cc(-n2c(=O)[nH]c(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccccc43)c2=O)cc(OC)c1OC,C08791307_decoy,TRY1,Decoy,0,-7.54765,-6.25,-4.85,-4.907777608050843
O=c1[nH]c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)n1-c1ccc(Br)cc1,C08917883_decoy,TRY1,Decoy,0,-7.98451,-5.91,-2.32,-5.033017521706079
Cc1cc(Cl)c2c(c1)[C@@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12883478_decoy,TRY1,Decoy,0,-7.89196,-6.09,-0.93,-5.179103029369844
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1,C13163333_decoy,TRY1,Decoy,0,-8.78077,-9.12,-1.65,-6.5948598108033165
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4C[C@H]3C[C@H]12,C08615342_decoy,TRY1,Decoy,0,-7.80886,-6.34,-2.16,-4.3393614948417865
NC(=O)C[C@@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C08972077_decoy,TRY1,Decoy,0,-7.25837,-5.22,-1.38,-5.591494983745229
C[C@]1(CO)[C@H]2Cc3sc(N)[nH+]c3[C@@H](CC(=O)NCCN3CCOCC3)[C@]2(C)CC[C@H]1O,C20504841_decoy,TRY1,Decoy,0,-9.74637,-6.34,-0.92,-5.477489156294304
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3O)n2)CC(C)(C)[NH2+]1,C20832433_decoy,TRY1,Decoy,0,-7.81341,-8.5,-1.81,-7.364940093693125
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C21982917_decoy,TRY1,Decoy,0,-8.17889,-9.42,-1.56,-7.102062721911973
Cc1csc(NC(=O)CS[C@@H]2NN[C@@H](c3cc(Br)ccc3O)[NH+]2C)n1,C39035094_decoy,TRY1,Decoy,0,-8.30224,-6.49,-2.49,-7.805964723713694
COCc1cc(C)nc2c1[C@@H]([NH3+])[C@@H](C(=O)Nc1nc3ccc(NC(C)=O)cc3s1)S2,C39272627_decoy,TRY1,Decoy,0,-8.95604,-5.96,-1.63,-6.952339142446414
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661831_decoy,TRY1,Decoy,0,-8.62915,-9.38,-2.04,-8.309314074251262
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)NN1C,C39684259_decoy,TRY1,Decoy,0,-8.42862,-8.94,-1.64,-7.650789700350058
OC[C@@H](O)[C@H](O)[C@H](O)[C@@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C35365984_decoy,TRY1,Decoy,0,-8.07638,-5.58,-0.96,-5.661916993144833
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1ccccc1C3=O,C40555045_decoy,TRY1,Decoy,0,-9.80434,-9.63,-2.01,-9.195939791451195
C[NH+]1CCN(Nc2ncnc(Nc3ccc(I)cc3)c2N)CC1,C40756902_decoy,TRY1,Decoy,0,-7.34852,-5.37,-1.23,-5.083476976000766
[NH3+]C[C@]12CC(=O)Nc3cccc(c31)N(Cc1ccc3cc4c(cc3n1)C[C@]1(C4)C(=O)Nc3ncccc31)C2=O,C43153541_decoy,TRY1,Decoy,0,-8.16736,-8.81,-2.27,-6.332474227275233
CC[C@H]([NH3+])Cc1c(OC)cc(C)c2c1Oc1c(c(C)c(O)c3c1[C@@H](O)OC3=O)OC2=O,C44409691_decoy,TRY1,Decoy,0,-7.66297,-6.32,-1.81,-5.411161603899764
COc1cc(C)c2c(c1C[C@H](C)[NH3+])Oc1c(c(C)c(O)c3c1[C@@H](O)OC3=O)OC2=O,C44463416_decoy,TRY1,Decoy,0,-8.7197,-7.25,-1.59,-5.624835294294489
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44960179_decoy,TRY1,Decoy,0,-8.25964,-7.14,-2.2,-5.465207140026769
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(O[C@H](C[NH3+])c3ccccc3)cc21,C49089594_decoy,TRY1,Decoy,0,-10.423,-5.87,-3.53,-5.907882790335961
Cc1cc(C2=[NH+][C@H](C)CN2)cc2[nH]c([C@@H]3C(=O)N=CC=C3NC[C@H](O)c3cccc(Cl)c3)nc12,C52634751_decoy,TRY1,Decoy,0,-8.87075,-7.15,-1.11,-6.439083678163333
COc1cc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(Cl)c1O,C12507032_decoy,TRY1,Decoy,0,-9.37834,-7.42,-2.57,-5.909792335243953
COc1cc([C@@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(Br)c1O,C12818079_decoy,TRY1,Decoy,0,-9.00806,-7.34,-1.81,-6.6917526337762405
COc1cc([C@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(Br)c1O,C12818088_decoy,TRY1,Decoy,0,-8.98639,-6.64,-2.38,-5.757826876059148
COc1cc([C@H]2NC(N)=[NH+]c3nc4ccccc4n32)cc(I)c1O,C18053706_decoy,TRY1,Decoy,0,-8.62694,-7.12,-3.15,-7.401517049662599
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258690_decoy,TRY1,Decoy,0,-8.10092,-7.11,-1.68,-6.650399536139851
CCOc1cc([C@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc(Cl)c1O,C12506447_decoy,TRY1,Decoy,0,-9.6566,-7.16,-1.72,-6.425320694305056
COc1cc([C@@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc(Cl)c1O,C12507031_decoy,TRY1,Decoy,0,-10.0656,-7.01,-2.8,-7.58873582101362
NC(=O)C1=C2CCC[C@H]2S[C@H]1NC(=O)C(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63272281_decoy,TRY1,Decoy,0,-8.87225,-7.67,-2.25,-7.070730391174996
O=C1[C@H]([C@@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@H](O)N1c1ccccc1Cl,C63641541_decoy,TRY1,Decoy,0,-6.28129,-6.34,-2.44,-4.87405581292852
O=C1[C@H]([C@@H]2NCCC3=c4ccccc4=[NH+][C@H]32)[C@H](O)N[C@H](O)N1c1ccccc1Cl,C63641543_decoy,TRY1,Decoy,0,-8.15583,-7.9,-2.02,-5.170257936629191
O=C1[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@H](O)N1c1ccccc1Cl,C63641544_decoy,TRY1,Decoy,0,-6.92459,-7.17,-2.58,-7.408353405238711
COc1cc(N2C(=O)[C@@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)[C@@H](O)N[C@@H]2O)cc(OC)c1OC,C64044450_decoy,TRY1,Decoy,0,-7.40052,-8.08,-2.72,-7.382615186862502
COc1ccc2c(c1)=C1CCN[C@@H]([C@H]3C(=O)N(c4ccccc4Cl)[C@@H](O)N[C@H]3O)[C@@H]1[NH+]=2,C64198051_decoy,TRY1,Decoy,0,-8.09749,-6.97,-2.43,-5.151285322147979
O=C(/C=C1/CS[C@@H](NC(=O)c2ccc[nH]c2=O)N1)NCCC1=c2ccccc2=[NH+]C1,C64403640_decoy,TRY1,Decoy,0,-8.07366,-9.09,-2.22,-6.913010094223617
C[C@@H]1C[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C[C@H](C)O1,C03360479_decoy,TRY1,Decoy,0,-9.44012,-6.45,-2.33,-5.939362275230521
C=C(C)C[NH+]1CCN(C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C09183658_decoy,TRY1,Decoy,0,-9.28135,-6.5,-2.38,-6.957847070430743
Oc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@@H](O)c3ccccc3)CC1)O2,C12329281_decoy,TRY1,Decoy,0,-9.04383,-5.43,-1.82,-5.2913948355938905
[NH2+]=c1oc2ccccc2cc1C(=O)N/N=C/c1cc(Cl)ccc1O,C25502023_decoy,TRY1,Decoy,0,-8.09762,-5.87,-0.82,-4.938463822602556
COc1ccc(-c2cc3ccc(O)c(C[NH2+]CCO)c3oc2=O)cc1,C32501414_decoy,TRY1,Decoy,0,-7.30706,-6.71,-1.57,-6.036212282850802
COc1c(Br)cc(Cl)cc1S(=O)(=O)N[C@H]1C[C@@H]1[NH3+],C36264594_decoy,TRY1,Decoy,0,-8.32933,-5.0,-0.11,-6.040503816488791
CCOc1cc(C[NH3+])cc(Br)c1O[C@@H]1CCCCNC1=O,C36824687_decoy,TRY1,Decoy,0,-8.91874,-5.06,-1.47,-7.583780663516933
COc1cc(C[NH2+][C@H]2CCCCNC2=O)cc(Br)c1O,C36976806_decoy,TRY1,Decoy,0,-7.22032,-5.79,-2.37,-4.927443313145172
CC(C)[NH2+][C@H](C(N)=O)c1cc(Br)c2c(c1)OCCCO2,C37869284_decoy,TRY1,Decoy,0,-7.78284,-5.77,-1.24,-6.680431037998526
CC(C)C[NH2+][C@@H](C(N)=O)c1cc(Br)c2c(c1)OCCO2,C37946309_decoy,TRY1,Decoy,0,-7.54917,-4.87,-2.76,-4.71710236699066
CCNC(=O)NC(=O)[C@@H](C)[NH2+]Cc1cc(F)ccc1Br,C38039310_decoy,TRY1,Decoy,0,-7.3806,-6.02,-0.88,-4.977544904062629
CCNC(=O)NC(=O)[C@H](C)[NH2+]Cc1cc(F)ccc1Br,C38039311_decoy,TRY1,Decoy,0,-7.25811,-5.32,-2.62,-6.292125407113542
C[C@@H]1c2cc(O)c(O)cc2CC[NH+]1CC(=O)Nc1sccc1C#N,C39303969_decoy,TRY1,Decoy,0,-9.73884,-6.11,-2.67,-5.800177262740188
CC1=C([C@@H]2C=C(c3ccc(Cl)c(Cl)c3)N=N2)[C@H]([NH3+])C(=O)N(C)N1,C39448332_decoy,TRY1,Decoy,0,-9.93009,-9.49,-1.17,-8.489044875429995
C[NH+]1CCC(NC(=O)c2cc(Cl)ccc2Cl)(C(N)=S)CC1,C40366195_decoy,TRY1,Decoy,0,-8.12662,-4.38,-1.71,-4.6244078571388645
Cc1cccc(Nc2ncnc(N(C)C3CC[NH+](C)CC3)c2N)c1C,C40755252_decoy,TRY1,Decoy,0,-6.78107,-7.45,-1.33,-6.965146309048001
CCNC(=O)NC(=O)[C@H](C)[NH2+]Cc1cc(Br)ccc1F,C41065353_decoy,TRY1,Decoy,0,-7.03005,-4.94,-1.9,-4.75400685735788
O=C1Nc2cc(F)c(Br)cc2[C@@H]1[NH2+]C1CCC(O)CC1,C42135078_decoy,TRY1,Decoy,0,-8.87268,-6.05,-0.4,-4.687226966987568
CC1(C)C[C@@H]1NS(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl,C45141212_decoy,TRY1,Decoy,0,-9.53106,-6.26,-6.64,-8.08168107976198
CC(C)[NH2+][C@](Cn1cc(Br)cn1)(C(N)=O)c1ccccc1,C45437278_decoy,TRY1,Decoy,0,-6.1885,-5.41,-1.74,-5.134400113959857
CC(C)[NH2+][C@@](Cn1cc(Br)cn1)(C(N)=O)c1ccccc1,C45437280_decoy,TRY1,Decoy,0,-6.78933,-4.15,-1.66,-4.404930927112067
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Br,C45623313_decoy,TRY1,Decoy,0,-9.23202,-4.32,-1.51,-4.832209324214979
C#CC[NH+](CC(=O)Nc1sccc1C(N)=O)[C@H]1CCc2ccccc21,C47405977_decoy,TRY1,Decoy,0,-7.764,-5.81,-2.01,-5.576440286573756
C[C@@H](C[NH+]1CCCC1)NS(=O)(=O)c1cc(Br)ccc1N,C49150691_decoy,TRY1,Decoy,0,-8.21986,-5.77,-1.03,-5.026982597530315
C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1cc(Br)ccc1N,C49554831_decoy,TRY1,Decoy,0,-6.95101,-5.33,-1.24,-6.097696671825957
Cc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCCNC2=O)c(Br)c1,C50395948_decoy,TRY1,Decoy,0,-8.30184,-5.98,-2.1,-8.643691872012692
C[C@@H](Nc1c(N)c[nH+]c2ccc(Br)cc12)c1nncn1C,C50417271_decoy,TRY1,Decoy,0,-6.62502,-6.61,-0.3,-5.03323062842484
C[C@H]([NH3+])[C@@H](Sc1ncnc2nc[nH]c12)c1ccc(Br)cc1,C51036207_decoy,TRY1,Decoy,0,-8.30582,-6.18,-0.86,-7.100655726904671
C[C@H]([NH3+])[C@@H](Sc1ncnc2nc[nH]c12)c1ccccc1Br,C51036227_decoy,TRY1,Decoy,0,-7.43369,-6.13,-3.47,-6.16335854640775
O[C@H](C[NH2+][C@@H]1CCCC[C@@H]1O)COc1ccc(Br)cc1,C52013885_decoy,TRY1,Decoy,0,-7.89824,-5.44,-1.84,-5.491250164244272
CC(C)[NH+](CC(N)=O)CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2,C14927183_decoy,TRY1,Decoy,0,-8.24252,-5.84,-2.0,-5.410027379165831
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+](C)Cc1ccc(Cl)s1,C08473899_decoy,TRY1,Decoy,0,-8.24161,-5.9,-0.42,-9.875986459548074
CCn1c(S[C@H](c2cccc(Br)c2)[C@@H](C)[NH3+])n[nH]c1=O,C61594333_decoy,TRY1,Decoy,0,-8.3566,-6.37,-1.2,-6.964417333647349
CCn1c(S[C@@H](c2cccc(Br)c2)[C@H](C)[NH3+])n[nH]c1=O,C61594334_decoy,TRY1,Decoy,0,-8.83652,-5.97,-1.5,-7.400619932519736
CCn1c(S[C@H](c2ccc(Br)s2)[C@@H](C)[NH3+])n[nH]c1=O,C61594375_decoy,TRY1,Decoy,0,-8.49644,-5.7,-1.23,-7.028589095854965
CCCn1c(S[C@@H](C[NH3+])c2ccc(Br)cc2)n[nH]c1=O,C61594899_decoy,TRY1,Decoy,0,-8.15943,-5.7,-1.63,-5.347537034740548
CC(C)n1c(S[C@@H](C[NH3+])c2ccc(Br)cc2)n[nH]c1=O,C61595175_decoy,TRY1,Decoy,0,-6.84062,-5.58,-0.84,-4.777266255253549
C[C@@](C(=O)[O-])(c1ccc(F)c(Br)c1)[NH+]1CC[C@H](C[NH3+])C1,C61690316_decoy,TRY1,Decoy,0,-9.08495,-5.81,-1.12,-8.87507064157481
C[NH+]1CC[C@H](NS(=O)(=O)c2cc(Cl)cc(N)c2Br)C1,C61882297_decoy,TRY1,Decoy,0,-7.22682,-4.7,-4.86,-3.947095101715111
CCOc1ccc(Br)cc1S(=O)(=O)NC(C)(C)C[NH3+],C63020617_decoy,TRY1,Decoy,0,-7.28325,-4.52,-1.56,-5.170146494477133
[NH3+][C@H]1CCC[C@H]1NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl,C63176278_decoy,TRY1,Decoy,0,-9.27376,-7.01,-2.45,-9.37332165541605
O=C(CNC(=O)[C@@H]1C=c2ccccc2=[NH+]1)N[C@@H]1Nc2ccccc2S1,C63280023_decoy,TRY1,Decoy,0,-6.70352,-8.65,-1.74,-6.82713921206757
Cc1ccc(/[NH+]=c2\oc3c(C)ncc(CO)c3cc2C(N)=O)c(F)c1,C12338886_decoy,TRY1,Decoy,0,-6.91906,-7.11,-1.57,-5.064404456780938
Cc1ccc(C#N)cc1NC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C63814383_decoy,TRY1,Decoy,0,-6.96259,-7.08,-2.3,-5.302626472893013
C[C@H](NC(=O)N[C@H]1CC[NH+]2CCCC[C@H]12)c1ccc2c(c1)CC(=O)N2,C65444068_decoy,TRY1,Decoy,0,-8.64391,-9.19,-1.24,-8.678830524103576
C[C@@H](NC(=O)N[C@H]1CC[NH+]2CCCC[C@H]12)c1ccc2c(c1)CC(=O)N2,C65444072_decoy,TRY1,Decoy,0,-10.1024,-5.98,-0.82,-5.560913070605902
CC1CC[NH+](CCNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)CC1,C65449243_decoy,TRY1,Decoy,0,-8.09393,-8.34,-0.45,-7.326003872071591
CSc1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cn1,C66206314_decoy,TRY1,Decoy,0,-8.69228,-6.25,-1.92,-5.661420109281048
CC(=O)Nc1cc(NC(=O)NC2CC[NH+](C(C)C)CC2)c(F)cc1F,C66981031_decoy,TRY1,Decoy,0,-8.05705,-5.3,-4.65,-5.550667428344427
CC(=O)Nc1cc(NC(=O)NCC[NH+]2CCC(C)CC2)c(F)cc1F,C66981591_decoy,TRY1,Decoy,0,-8.33533,-5.83,-1.42,-6.12833219574172
C[C@@H](Cc1ccc2c(c1)OCO2)[NH2+]C[C@@H](O)c1ccc(O)c(O)c1,C01704227_decoy,TRY1,Decoy,0,-7.67036,-7.14,-3.0,-6.255563050782577
O=c1cc(CO)oc([C@H](Nc2cccc[nH+]2)c2ccccc2O)c1O,C00134600_decoy,TRY1,Decoy,0,-7.27225,-6.8,-0.46,-5.458585254515025
CNc1cc(CO)c2c(c1OC)N[C@H](c1ccc(O)cc1)C[NH+](C)C2,C13370848_decoy,TRY1,Decoy,0,-7.51451,-5.02,-0.57,-4.724872660970308
[NH3+][C@H](c1cccc(Br)c1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1,C19842545_decoy,TRY1,Decoy,0,-7.6322,-5.85,-1.67,-4.210252012268739
Cc1c(Cl)cccc1NC(=[NH2+])Nc1nc(=O)c2c([nH]1)CCCC2,C20064250_decoy,TRY1,Decoy,0,-9.58271,-5.53,-0.93,-5.199189318722532
COc1cc([C@H](C[NH3+])N(C)c2ccc(O)cc2)cc(Cl)c1O,C33461793_decoy,TRY1,Decoy,0,-7.2281,-6.76,-1.88,-8.302108610965346
[NH3+][C@H](c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccc(Br)s1,C35379747_decoy,TRY1,Decoy,0,-8.17854,-6.93,-0.2,-4.949496561825076
CC[NH2+]Cc1cc(Cl)cc(Cl)c1O[C@H](C)C(=O)NC(N)=O,C35662083_decoy,TRY1,Decoy,0,-8.3275,-5.38,-1.77,-5.327952970573439
CC[NH+](CC(=O)NC)CC(=O)Nc1c(Cl)cc(N)cc1Cl,C36797466_decoy,TRY1,Decoy,0,-7.61468,-5.42,-1.8,-9.243544227167249
Cc1cc(Br)ccc1[C@@H]([NH3+])c1ccc2[nH]c(=O)[nH]c2c1,C36829531_decoy,TRY1,Decoy,0,-8.45187,-6.7,-0.46,-5.449791347601337
[NH3+]C1(c2nc(-c3nc4ccc(Br)cc4[nH]3)c[nH]2)CCC1,C37599884_decoy,TRY1,Decoy,0,-9.75661,-4.4,-0.75,-4.826773696725965
NC(=O)CC1(C[C@@H]([NH3+])c2cc(Cl)sc2Cl)CCCCC1,C37636885_decoy,TRY1,Decoy,0,-10.2198,-4.83,-2.94,-5.8331523961991305
C[C@@H]1[C@@H](NC(=O)c2cccnc2NCCC[NH3+])C[C@H]2C[C@@H]1C2(C)C,C39230563_decoy,TRY1,Decoy,0,-7.57237,-5.96,-3.09,-8.558746701323562
COc1cc2c(c(O)c1O)[C@H](Cc1ccc(O)c(O)c1)[NH+](C)CC2,C39546140_decoy,TRY1,Decoy,0,-9.1893,-7.47,-1.16,-7.098762192153041
NC(=O)CC1(C[C@H]([NH3+])c2ccc(Br)s2)CCCCC1,C40237316_decoy,TRY1,Decoy,0,-8.68212,-5.33,-1.3,-5.67394121371353
C[NH+]1CCC(NC(=O)c2ccccc2Br)(/C(N)=N/O)CC1,C40371413_decoy,TRY1,Decoy,0,-6.35351,-4.03,-1.55,-4.382956389375559
Nc1c(Nc2cc[nH+]cc2)ncnc1Nc1cccc2ccccc12,C40687568_decoy,TRY1,Decoy,0,-6.93051,-7.29,-0.25,-6.978230982689738
Nc1c[nH+]c2ccc(Br)cc2c1N(CCO)CCO,C40694616_decoy,TRY1,Decoy,0,-7.50339,-5.49,-3.13,-4.393453288805869
Cc1cccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)c1C,C40755017_decoy,TRY1,Decoy,0,-7.07051,-5.88,-1.37,-5.173976553492421
CN(C)Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40759926_decoy,TRY1,Decoy,0,-7.8806,-6.91,0.1,-16.132645990851803
NC(=O)CC1(C[C@H]([NH3+])c2ccc(Cl)cc2Cl)CCCCC1,C40940924_decoy,TRY1,Decoy,0,-8.41456,-4.48,-3.11,-5.770807291055788
Cc1cc(Br)cc2c1NC(=O)[C@H]2[NH2+]C(C)(C)C(N)=O,C42117876_decoy,TRY1,Decoy,0,-6.91948,-4.38,-0.68,-3.919335049784051
Nc1[nH][nH+]cc1Nc1ccc(Br)cc1Br,C42598529_decoy,TRY1,Decoy,0,-9.31059,-6.76,-0.09,-10.162981891389622
C[C@H](N)[C@@H](c1cc(Br)cs1)[NH+]1CCC[C@@H]1C(N)=O,C43285098_decoy,TRY1,Decoy,0,-7.12178,-4.36,-2.49,-4.53553080213817
C[C@@H](N)[C@@H](c1cc(Br)cs1)[NH+]1CCC[C@@H]1C(N)=O,C43285101_decoy,TRY1,Decoy,0,-7.29894,-3.4,-3.49,-3.931639255521517
C[C@H](N)[C@H](c1cc(Br)cs1)[NH+]1CCC[C@@H]1C(N)=O,C43285104_decoy,TRY1,Decoy,0,-8.02,-4.05,-1.21,-4.577193115996395
C[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1C[C@@H](C(N)=O)CC[C@@H]1C,C43287228_decoy,TRY1,Decoy,0,-8.50822,-3.57,-2.88,-4.496356279088666
COc1cc(C[C@@H]([NH3+])CO)c(Br)c(Br)c1O,C44463998_decoy,TRY1,Decoy,0,-10.067,-4.33,-1.15,-5.367862691533842
[NH3+][C@@H](CO)Cc1cc(Br)c(O)c(Br)c1,C44464002_decoy,TRY1,Decoy,0,-8.86326,-4.08,-1.34,-5.200627319274227
N[C@H](C[NH3+])c1cc(Cl)cc(C2CCCCC2)c1OCC1CC1,C44474786_decoy,TRY1,Decoy,0,-7.83253,-5.82,-0.91,-7.866710974080633
Nc1nc(Cl)cc(NC[C@@H](O)C[NH+]2CCc3ccccc3C2)n1,C44913867_decoy,TRY1,Decoy,0,-7.91192,-7.15,-1.4,-5.475586439911493
CNC(=O)[C@@H](C)Nc1c(N)c[nH+]c2ccc(Br)cc12,C49096194_decoy,TRY1,Decoy,0,-6.35827,-6.62,-0.69,-4.582136807396391
Nc1c[nH+]c2ccc(Br)cc2c1N[C@@H]1CCCNC1=O,C50397399_decoy,TRY1,Decoy,0,-6.9077,-5.19,-0.74,-4.158816621697048
NNc1ncc(Br)cc1C(=O)N[C@H]1CC[NH+]2CCCC[C@H]12,C51121180_decoy,TRY1,Decoy,0,-8.2019,-5.32,-1.63,-5.358405683193433
[NH3+][C@@H](c1ccc(Br)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094371_decoy,TRY1,Decoy,0,-8.04269,-7.85,-1.23,-12.480674987734464
Cc1cccc([C@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)c1,C52094381_decoy,TRY1,Decoy,0,-7.37168,-7.85,-0.46,-6.841617987636861
[NH3+][C@H](c1cccc(F)c1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094392_decoy,TRY1,Decoy,0,-7.65571,-5.41,-0.81,-3.9999403798124846
Cc1cccc(C[C@@H]([NH3+])c2cc3[nH]c(=O)[nH]c3cc2Br)c1,C52127949_decoy,TRY1,Decoy,0,-6.89575,-5.63,-2.05,-4.470711127712446
Nc1c(-c2cc(Br)c3c(c2)OCCO3)[nH+]c(C2CC2)n1N,C52839136_decoy,TRY1,Decoy,0,-8.25839,-7.53,-1.05,-5.043013297849744
[NH3+]c1cc2c(cc1NCc1ccc(Br)cc1)NC(=O)CC2,C57465025_decoy,TRY1,Decoy,0,-8.28336,-6.03,-1.5,-4.771700214289914
C[C@@H]1CC[C@H](C(N)=O)CN1[C@@H](C[NH3+])c1ccc(Br)s1,C43262538_decoy,TRY1,Decoy,0,-9.00699,-5.08,-0.94,-5.6648002023987365
C[C@H]1CC[C@H](C(N)=O)CN1[C@@H](C[NH3+])c1ccc(Br)s1,C43262541_decoy,TRY1,Decoy,0,-7.68311,-5.1,-1.64,-4.9358039264694
C[C@@H]1CC[C@@H](C(N)=O)CN1[C@@H](C[NH3+])c1ccc(Br)s1,C43262544_decoy,TRY1,Decoy,0,-8.97913,-5.32,-0.8,-5.652570859054892
C[C@H]1CC[C@@H](C(N)=O)CN1[C@@H](C[NH3+])c1ccc(Br)s1,C43262547_decoy,TRY1,Decoy,0,-7.65895,-4.32,-1.49,-4.360257978997643
NC1=[NH+]C2(CCCCC2)NC(Nc2ccc(Br)cc2)=N1,C08688054_decoy,TRY1,Decoy,0,-8.74977,-6.73,-0.96,-4.7818412289412935
C[C@]1(C(=O)Nc2cc3[nH]c(=O)[nH]c3cc2Br)CCC[NH2+]C1,C62855574_decoy,TRY1,Decoy,0,-6.73918,-5.44,-3.37,-4.204156773630848
C[C@@]1(C(=O)Nc2cc3[nH]c(=O)[nH]c3cc2Br)CC[NH2+]C1,C62893212_decoy,TRY1,Decoy,0,-6.63265,-5.09,-1.3,-4.709098601855252
CC[C@H]1CC2=c3ccccc3=[NH+][C@@H]2[C@H](c2c([O-])[nH]c(=O)[nH]c2=O)[NH2+]1,C63386214_decoy,TRY1,Decoy,0,-5.92159,-6.23,-0.51,-4.6520436277306985
CC[C@H]1CC2=c3ccccc3=[NH+][C@@H]2[C@H](c2c([O-])[nH]c(=S)[nH]c2=O)[NH2+]1,C63386361_decoy,TRY1,Decoy,0,-7.19228,-6.24,-0.94,-4.640708147226405
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)Sc1nc(N)cc(N)n1,C39996958_decoy,TRY1,Decoy,0,-7.60668,-7.33,-0.88,-7.308951649219906
Cc1cc2cc(CN(CC[NH+](C)C)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2cc1C,C04133569_decoy,TRY1,Decoy,0,-7.26701,-6.27,-1.66,-6.583591929945355
Fc1ccc(N2CC[NH+](C[C@H]3C[NH+]4CC[C@H]3C[C@@H]4CNC(=S)Nc3ccc(-n4cccn4)cc3)CC2)cc1,C08635656_decoy,TRY1,Decoy,0,-10.2568,-8.15,-2.24,-7.632319474337757
N#Cc1cccc(NC(=O)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1,C08635958_decoy,TRY1,Decoy,0,-7.82606,-7.85,-2.56,-6.63451904742197
O=c1cccc2n1C[C@H]1C[C@@H]2C[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNC(=S)Nc2ccccc2)C1,C08635961_decoy,TRY1,Decoy,0,-7.60377,-7.64,-2.12,-5.731566186695953
COCC[NH2+][C@H]1C[C@@H]2c3[nH]c4ccccc4c3C[C@@H](C(=O)OC)[NH+]2[C@H](c2ccc(C(F)(F)F)cc2)C1,C08636021_decoy,TRY1,Decoy,0,-8.60112,-6.58,-2.09,-8.956549231661203
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC[NH+](C)C)[NH+]2CCc3ccccc3C2)cc1,C10188452_decoy,TRY1,Decoy,0,-8.87732,-8.08,-4.19,-7.11108757603605
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH2+]C[C@@H]4CCC[NH+](C(C)C)C4)CC3)cc2)c(C)c1,C11786084_decoy,TRY1,Decoy,0,-7.95906,-6.73,-3.63,-5.887029505492207
CC(C)(CNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1cccc(F)c1F)[NH+]1CCOCC1,C11933068_decoy,TRY1,Decoy,0,-7.7664,-7.21,-3.25,-6.935280264748467
C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1,C12058349_decoy,TRY1,Decoy,0,-8.12375,-7.08,-2.13,-5.636499366957569
COc1ccc(C[NH+](C)CCc2c(C)n[nH]c2C)c(OC[C@H](O)C[NH+]2CCCC2)c1,C12479359_decoy,TRY1,Decoy,0,-8.05554,-6.93,-2.35,-7.087515173406305
C#CC[NH+](Cc1cc(OC)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1)C1CCCCC1,C12597428_decoy,TRY1,Decoy,0,-10.5574,-5.1,-2.81,-6.687209759950269
C[NH+](Cc1cccc(Cl)c1)Cc1cccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c1,C12718572_decoy,TRY1,Decoy,0,-7.97156,-6.14,-2.47,-5.187905677384404
O[C@@H](COc1ccccc1C[NH2+]CCCn1ncc2ccccc21)C[NH+]1CCCCC1,C12753227_decoy,TRY1,Decoy,0,-8.7046,-6.94,-1.44,-6.750496719900347
O[C@H](C[NH2+]CC1([NH+]2CCCCC2)CCCCC1)COc1ccc(-c2ccccc2)cc1,C19360361_decoy,TRY1,Decoy,0,-9.92007,-7.76,-3.07,-6.504234647796595
O[C@H](COc1ccccc1C[NH2+]CCN1CCOCC1)C[NH+]1CCc2ccccc2C1,C20323775_decoy,TRY1,Decoy,0,-8.71891,-6.78,-2.13,-6.313990920835776
COc1ccc(C[NH2+]Cc2cc(C(C)C)no2)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C20539010_decoy,TRY1,Decoy,0,-9.88541,-6.53,-4.58,-7.492978131874477
C[C@H]([NH2+]CCCCCC[NH2+][C@H](C)[C@@H]1COc2ccccc2O1)[C@@H]1COc2ccccc2O1,C16849775_decoy,TRY1,Decoy,0,-7.88704,-7.62,-3.77,-7.227710193090354
CC(C)(C)c1ccc(-c2cn3cccc(N4CC[NH+](Cc5c[nH]c(=O)[nH]c5=O)CC4)c3[nH+]2)cc1,C34602351_decoy,TRY1,Decoy,0,-8.29327,-6.32,-1.9,-4.999038737867679
CC1CC[NH+](C[C@@H](O)COc2ccc(OC[C@H](O)C[NH+]3CCC(C)CC3)cc2)CC1,C04714304_decoy,TRY1,Decoy,0,-10.1741,-6.83,-3.33,-6.638118063280847
Cc1ccc(CNC(=O)c2nn(C)c3c2C[C@H]([NH2+]CC2([NH+]4CCCCC4)CCCCC2)CC3)o1,C32578217_decoy,TRY1,Decoy,0,-8.80804,-5.48,-3.53,-5.543885002395903
COc1ccc(C[NH2+]CCC2=C(C)N=N[C@@H]2C)cc1OC[C@@H](O)C[NH+]1CCCCC1,C39420813_decoy,TRY1,Decoy,0,-7.99421,-6.87,-2.0,-6.553766230831815
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c1F,C39594693_decoy,TRY1,Decoy,0,-10.2178,-6.06,-1.59,-7.00510936615682
COc1c(C(=O)N2C[C@H](C(=O)NC[C@@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39594977_decoy,TRY1,Decoy,0,-9.12792,-5.94,-2.06,-6.5918537493546365
O=C(NCC[NH+]1CCCCC1)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39628160_decoy,TRY1,Decoy,0,-8.66557,-7.17,-0.39,-5.80434752460133
O=C(NCC[NH+]1CCCCC1)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39628185_decoy,TRY1,Decoy,0,-10.0345,-8.59,-1.48,-7.609864114053363
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39630686_decoy,TRY1,Decoy,0,-8.51506,-7.44,-2.28,-6.472655505520736
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2)C(C)C,C39634859_decoy,TRY1,Decoy,0,-8.96644,-5.39,-2.06,-6.269454416924983
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39634896_decoy,TRY1,Decoy,0,-9.14956,-5.15,-2.9,-5.448155578850245
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2)C(C)C,C39634912_decoy,TRY1,Decoy,0,-10.293,-6.26,-0.56,-7.114151731034751
O=C(N[C@H]1C[NH+]2CCC1CC2)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39662989_decoy,TRY1,Decoy,0,-9.23351,-7.31,-1.25,-6.482029779510933
COc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)[NH+]2CCCC2)cc1,C39664167_decoy,TRY1,Decoy,0,-9.33068,-6.67,-2.84,-6.498867426603099
Cc1cccc2[nH+]c(CNC(=O)[C@H]3CN(C(=O)c4ccccc4C(F)(F)F)CC34CC[NH2+]CC4)cn12,C39670661_decoy,TRY1,Decoy,0,-9.17994,-8.46,-4.3,-6.845466755639463
CCC(CC)C(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674716_decoy,TRY1,Decoy,0,-8.94156,-5.3,-3.74,-5.942508791677502
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39678990_decoy,TRY1,Decoy,0,-8.1531,-5.14,-0.76,-4.975107147118777
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39678992_decoy,TRY1,Decoy,0,-8.79464,-6.2,-2.73,-6.104857226647599
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39679041_decoy,TRY1,Decoy,0,-8.52416,-5.51,-4.45,-5.815754300227937
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)C3CCN(C(C)=O)CC3)CC23CC[NH2+]CC3)CC1,C39683512_decoy,TRY1,Decoy,0,-10.1105,-6.35,-3.54,-6.530193570229631
Cn1cc[nH+]c1CNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39689025_decoy,TRY1,Decoy,0,-10.2202,-7.2,-1.82,-6.521319543645324
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OCc1ccc(F)cc1Cl,C40720463_decoy,TRY1,Decoy,0,-7.96033,-4.67,-2.72,-5.030206586234285
CN(C)c1ccc(NC(=S)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3C[NH+]2CCCCC2)cc1,C43527079_decoy,TRY1,Decoy,0,-9.00396,-7.25,-3.83,-6.552625065086937
Clc1ccc(N2[C@@H](c3ccccc3)NN[C@H]2SCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63162931_decoy,TRY1,Decoy,0,-8.73474,-6.47,-2.73,-5.824007938289384
COc1ccc(N2[C@H](COc3ccc(C)cc3)NN[C@H]2SCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63165353_decoy,TRY1,Decoy,0,-8.79912,-8.86,-1.47,-7.581010250232333
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)c1ccc(N/N=C/C2=c3ccccc3=[NH+]C2)cc1,C39949142_decoy,TRY1,Decoy,0,-8.63177,-8.58,-2.7,-6.085855962027164
CC(C)[C@@H](NC(=O)[C@H](C)S[C@@H]1NN=NN1c1ccccc1)C1[NH+]=c2ccccc2=[NH+]1,C63478605_decoy,TRY1,Decoy,0,-8.54045,-6.96,-3.1,-8.366839924533927
CC1=C(/C=N/NC(=O)[C@]2(C)CC[C@H](C3[NH+]=c4ccccc4=[NH+]3)C2(C)C)[C@H](C)N(c2ccccc2)N1,C63541048_decoy,TRY1,Decoy,0,-8.67841,-6.25,-1.5,-5.705162053505852
C[C@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)N/N=C/c1cc(Cl)cc(Br)c1O,C63562677_decoy,TRY1,Decoy,0,-8.98003,-7.93,-0.89,-7.587600505335417
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](SCC(=O)Nc4cc(Cl)ccc4C)N3N2)[C@@H](C)N=N1,C63708290_decoy,TRY1,Decoy,0,-9.32261,-9.57,-1.57,-8.508772255147887
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@H]1NC(c2ccc(N3CCCCCC3)cc2)=NO1,C63747029_decoy,TRY1,Decoy,0,-8.12441,-6.4,-1.74,-5.46076440914363
O=C(Nc1cccc(F)c1)Nc1nnc(SC[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)s1,C63752133_decoy,TRY1,Decoy,0,-10.2058,-7.49,-2.91,-6.3923238567362
CCOc1ccc(N2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@@H]2c2ccccc2Cl)cc1,C63838930_decoy,TRY1,Decoy,0,-8.50076,-4.55,-1.38,-4.469768937636894
Cc1ccc2cc(CN(CC[NH+](C)C)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2c1C,C04133498_decoy,TRY1,Decoy,0,-8.56788,-5.72,-2.3,-5.646551362484857
O=[N+]([O-])c1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CC[NH+](CCc2ccccc2)CC1,C05032046_decoy,TRY1,Decoy,0,-7.56365,-6.78,-2.19,-5.778258653625066
O[C@H](COc1ccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)cc1)C[NH+]1CCc2ccccc2C1,C08833893_decoy,TRY1,Decoy,0,-9.55413,-7.65,-2.13,-7.220172653048807
O[C@@H](COc1cccc(C[NH2+]CCCn2cccn2)c1)C[NH+]1CCc2ccccc2C1,C11817784_decoy,TRY1,Decoy,0,-7.84943,-7.05,-3.29,-5.642446548387114
O[C@H](C[NH+]1CCC(CCCC2CC[NH+](C[C@@H](O)c3ccccc3)CC2)CC1)c1ccccc1,C13132764_decoy,TRY1,Decoy,0,-8.7339,-8.62,-1.87,-7.027054578825669
COc1ccc(C[NH2+]CCn2ccnc2)c(OC[C@H](O)C[NH+]2CCCCCCC2)c1,C12307340_decoy,TRY1,Decoy,0,-8.49855,-6.74,-2.52,-9.022207760381317
O[C@@H](COc1cccc(C[NH2+]CCc2cccnc2)c1)C[NH+]1CCc2ccccc2C1,C12308018_decoy,TRY1,Decoy,0,-8.18817,-7.13,-4.74,-6.028877514542044
CCc1cc(C[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCc3ccccc3C2)on1,C14970258_decoy,TRY1,Decoy,0,-7.90337,-7.47,-2.79,-7.198934037359228
Cc1cc(N2CCCC2)[nH+]c2ccc(NC(=S)NCC[NH+]3CCc4ccccc4C3)cc12,C20183159_decoy,TRY1,Decoy,0,-7.63013,-6.67,-2.65,-5.581728044946936
COc1ccc(C[NH2+]Cc2ccc(C)s2)c(OC[C@H](O)CN2CC[NH+](C)CC2)c1,C20878098_decoy,TRY1,Decoy,0,-8.48236,-7.03,-4.16,-6.8764073472531
O=c1cc(C[NH+]2CCN(Cc3ccc(Cl)cc3)CC2)nc(N2CCC[NH2+]CC2)[nH]1,C35564687_decoy,TRY1,Decoy,0,-8.03661,-5.49,-2.46,-5.29161707094748
Cc1ccc([C@@H]2[NH+]=NC(O)=C2C(C2=C(O)N=[NH+][C@@H]2c2ccc(C)cc2)c2ccc(Cl)cc2)cc1,C39357313_decoy,TRY1,Decoy,0,-7.4544,-6.82,-2.36,-6.333259806807332
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39594751_decoy,TRY1,Decoy,0,-9.57795,-8.21,-2.27,-8.146612451339156
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39594758_decoy,TRY1,Decoy,0,-8.78365,-6.43,-2.21,-6.617347187867457
COc1c(C(=O)N2C[C@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39594983_decoy,TRY1,Decoy,0,-10.1445,-5.95,-2.82,-6.229504691244884
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39626949_decoy,TRY1,Decoy,0,-8.32753,-7.21,-1.78,-6.056829543622048
C[NH+](C)CCCNC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39627339_decoy,TRY1,Decoy,0,-9.51414,-7.41,-3.01,-6.93768456215473
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39627398_decoy,TRY1,Decoy,0,-7.87527,-5.06,-4.23,-5.96468240461968
C[NH+](C)CCCNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39627441_decoy,TRY1,Decoy,0,-7.73157,-5.1,-1.87,-5.690441826794885
Cc1ccc(C(=O)N2C[C@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)c(C)c1,C39628174_decoy,TRY1,Decoy,0,-8.74169,-7.35,-2.5,-7.891835706614018
O=C(NCC[NH+]1CCCCC1)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39628261_decoy,TRY1,Decoy,0,-9.92217,-7.72,-2.88,-7.317089048475506
C[NH+](C)CC(C)(C)CNC(=O)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2,C39630552_decoy,TRY1,Decoy,0,-9.19121,-5.29,-2.9,-6.537280398324521
COc1ccc([C@@H](CNC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)[NH+]2CCCC2)cc1,C39664169_decoy,TRY1,Decoy,0,-10.5731,-6.64,-1.21,-6.784985734053259
Cc1ccc2[nH+]c(CNC(=O)[C@@H]3CN(C(=O)c4ccc(-c5ccc(F)cc5)o4)CC34CC[NH2+]CC4)cn2c1,C39670580_decoy,TRY1,Decoy,0,-9.69772,-6.73,-2.25,-6.165514483682236
Cc1cc(C(=O)N2C[C@H](C(=O)NCc3cn4c(C)cccc4[nH+]3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39670797_decoy,TRY1,Decoy,0,-8.47802,-8.8,-2.79,-6.857769162910709
Cc1ccccc1C(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674607_decoy,TRY1,Decoy,0,-7.87939,-7.78,-3.0,-6.470315523701366
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674791_decoy,TRY1,Decoy,0,-8.1677,-7.84,-2.63,-6.719412607288798
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674832_decoy,TRY1,Decoy,0,-9.71549,-6.83,-2.94,-8.142324172402988
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39679021_decoy,TRY1,Decoy,0,-8.0635,-7.19,-2.91,-6.501337031923706
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)NCCN3CCC[NH+](C)CC3)C3(CC[NH2+]CC3)C2)c1F,C39685589_decoy,TRY1,Decoy,0,-8.47056,-7.48,-1.39,-5.922614892363157
COc1c(C(=O)N2C[C@H](C(=O)NC3CCN(c4cccc[nH+]4)CC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39687468_decoy,TRY1,Decoy,0,-9.61044,-6.95,-1.83,-5.910453973015563
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39695550_decoy,TRY1,Decoy,0,-9.42366,-6.37,-0.83,-7.048385954951178
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)NC[C@H]2CCC[NH+]2CC)C2(CC[NH2+]CC2)C1,C39695608_decoy,TRY1,Decoy,0,-9.28781,-5.09,-2.76,-5.686509993824208
Cn1c(=O)n(C)c2cc([C@@H](O)COc3ccc(C[NH2+]CCCn4cc[nH+]c4)cc3)ccc21,C40719392_decoy,TRY1,Decoy,0,-7.78775,-7.02,-3.1,-5.329563137579178
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OCc1ccc(Cl)c(Cl)c1,C40720479_decoy,TRY1,Decoy,0,-9.08033,-4.81,-4.04,-6.399922737547005
C=CC[NH+](C)C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=S)Nc1cc(OC)cc(OC)c1,C43526568_decoy,TRY1,Decoy,0,-8.38471,-6.73,-4.43,-7.039706907576526
O=c1cccc2n1C[C@H]1C[C@@H]2C[NH+](C[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=S)NCc2ccco2)C1,C43527194_decoy,TRY1,Decoy,0,-8.30329,-7.87,-3.99,-6.746246588393065
COC[C@H]1CCC[NH+]1C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=S)Nc1ccc(N(C)C)cc1,C43527638_decoy,TRY1,Decoy,0,-9.10748,-6.38,-2.51,-6.172519838706893
CCOc1ccc2c(c1)=[NH+][C@@H](SCC(=O)N[C@@H]1Nc3ccc(OC)cc3S1)[NH+]=2,C63113100_decoy,TRY1,Decoy,0,-8.0043,-7.61,-1.79,-13.838424023585436
Clc1ccc([C@@H]2NN[C@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2Cc2ccco2)cc1,C63162965_decoy,TRY1,Decoy,0,-9.01049,-7.39,-0.44,-7.661406063953541
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@H]1CC2=[NH+][C@@H](c3ccc4c(c3)OCO4)C[C@H](C(F)(F)F)N2N1,C63537948_decoy,TRY1,Decoy,0,-8.11231,-7.14,-3.43,-5.851303207519553
CCc1ccc(NC(=O)[C@@H](CC)S[C@@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=C(C)N=N[C@@H]4C)NN32)cc1,C63708239_decoy,TRY1,Decoy,0,-10.4148,-8.42,-0.98,-8.795400407402509
COc1ccc(N(CCC(N)=O)C(=O)CS[C@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)cc1,C63731473_decoy,TRY1,Decoy,0,-8.72509,-7.8,-1.8,-8.66612148128053
COc1ccc2c(c1)=[NH+][C@@H](S[C@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F)[NH+]=2,C63742873_decoy,TRY1,Decoy,0,-8.49183,-7.9,-1.86,-7.18713433654323
O=C(Nc1ccc(F)c(Cl)c1)Nc1nnc(SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)s1,C63752113_decoy,TRY1,Decoy,0,-10.828,-7.74,-2.64,-6.700080613090962
CC1=C(C[NH2+]C[C@H](C2=c3ccccc3=[NH+]C2)c2cccs2)[C@@H](C)N([C@@H]2CCS(=O)(=O)C2)N1,C63820459_decoy,TRY1,Decoy,0,-8.7038,-6.45,-1.73,-5.793674927385895
CC(C)CCN1C(=O)N(CC(N)=O)C(=O)C12CC[NH+](C[C@@H]1C=c3ccccc3=[NH+]1)CC2,C63994387_decoy,TRY1,Decoy,0,-7.04096,-5.5,-1.91,-4.784917072977995
O[C@@H](C[NH2+]C[C@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl)COC[C@@H]1CCCO1,C64338198_decoy,TRY1,Decoy,0,-8.24124,-7.51,-2.1,-8.448554590744045
CN1C(=O)[C@H]([NH+]2CCC(C(=O)NCCC3=c4ccccc4=[NH+]C3)CC2)Nc2cccnc21,C64502358_decoy,TRY1,Decoy,0,-8.36645,-8.69,-1.02,-6.3396618466908246
CCC1=NN[C@@H](c2ccc3ccn(CC(=O)NC[C@H]4[NH+]=c5ccc(C)cc5=[NH+]4)c3c2)O1,C64656105_decoy,TRY1,Decoy,0,-9.23175,-9.68,-1.54,-10.146310512580332
Cc1cc(C)c2[nH]c(=O)c(CN(CC[NH+](C)C)C(=S)NCCC[NH+](C)C)cc2c1,C04133507_decoy,TRY1,Decoy,0,-9.63712,-4.97,-2.81,-5.758115734127767
CN(C)c1ccc2c(NCCCCCCNc3cc[nH+]c4cc(N(C)C)ccc34)cc[nH+]c2c1,C01570581_decoy,TRY1,Decoy,0,-9.93599,-7.27,-3.03,-7.127868831405762
COc1ccc([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)cc1C[NH+]1CCN(c2ccccc2F)CC1,C06157320_decoy,TRY1,Decoy,0,-8.27091,-7.62,-1.72,-5.562152047950022
COc1cc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cc(Br)c1O,C09833619_decoy,TRY1,Decoy,0,-8.67652,-5.92,-4.08,-5.877893163360039
COc1ccc(C[NH+](C)Cc2ccn[nH]2)c(OC[C@H](O)C[NH+]2CCCCCCC2)c1,C11935729_decoy,TRY1,Decoy,0,-8.79251,-6.8,-3.38,-6.90523779281671
Cc1ccc(C[NH2+]Cc2ccc(OC[C@H](O)C[NH+](C)Cc3ccccc3)cc2)cc1F,C12585849_decoy,TRY1,Decoy,0,-8.0609,-7.02,-2.32,-5.680364925344681
Cc1ccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NCC2([NH+]3CCCCC3)CCCC2)cc1,C12836805_decoy,TRY1,Decoy,0,-8.20412,-6.93,-1.89,-5.956093076406791
O[C@H](COc1ccc(-c2ccc(OC[C@@H](O)C[NH+]3CCCC3)cc2)cc1)C[NH+]1CCCC1,C13425554_decoy,TRY1,Decoy,0,-8.04655,-7.51,-2.92,-5.981553120169528
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2cc3c(cc2OC)OCO3)C[C@@]1(C)CO,C19836130_decoy,TRY1,Decoy,0,-8.42408,-5.49,-3.39,-5.455999791188332
O[C@H](C[NH+]1CCC(CCCC2CC[NH+](C[C@H](O)c3ccccc3)CC2)CC1)c1ccccc1,C13132766_decoy,TRY1,Decoy,0,-8.10589,-6.82,-3.59,-6.348814794009781
COCCN[C@H]1[NH+]=CNc2c1sc1[nH+]c(N3CCOCC3)c3c(c21)CC(C)(C)OC3,C27345007_decoy,TRY1,Decoy,0,-9.10377,-5.8,-1.82,-5.245639683391258
COC(=O)C1CC[NH+](C[C@H](O)COc2ccc(C[NH2+]C[C@H]3N=NC4=C3CCC4)cc2)CC1,C39455062_decoy,TRY1,Decoy,0,-8.83323,-6.14,-3.06,-5.755657881652758
CC[NH+]1CCN(C[C@H](O)COc2cccc(C[NH2+]CCC3=C(C)N=N[C@H]3C)c2)CC1,C39466228_decoy,TRY1,Decoy,0,-8.65486,-6.18,-2.17,-5.4638416149249815
O=C(NC[C@@H](c1cccnc1)[NH+]1CCCC1)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39594225_decoy,TRY1,Decoy,0,-9.34907,-7.69,-4.14,-6.673435950140253
COc1c(C(=O)N2C[C@@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39594986_decoy,TRY1,Decoy,0,-8.99883,-7.48,-2.43,-6.860037573926041
Cc1ccc(F)cc1C(=O)N1C[C@H](C(=O)NCC[NH+]2CCCCC2)C2(CC[NH2+]CC2)C1,C39628071_decoy,TRY1,Decoy,0,-8.31207,-7.18,-1.89,-6.434296970934795
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39631107_decoy,TRY1,Decoy,0,-9.61142,-7.34,-2.99,-6.805337946500258
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2)C(C)C,C39634844_decoy,TRY1,Decoy,0,-9.42431,-5.15,-1.84,-6.442115255885763
Cc1cc(C(=O)N2C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39634851_decoy,TRY1,Decoy,0,-8.87005,-5.2,-2.06,-5.910343337284964
COc1ccc([C@H](CNC(=O)[C@@H]2CN(C(=O)C3CCOCC3)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663963_decoy,TRY1,Decoy,0,-9.93208,-5.74,-2.07,-6.808701946612104
Cc1ccc2[nH+]c(CNC(=O)[C@@H]3CN(C(=O)c4cc(C)oc4C(F)(F)F)CC34CC[NH2+]CC4)cn2c1,C39670564_decoy,TRY1,Decoy,0,-9.05541,-9.22,-3.05,-10.753262354188536
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)c2cccnc2Cl)CC12CC[NH2+]CC2,C39674685_decoy,TRY1,Decoy,0,-8.25396,-8.31,-5.01,-6.97912646945983
Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@H]3C)C3(CC[NH2+]CC3)C2)c1F,C39674739_decoy,TRY1,Decoy,0,-8.17799,-7.79,-2.97,-7.18193285761858
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)c2cccc(N(C)C)c2)CC12CC[NH2+]CC2,C39674763_decoy,TRY1,Decoy,0,-10.0445,-1.64,-3.43,-1.7774613534822112
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674853_decoy,TRY1,Decoy,0,-8.93355,-8.11,-2.77,-6.716344000545272
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39674873_decoy,TRY1,Decoy,0,-8.76574,-7.8,-2.81,-6.30507097752864
C[NH+](C)CCCCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39679077_decoy,TRY1,Decoy,0,-10.9021,-6.39,-3.81,-7.2102078394889215
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)C3CCOCC3)CC23CC[NH2+]CC3)CC1,C39683614_decoy,TRY1,Decoy,0,-9.98094,-5.73,-2.63,-6.274657465352968
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCN2CCC[NH+](C)CC2)C2(CC[NH2+]CC2)C1,C39685523_decoy,TRY1,Decoy,0,-8.07124,-5.42,-1.48,-5.929663013727107
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)c2c(-c3c(F)cccc3Cl)noc2C)CC12CC[NH2+]CC2,C39695533_decoy,TRY1,Decoy,0,-10.0221,-5.91,-2.59,-6.775130204427967
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)c2cc(F)ccc2C)CC12CC[NH2+]CC2,C39695583_decoy,TRY1,Decoy,0,-8.04763,-6.31,-1.91,-6.309634577124834
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CN(C(=O)c2csc(Cl)c2OC)CC12CC[NH2+]CC2,C39695600_decoy,TRY1,Decoy,0,-8.32798,-6.3,-0.37,-5.876108661488415
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CN(C(=O)c2ccc(C)cc2C)CC12CC[NH2+]CC2,C39695632_decoy,TRY1,Decoy,0,-8.33951,-5.38,-2.51,-5.264042024951579
Cc1nc(-c2ccccc2)cc([C@H]2C[NH+]3CC[C@H]2C[C@@H]3C[NH2+]Cc2ccc(CO)o2)n1,C39960782_decoy,TRY1,Decoy,0,-8.84785,-8.78,-2.0,-6.9091549367950345
OCCCNc1nc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)[nH+]c2ccccc12,C41150381_decoy,TRY1,Decoy,0,-8.55378,-6.27,-0.86,-7.176226847473348
COc1ccccc1N1CC[NH+](C[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=S)Nc2ccc(N(C)C)cc2)CC1,C43527376_decoy,TRY1,Decoy,0,-8.74079,-6.83,-2.8,-6.0799494544758215
COCCNC(=S)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ncccn2)CC1,C43527499_decoy,TRY1,Decoy,0,-8.77365,-5.0,-3.21,-5.617334304675377
CC[NH+]1CCC[C@@H](NCc2c3ccccc3c(CN[C@@H]3CCC[NH+](CC)C3)c3ccccc23)C1,C22863812_decoy,TRY1,Decoy,0,-8.52385,-6.02,-2.2,-6.88415795830786
[NH3+][C@H](COc1cncc(/C=C/c2ccnc(Oc3ccccc3)c2)c1)CC1=c2ccccc2=[NH+]C1,C52627521_decoy,TRY1,Decoy,0,-8.68217,-7.01,-3.23,-6.412213788649772
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)cc1,C63108161_decoy,TRY1,Decoy,0,-8.01132,-5.59,-4.42,-5.157753555635579
CCOc1ccc(OC[C@@H](O)C[NH2+]C[C@H](C2=c3ccccc3=[NH+]C2)c2ccccc2Cl)cc1,C63230306_decoy,TRY1,Decoy,0,-9.21569,-7.86,-1.36,-8.099362515486508
COc1cccc([C@H](C[NH2+]C[C@@H](O)COc2ccccc2F)C2=c3ccccc3=[NH+]C2)c1OC,C63234360_decoy,TRY1,Decoy,0,-8.81347,-6.14,-1.72,-6.596164271620975
O=C(CCNC(=O)C[C@@H]1[NH+]=NC(=O)c2ccccc21)NCCC1=c2ccccc2=[NH+]C1,C63281781_decoy,TRY1,Decoy,0,-6.76173,-8.57,-2.01,-6.739583193063262
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@H]1CC2=[NH+][C@@H](c3ccc4c(c3)OCO4)C[C@@H](C(F)(F)F)N2N1,C63537953_decoy,TRY1,Decoy,0,-9.12871,-5.95,-2.21,-6.070085874750136
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1C[C@@H](C2CC2)N([C@@H]2CCS(=O)(=O)C2)N1,C63694311_decoy,TRY1,Decoy,0,-8.1042,-6.15,-1.68,-6.257789843084637
CCc1ccc(NC(=O)[C@@H](CC)S[C@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=C(C)N=N[C@@H]4C)NN32)cc1,C63708243_decoy,TRY1,Decoy,0,-10.3749,-8.47,-3.67,-8.780347260769458
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](SCC(=O)Nc4c(C)cccc4C)N3N2)[C@@H](C)N=N1,C63708300_decoy,TRY1,Decoy,0,-8.89795,-8.79,-1.52,-8.17177645563469
O=C(Nc1ccc(F)cc1)Nc1nnc(SC[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)s1,C63743178_decoy,TRY1,Decoy,0,-10.4692,-6.8,-1.6,-6.820904371843102
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)[C@H]1NC(c3ccc(N4CCCCC4)cc3)=NO1)[NH+]=2,C64519963_decoy,TRY1,Decoy,0,-8.97576,-7.35,-0.78,-5.975539543640416
CCC[C@@H](NC(=O)Cc1ccc(OCC)c(OCC)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65306068_decoy,TRY1,Decoy,0,-8.32176,-6.95,-3.09,-7.011843211928546
CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@H](O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12,C01591939_decoy,TRY1,Decoy,0,-7.48701,-6.81,-1.4,-8.336731444293289
CC1(C)CC(OC(=O)CCCCC(=O)OC2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C04644787_decoy,TRY1,Decoy,0,-7.98589,-6.02,-2.4,-6.115574785842263
O=C(C[NH+]1CCN(c2cccc[nH+]2)CC1)Nc1ccccc1C(=O)NCc1ccco1,C07522828_decoy,TRY1,Decoy,0,-6.90036,-7.23,-1.18,-5.788949511582285
COCCNC(=S)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ncccn2)CC1,C08635690_decoy,TRY1,Decoy,0,-8.34028,-6.0,-2.71,-5.742232222517667
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H]([NH2+]C3CC3)C[C@@H](c3ccc(C(C)C)cc3)[NH+]21,C08636058_decoy,TRY1,Decoy,0,-7.96023,-4.88,-1.18,-5.535715519083943
COc1ccc([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)cc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C09730587_decoy,TRY1,Decoy,0,-8.03735,-7.6,-1.73,-6.275189954933163
CSc1ccc2cc(C[NH2+]Cc3ccccc3F)c(N3CCC[C@@H](CO)C3)[nH+]c2c1,C11995627_decoy,TRY1,Decoy,0,-9.4382,-6.48,-3.38,-6.994950284498202
CSc1cccc(C[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCSCC2)c1,C12075923_decoy,TRY1,Decoy,0,-8.99462,-5.95,-3.71,-6.901249638416725
Cc1nn2cc(C[NH2+]Cc3ccccc3OC[C@H](O)C[NH+]3CCSCC3)nc2s1,C15069588_decoy,TRY1,Decoy,0,-8.14985,-6.36,-1.64,-6.794981950513771
O[C@H](COc1cccc(C[NH2+]CCOc2ccccc2)c1)C[NH+]1CCc2ccccc2C1,C15074057_decoy,TRY1,Decoy,0,-8.41547,-6.18,-2.78,-5.274676006433484
COc1ccc(C[NH2+]C2(c3ccccc3)CC2)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C19224046_decoy,TRY1,Decoy,0,-8.64643,-6.51,-2.98,-8.026778502895397
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH2+]CCN3CCCCC3=O)c2)CC1,C19744806_decoy,TRY1,Decoy,0,-8.73855,-6.19,-2.99,-6.079885789915657
CCc1ccc2c(c1)/C(=N/NC1[NH+]=c3ccccc3=[NH+]1)C[C@@H](c1ccc(O)c(OC)c1)O2,C38779419_decoy,TRY1,Decoy,0,-8.67413,-8.19,-1.16,-8.048191994466103
CC(=O)Nc1ccc(N[C@H]2[NH+]=c3ccccc3=[NH+]/C2=N\S(=O)(=O)c2ccc(C)c(C)c2)cc1,C38980434_decoy,TRY1,Decoy,0,-7.25109,-5.86,-3.22,-5.118193119221886
COc1ccc(C[NH2+]CCC2=C(C)N=N[C@@H]2C)cc1OC[C@H](O)C[NH+]1CCCCC1,C39420811_decoy,TRY1,Decoy,0,-8.19687,-6.98,-2.59,-6.8516455478118745
Cc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39594762_decoy,TRY1,Decoy,0,-8.79753,-8.29,-2.47,-6.646216157552559
O=C(NC[C@H](c1cccnc1)[NH+]1CCCC1)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39595328_decoy,TRY1,Decoy,0,-9.77042,-7.94,-2.19,-7.503617907085076
C[NH+](C)CCNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39626005_decoy,TRY1,Decoy,0,-8.7187,-6.09,-1.2,-5.821233641952684
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2cc(C)nn2C(C)(C)C)CC12CC[NH2+]CC2,C39626991_decoy,TRY1,Decoy,0,-7.86431,-6.14,-2.6,-5.639045613801196
Cc1ccc(C(=O)N2C[C@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39628012_decoy,TRY1,Decoy,0,-8.6704,-5.67,-2.42,-5.697595535807347
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630585_decoy,TRY1,Decoy,0,-8.11202,-6.86,-2.0,-6.616947637531728
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2)C(C)C,C39634734_decoy,TRY1,Decoy,0,-9.54968,-6.32,-4.88,-6.308878791523654
COc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)C3CCOCC3)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663965_decoy,TRY1,Decoy,0,-8.92528,-7.37,-2.6,-7.881186102469654
Cc1cccc2[nH+]c(CNC(=O)[C@H]3CN(C(=O)c4cc(F)cc(C(F)(F)F)c4)CC34CC[NH2+]CC4)cn12,C39670695_decoy,TRY1,Decoy,0,-8.60247,-8.27,-1.31,-5.85408849516094
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39674639_decoy,TRY1,Decoy,0,-8.7741,-7.01,-2.29,-6.321674206543188
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39674700_decoy,TRY1,Decoy,0,-8.52778,-6.36,-2.13,-6.069446325874299
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674855_decoy,TRY1,Decoy,0,-8.85652,-6.66,-1.47,-7.042360171986435
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39674875_decoy,TRY1,Decoy,0,-8.63474,-7.08,-2.59,-6.982756786436179
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39678868_decoy,TRY1,Decoy,0,-8.99164,-5.76,-1.66,-5.9955023694944005
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39678940_decoy,TRY1,Decoy,0,-10.2199,-6.57,-4.36,-7.415336387958631
Cc1cc(C(=O)N2C[C@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39679040_decoy,TRY1,Decoy,0,-8.28722,-4.76,-3.33,-5.137249314673942
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCN2CCC[NH+](C)CC2)C2(CC[NH2+]CC2)C1,C39685525_decoy,TRY1,Decoy,0,-9.84961,-6.98,-1.53,-7.099247352955662
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCN2CCC[NH+](C)CC2)C2(CC[NH2+]CC2)C1,C39685635_decoy,TRY1,Decoy,0,-9.53974,-7.02,-3.27,-6.793945257282757
Cc1cc(C(=O)N2C[C@H](C(=O)NC3CCN(c4[nH+]cccc4C)CC3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39687689_decoy,TRY1,Decoy,0,-10.0518,-6.27,-2.07,-6.533540439800089
Cn1cc[nH+]c1CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39689022_decoy,TRY1,Decoy,0,-10.1421,-7.43,-2.01,-7.037224705606959
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CN(C(=O)c2sccc2C)CC12CC[NH2+]CC2,C39695660_decoy,TRY1,Decoy,0,-8.86426,-5.64,-1.86,-6.265411243758891
COc1cc(C[NH2+]CC2CC[NH2+]CC2)cc(Br)c1OCc1ccc(F)cc1Cl,C40720010_decoy,TRY1,Decoy,0,-9.48953,-6.74,-3.62,-6.137800299466977
CSc1cccc(NC(=O)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3CN(C)CC[NH+](C)C)c1,C43526900_decoy,TRY1,Decoy,0,-10.4466,-5.92,-2.1,-6.66854785103415
CC(C)NC(=O)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,C43527187_decoy,TRY1,Decoy,0,-7.83511,-7.61,-3.48,-5.67280692168336
CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2C[NH2+]CC[NH+](C)C)cc1,C35591419_decoy,TRY1,Decoy,0,-8.47544,-7.44,-1.46,-8.425666450802131
C[C@@H]1[C@H](c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)C=C(C#N)C(=O)N1C,C52627751_decoy,TRY1,Decoy,0,-9.66404,-6.37,-3.11,-5.574279150774382
O=C(NC[C@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@H]1C=C2[NH+]=C(c3ccc4c(c3)OCO4)C=C(C(F)(F)F)N2N1,C63111103_decoy,TRY1,Decoy,0,-9.07276,-8.27,-1.66,-6.301375433743094
Clc1ccc(N2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@@H]2c2ccccc2)cc1,C63162928_decoy,TRY1,Decoy,0,-9.10764,-6.59,-2.69,-5.955496146412663
Cc1cc(C)c2nc(Nc3nc(CSC4[NH+]=c5ccccc5=[NH+]4)cc(=O)[nH]3)nc(C)c2c1,C63205573_decoy,TRY1,Decoy,0,-8.7207,-7.2,-1.55,-6.453173926690388
COc1ccc2c(c1OC)=C[C@H](C(=O)NCC(=O)NCCC1=c3ccccc3=[NH+]C1)[NH+]=2,C63271183_decoy,TRY1,Decoy,0,-8.06301,-7.21,-2.99,-6.690676854515677
CC(C)[C@@H](NC(=O)[C@@H](C)S[C@@H]1NN=NN1c1ccccc1)C1[NH+]=c2ccccc2=[NH+]1,C63478603_decoy,TRY1,Decoy,0,-7.98781,-7.85,-2.26,-6.7295038525665865
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1C=C2[NH+]=C(c3ccc4ccccc4c3)C=C(C(F)(F)F)N2N1,C63541090_decoy,TRY1,Decoy,0,-7.52881,-10.55,-3.56,-6.57631712971548
Cn1nc(C(=O)NCc2ccccc2F)c2c1CC[C@@H]([NH2+]C[C@@H]1C=c3ccccc3=[NH+]1)C2,C63980625_decoy,TRY1,Decoy,0,-7.40183,-8.38,-2.63,-6.713966236921332
C[NH+](CC(=O)NC[C@H]1CC=CO1)CC(=O)Nc1nc(C2=c3ccccc3=[NH+]C2)cs1,C64175202_decoy,TRY1,Decoy,0,-9.48487,-6.44,-1.36,-6.44324943546957
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2ccc(Cl)cc2Cl)O1,C64428644_decoy,TRY1,Decoy,0,-9.26908,-8.47,-2.32,-7.951266950367735
CCc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)n2)cc1,C01406356_decoy,TRY1,Decoy,0,-9.75897,-6.56,-2.11,-5.71400172393751
C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](C[NH2+]CCc4c[nH]c5ccc(O)cc45)[C@H]3C[C@@H]12,C04045419_decoy,TRY1,Decoy,0,-7.76445,-8.3,-1.47,-7.397417558449455
CNC(=S)NNC(=O)[C@H]1C2CC[NH+](CC2)[C@H]1SCc1ccc(Cl)cc1,C02142737_decoy,TRY1,Decoy,0,-9.42482,-6.97,-0.4,-6.48647032020103
Nc1nc(C[NH+]2CCN(c3ccccc3F)CC2)nc(Nc2ccc(F)cc2)n1,C04740295_decoy,TRY1,Decoy,0,-7.54412,-6.68,-0.94,-5.392914607511697
CCOc1cccc([C@@H](Nc2cccc[nH+]2)c2ccc3ccc(C)nc3c2O)c1O,C05102114_decoy,TRY1,Decoy,0,-8.6372,-8.1,-1.09,-7.495191616300766
NC(=O)c1ccsc1NC(=O)C[NH+]1CCc2sccc2[C@@H]1c1ccccc1,C08325353_decoy,TRY1,Decoy,0,-9.64818,-4.99,-1.1,-5.45765927234262
Cc1cccc(NC(=O)CNC(=O)C[NH+](C)CC(=O)Nc2cccc(F)c2)c1C,C08119437_decoy,TRY1,Decoy,0,-8.12198,-7.74,-2.93,-6.086543416460738
C[C@@H]([NH2+]CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccc(Cl)c(Cl)c1,C09125906_decoy,TRY1,Decoy,0,-9.00629,-9.2,-1.21,-8.580966112835222
CC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1ccc(Cl)s1,C09516729_decoy,TRY1,Decoy,0,-9.19673,-6.47,-2.22,-6.141965514767869
C[C@H](C(=O)Nc1ccccc1-c1ccccc1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C10224923_decoy,TRY1,Decoy,0,-8.15383,-6.81,-2.37,-6.2331220804452725
Cc1sc2nc(C[NH+](C)CC(=O)Nc3c(Cl)cccc3Cl)nc(N)c2c1C,C12511331_decoy,TRY1,Decoy,0,-8.25253,-7.07,-4.11,-6.574148743977329
CNC(=O)c1nn(CC2CCCCC2)c2c1C[C@@H]([NH2+]CC1(O)CCCCC1)CC2,C14536792_decoy,TRY1,Decoy,0,-9.04145,-7.15,-2.92,-6.683180840259507
C[C@@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+]1CCC(C(=O)Nc2ccccc2)CC1,C15550975_decoy,TRY1,Decoy,0,-7.85435,-7.51,-2.21,-6.031876979026492
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+](C)Cc1cccc(Cl)c1Cl,C22010575_decoy,TRY1,Decoy,0,-6.37397,-6.5,-1.59,-7.677976214411288
Cc1n[nH]c(=O)c2c(NC(=O)C[NH2+]C(c3ccccc3)c3ccccc3)oc(C)c12,C24718050_decoy,TRY1,Decoy,0,-8.0188,-7.14,-2.23,-6.608467616662749
CC[NH+](CC(=O)NC(=O)NCC(C)C)CC(=O)Nc1c(Cl)cccc1Cl,C27563542_decoy,TRY1,Decoy,0,-8.06251,-6.5,-2.61,-6.046921745647508
Cc1ccc([C@@H](C)NC(=O)C[NH+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1C,C32542485_decoy,TRY1,Decoy,0,-8.62937,-7.6,-3.15,-6.541112720761612
C[NH+](C)CCNc1nc(-c2cccs2)c2c(N)n(-c3cccc(F)c3)nc2n1,C37359344_decoy,TRY1,Decoy,0,-6.77602,-5.59,-0.75,-5.015712578330957
CCCCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228170_decoy,TRY1,Decoy,0,-8.45871,-6.21,-1.08,-6.128792113050474
O=C(NNc1cccc(Br)c1)c1ccc(N2CC[NH2+][C@H](c3ccccc3)C2)nc1,C39230130_decoy,TRY1,Decoy,0,-9.17528,-6.97,-2.18,-6.126874107458914
CNC(=S)NNC(=O)[C@H]1C2CC[NH+](CC2)[C@@H]1SCc1ccc(Cl)cc1,C39337085_decoy,TRY1,Decoy,0,-10.1968,-6.09,-1.98,-8.592237956525862
COc1ccc(N2NC=C([C@@H](C)[NH2+]Cc3[nH]c4ccc(OC)cc4c3C)[C@@H]2C)cc1,C39387785_decoy,TRY1,Decoy,0,-6.81528,-5.98,-1.9,-4.693242545028122
CCO[C@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(CC(C)C)cc2)CCN1,C39533537_decoy,TRY1,Decoy,0,-8.6285,-5.72,-3.91,-5.803263707070858
CO[C@@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(-c3ccccc3)cc2)CCN1,C39533668_decoy,TRY1,Decoy,0,-8.2947,-5.65,-0.64,-4.954458898019644
CCC(CC)(CNC(=O)Nc1ccc(F)c(NC(=O)c2ccoc2C)c1)[NH+](C)C,C40105585_decoy,TRY1,Decoy,0,-7.7253,-6.78,-3.59,-5.519763293040164
CCCCc1ccc(Nc2ncnc(N3CCN(c4cccc[nH+]4)CC3)c2N)cc1,C40680252_decoy,TRY1,Decoy,0,-8.69833,-5.61,-1.38,-5.068458009328644
CC[NH+]1CCN(c2ncnc(Nc3cc(C(F)(F)F)ccc3Cl)c2N)CC1,C40682433_decoy,TRY1,Decoy,0,-8.1307,-7.01,-2.34,-5.441967729482772
COc1cc(OC)c(Nc2[nH+]cnc(N3CCc4ccccc43)c2N)cc1Cl,C40687432_decoy,TRY1,Decoy,0,-6.45206,-5.62,-1.52,-4.292497312629175
CC[NH+]1CCN(c2ncnc(Nc3ccc(Cl)c(C(F)(F)F)c3)c2N)CC1,C40726774_decoy,TRY1,Decoy,0,-8.06195,-6.49,-1.97,-5.194768848907152
CCOc1ccc(Nc2[nH+]cnc(N(Cc3ccccc3)c3ccccn3)c2N)cc1,C40782712_decoy,TRY1,Decoy,0,-8.50798,-7.81,-1.87,-7.138082293157038
CC(C)c1ccc2c(c1)CC[C@@H]1[C@@](C)(CNC(=O)c3coc([C@@H]([NH3+])C(C)C)n3)CCC[C@]21C,C43213749_decoy,TRY1,Decoy,0,-9.38731,-7.78,-1.26,-6.570416241762448
C=C1CCC[C@@]2(C)C[C@H]3OC(=O)[C@H](C[NH2+]CCc4c[nH]c5ccc(O)cc45)[C@H]3C[C@H]12,C43741127_decoy,TRY1,Decoy,0,-7.99842,-7.41,-1.86,-5.288674253585044
CCOc1ccc(Nc2c(C)c(NC[C@H]3CCC[NH2+]C3)c(C#N)c3ccnn23)cc1,C45253559_decoy,TRY1,Decoy,0,-8.59443,-5.82,-2.17,-6.035734787102116
CCC(CC)[C@H](CNC(=O)NNC(=O)c1cn(C)c2ccccc12)[NH+]1CCCC1,C45533553_decoy,TRY1,Decoy,0,-8.29529,-6.59,-2.28,-5.90933752497083
C[C@H](NC(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1)c1ccc(Cl)cc1Cl,C26283809_decoy,TRY1,Decoy,0,-9.32348,-8.02,-1.14,-6.966923433778743
CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cc1,C44031631_decoy,TRY1,Decoy,0,-8.29027,-5.54,-3.17,-5.8242847347147215
CC(C)C[C@@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21,C06952418_decoy,TRY1,Decoy,0,-8.65362,-7.73,-1.28,-6.613904512258677
C[C@H](C(=O)Nc1ccc(Cl)cc1)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258626_decoy,TRY1,Decoy,0,-8.13572,-6.78,-2.17,-5.67769321193146
CCC[NH+](CC(=O)Nc1ccccc1C(N)=O)[C@@H](C)c1ccc(Cl)c(Cl)c1,C60090302_decoy,TRY1,Decoy,0,-8.19145,-6.37,-1.89,-6.011186440969575
CCCCCCN1C(=S)NC(=O)[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H]1O,C63376009_decoy,TRY1,Decoy,0,-8.25455,-7.21,-1.07,-7.522081925199766
CCOCCOc1c(Cl)cccc1NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C63397943_decoy,TRY1,Decoy,0,-7.91466,-5.62,-1.82,-6.532199183837482
Cc1ccc(CN2NNc3cc(C(=O)NCCC4=c5ccccc5=[NH+]C4)ccc32)cc1,C64504331_decoy,TRY1,Decoy,0,-9.51765,-8.95,-2.56,-6.798775656327332
c1ccc(CC[C@H]2NN(c3ccccn3)[C@@H](c3ccccc3-c3nc[nH]n3)[NH2+]2)cc1,C65423536_decoy,TRY1,Decoy,0,-7.36329,-7.96,-0.76,-8.206805693982385
c1ccc(CC[C@H]2NN(c3ccccn3)[C@H](c3ccccc3-c3nc[nH]n3)[NH2+]2)cc1,C65423542_decoy,TRY1,Decoy,0,-8.29973,-7.89,-1.61,-7.703468992612676
Cc1cc(OC[C@@H](O)C[NH+]2CCC[C@H](CCC(N)=O)C2)c(C(C)C)cc1Cl,C66156395_decoy,TRY1,Decoy,0,-8.69349,-4.76,-2.82,-6.2330229790495775
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)C1,C66679837_decoy,TRY1,Decoy,0,-8.01591,-5.98,-3.49,-5.596200462651677
C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)C1,C66679839_decoy,TRY1,Decoy,0,-8.19098,-7.07,-3.01,-5.796595579054697
C[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccc(NC(=O)NC2CC2)cc1,C67189109_decoy,TRY1,Decoy,0,-10.2418,-7.05,-3.75,-6.880406302461794
O[C@H](C[NH2+]Cc1c[nH]nc1-c1cccs1)COc1ccc(C(F)(F)F)cc1,C67255076_decoy,TRY1,Decoy,0,-7.7865,-6.97,-1.84,-6.485154958849894
CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1C,C67584543_decoy,TRY1,Decoy,0,-8.47026,-5.32,-2.95,-5.388878722311588
CSc1nc(NCC[NH3+])c2sc3nc(CC(C)C)c4c(c3c2n1)CCC4,C02387020_decoy,TRY1,Decoy,0,-9.93069,-4.5,-0.62,-6.868783875668123
COc1cc(N[C@H](C)CCC[NH3+])c2nc(C)ccc2c1Oc1ccc(F)cc1,C01568080_decoy,TRY1,Decoy,0,-8.52117,-7.16,-1.87,-8.220149676412737
CCOc1cc(C[NH2+]C2CCCCCC2)cc(Br)c1OCC(N)=O,C08253713_decoy,TRY1,Decoy,0,-9.52454,-6.27,-3.0,-11.082053617565364
CCOc1cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)cc(Cl)c1OCC(N)=O,C08253742_decoy,TRY1,Decoy,0,-9.75327,-5.12,-0.99,-6.1834047023809
C[C@H]([NH2+]CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1,C08747713_decoy,TRY1,Decoy,0,-8.85473,-8.9,-3.48,-7.563650655554274
Cc1cccc(-n2ncc3c2CCC[C@@H]3[NH2+]Cc2cn(CC(N)=O)c3ccccc23)c1C,C11938080_decoy,TRY1,Decoy,0,-7.81805,-8.25,-3.05,-7.017718316652755
C[C@@H](NC(=O)C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1)c1ccccc1Cl,C12745347_decoy,TRY1,Decoy,0,-8.32951,-8.16,-2.64,-6.714587437849924
[NH3+][C@@H](CC(=O)N1CCc2[nH]nc(C(F)(F)F)c2C1)Cc1cc(F)ccc1F,C14948929_decoy,TRY1,Decoy,0,-7.22723,-7.48,-2.13,-6.692965182276597
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH+](C)C[C@H](O)CO)CC3)cc2)c(C)c1,C14987393_decoy,TRY1,Decoy,0,-8.18592,-6.13,-1.65,-10.017210612894946
COc1ccccc1/N=c1\nc(N)nc(C[NH+]2CCC(Cc3ccccc3)CC2)[nH]1,C17207386_decoy,TRY1,Decoy,0,-7.54058,-5.95,-3.97,-5.075275292538862
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc(F)c(Cl)c2)cc1,C30499482_decoy,TRY1,Decoy,0,-8.10908,-7.37,-1.95,-6.111297934321866
CC(C)(C)n1nc2nc(NCC[NH+]3CCCCC3)nc(-c3ccccc3)c2c1N,C35929382_decoy,TRY1,Decoy,0,-8.17855,-5.77,-0.88,-5.1137482194043145
Cn1nc2nc(NCC[NH+]3CCCCC3)nc(-c3ccc(Cl)cc3)c2c1N,C37358589_decoy,TRY1,Decoy,0,-9.18348,-5.71,-0.98,-6.01052576332525
Nc1nc(C[NH+]2CCN(c3ccccc3)CC2)nc(Nc2ccc(Cl)cc2)n1,C19891096_decoy,TRY1,Decoy,0,-8.59961,-8.29,-0.75,-6.8895335519775935
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4ccccc4F)CC3)n2)cc1,C01419215_decoy,TRY1,Decoy,0,-7.96696,-6.99,-1.32,-5.91297694374925
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@@H]1N=N[C@H](SCc2cccc(Cl)c2)O1,C38654394_decoy,TRY1,Decoy,0,-9.98771,-7.73,-2.07,-6.908578730884001
O=c1[nH]c(CS[C@@H]2NN[C@@H]([NH+]3CCCC3)N2c2cccc(Cl)c2)nc2ccccc12,C39462577_decoy,TRY1,Decoy,0,-9.02546,-8.11,-1.06,-8.437733473547222
CCONC[C@@H](c1ccc(-c2ccccc2O)cc1)[NH+]1CCN[C@H](SC)C1,C39534025_decoy,TRY1,Decoy,0,-7.97443,-6.18,-1.18,-5.349226227723372
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39673939_decoy,TRY1,Decoy,0,-7.70358,-8.54,-1.75,-7.259104072261179
Cc1cccc(Nc2[nH+]cnc(N(Cc3ccccc3)c3ccccn3)c2N)n1,C40685743_decoy,TRY1,Decoy,0,-8.51309,-6.94,-2.79,-6.96032647951713
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc(F)cc2Cl)cc1,C42183326_decoy,TRY1,Decoy,0,-7.57365,-6.68,-2.4,-6.196039655551108
CNC(=O)Cc1ccccc1NC(=O)NCC1([NH+]2CCSCC2)CCCC1,C44178009_decoy,TRY1,Decoy,0,-8.92302,-7.46,-4.01,-6.238538765837285
NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1,C44658349_decoy,TRY1,Decoy,0,-8.12546,-7.46,-0.53,-9.052444599526744
CC[NH+](CC)C[C@H](C)NS(=O)(=O)c1c(Br)cc(N)cc1Br,C45684259_decoy,TRY1,Decoy,0,-7.39297,-5.43,-1.63,-5.263946201846568
Cc1ccc(C(C)C)c(OC[C@H](O)Cn2c(NCCO)[nH+]c3ccccc32)c1,C46342414_decoy,TRY1,Decoy,0,-7.72431,-7.67,-2.49,-7.543599450623928
COC(=O)Nc1ccc(NC(=O)NCC2([NH+]3CCSCC3)CCCC2)cc1,C47008865_decoy,TRY1,Decoy,0,-9.60736,-6.22,-1.49,-6.298753589996012
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)o1,C48127291_decoy,TRY1,Decoy,0,-8.31687,-4.91,-2.72,-4.92510742823665
C[NH+](C)[C@@H](CNC(=O)NNc1nc(Cl)c(Cl)cc1Cl)c1ccco1,C49779714_decoy,TRY1,Decoy,0,-9.58798,-5.68,-1.92,-5.734985492215075
CC[NH+](CC)[C@@H](CNC(=O)Nc1ccc(F)c(C(=O)NC)c1)c1ccsc1,C50088574_decoy,TRY1,Decoy,0,-8.69162,-5.36,-2.73,-5.650921754956361
Cc1n[nH]c(=O)c2c(NC(=O)C[NH2+][C@H](c3cccs3)C(C)(C)C)oc(C)c12,C52838723_decoy,TRY1,Decoy,0,-7.02981,-5.0,-2.48,-4.7744892847505245
C[C@H](NC(=O)[C@@H](C)[NH+]1CCC(CC(N)=O)CC1)c1ccc(Cl)cc1Cl,C52941236_decoy,TRY1,Decoy,0,-8.33749,-6.68,-1.64,-5.168520029499254
CCCNC(=O)c1ccc(NC(=O)NCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl,C54477069_decoy,TRY1,Decoy,0,-8.84627,-6.94,-2.19,-6.984178513454374
C[C@@H]([NH2+]Cc1cn(CCC(N)=O)c2ccccc12)c1ccccc1-n1cccn1,C55242783_decoy,TRY1,Decoy,0,-7.98583,-7.88,-0.61,-6.39025911953734
Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(OCC(=O)NC2CC2)cc1,C56184408_decoy,TRY1,Decoy,0,-6.80626,-6.32,-2.37,-4.79573045301911
O=C(NCC[NH+]1CCCCC1)NC[C@H](O)COc1ccc(C(F)(F)F)cc1,C57479805_decoy,TRY1,Decoy,0,-7.82608,-5.76,-1.4,-5.239153886737181
NC(=O)c1ccccc1NC(=O)C[NH+]1CCc2sccc2[C@H]1c1ccccc1,C53137449_decoy,TRY1,Decoy,0,-7.44138,-6.85,-2.26,-5.582128448061952
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1,C43136501_decoy,TRY1,Decoy,0,-8.4514,-7.46,-2.33,-6.452713962123887
C[C@@H](CNC(=O)NC[C@@H](O)c1ccc(F)c(F)c1)[NH+]1CCc2ccccc2C1,C61962425_decoy,TRY1,Decoy,0,-9.37176,-7.95,-3.25,-8.864198851705426
CNC(=O)C[NH+]1CCC(NC(=O)NCC2(c3ccc(F)cc3)CCCC2)CC1,C41171269_decoy,TRY1,Decoy,0,-8.77729,-7.77,-1.95,-6.950813108554764
CCCNC(=O)NC(C)(C)C(=O)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C62271508_decoy,TRY1,Decoy,0,-8.49539,-8.05,-1.21,-6.530448113502715
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NC[C@H](c1cccs1)[NH+]1CCC(C)CC1,C62527063_decoy,TRY1,Decoy,0,-8.48973,-5.21,-2.66,-5.157040388005906
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@@H]1SNN[C@H]1c1ccccc1,C63795976_decoy,TRY1,Decoy,0,-8.71942,-7.15,-1.04,-9.206610733115518
C[C@]1(c2cccc(NC(=O)CCCC3=c4ccccc4=[NH+]C3)c2)NC(=O)NC1=O,C64098257_decoy,TRY1,Decoy,0,-8.04204,-7.79,-2.99,-6.062355926038138
CCCNC(=O)c1ccc(NC(=O)NC[C@H](C)[NH+]2CCC(C)CC2)cc1Cl,C65416232_decoy,TRY1,Decoy,0,-8.61224,-5.56,-2.64,-5.338124259171503
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)C1,C66679735_decoy,TRY1,Decoy,0,-7.25447,-8.69,-3.26,-6.830108073669359
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)C1,C66679946_decoy,TRY1,Decoy,0,-7.94135,-6.36,-1.48,-5.4660810365890535
O=C(Cc1ccccc1F)NNC(=O)NC1CC[NH+](CC2CCCCC2)CC1,C66925657_decoy,TRY1,Decoy,0,-8.54231,-7.96,-1.75,-6.78414693431987
COc1ccccc1C(=O)NNC(=O)NC1CC[NH+](C2CCC(C)CC2)CC1,C67479661_decoy,TRY1,Decoy,0,-8.71364,-7.18,-2.12,-5.854465878844945
CC(=O)Nc1cc(NC(=O)NC[C@H]2CCC[NH+]2CC2CCCCC2)ccc1F,C67539100_decoy,TRY1,Decoy,0,-9.9955,-7.33,-1.87,-6.608492589481758
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CC1,C67639874_decoy,TRY1,Decoy,0,-6.86601,-6.53,-1.97,-4.76636192976462
COC1(OC)[NH+]=C(N)[C@@]2(C#N)[C@H](c3ccccc3)[NH2+]C(C)=C[C@]12C#N,C04427571_decoy,TRY1,Decoy,0,-5.66011,-4.32,-2.63,-3.9599670279851424
C[NH2+][C@@H](C)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H]([NH2+]C)CC[C@]45C[C@]35CC[C@]12C,C05763289_decoy,TRY1,Decoy,0,-7.98461,-7.06,-2.01,-5.882878726376989
CC1=C[C@]2(C#N)C3([NH+]=C(N)[C@@]2(C#N)[C@@H](c2ccccc2)[NH2+]1)OCCO3,C07991589_decoy,TRY1,Decoy,0,-6.3987,-6.95,-1.65,-4.422998826057454
c1ccc2c(c1)N/C(=[NH+]\C1CCCCCC1)C1(CC[NH2+]CC1)N2,C15862363_decoy,TRY1,Decoy,0,-7.7884,-5.49,-1.75,-3.533117098821932
C[NH2+][C@H](C)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@H]([NH2+]C)CC[C@@]45C[C@@]35C=C[C@]12C,C21992839_decoy,TRY1,Decoy,0,-6.99449,-6.64,-2.49,-5.266981903482924
C[NH+](Cc1ccccc1O)[C@@H]1c2ccccc2C2(CC[NH2+]CC2)[C@H]1O,C23214574_decoy,TRY1,Decoy,0,-6.95993,-5.42,-2.38,-3.922733007511306
CCOc1cc([C@H](C[NH3+])N2CC[NH+](C)CC2)cc(Cl)c1O,C32070938_decoy,TRY1,Decoy,0,-7.76147,-5.29,-0.9,-5.120631507598173
CCCC[NH+](CC)[C@@H](C[NH3+])c1cc(Br)ccc1O,C32071470_decoy,TRY1,Decoy,0,-8.81942,-4.08,-3.73,-4.988486278768108
CC[NH+](CC)[C@H](C[NH3+])c1cc(Br)cc(OC)c1O,C32072065_decoy,TRY1,Decoy,0,-8.8377,-4.77,-2.46,-5.3547202094374535
C=CCc1cc([C@H](C[NH3+])[NH+]2C[C@H](C)C[C@@H](C)C2)cc(OC)c1O,C32076903_decoy,TRY1,Decoy,0,-7.76792,-5.12,-3.63,-5.825461416847954
Clc1ccc(C/[NH+]=C2\Nc3ccccc3NC23CC[NH2+]CC3)cc1,C32918740_decoy,TRY1,Decoy,0,-7.28759,-5.76,-0.53,-3.929046261446732
[NH3+]CCCCCCc1[nH]c(-c2ccc(Br)cc2)c[nH+]1,C36878263_decoy,TRY1,Decoy,0,-9.14307,-5.92,-2.34,-6.724657186080674
[NH3+]CCC[NH2+]Cc1cc(Br)ccc1OC(F)F,C37713700_decoy,TRY1,Decoy,0,-8.21861,-5.64,-1.55,-7.560366246018885
CC1(C)CC(N2C(=O)OC3(CC(C)(C)[NH2+]C(C)(C)C3)[C@]2(C)O)CC(C)(C)[NH2+]1,C38194334_decoy,TRY1,Decoy,0,-6.91307,-6.42,-2.02,-4.2429317450402655
C[NH+](CC[NH3+])[C@H]1CC[C@@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@@]4(C)[C@H]3CC[C@]21C,C39029992_decoy,TRY1,Decoy,0,-10.3112,-5.47,-3.36,-5.512415649032831
N[C@H]1C(C2[NH+]=c3ccccc3=[NH+]2)=NNN1c1ccc(Cl)cc1,C39224433_decoy,TRY1,Decoy,0,-7.2725,-6.83,-0.67,-5.6920935311873935
O[C@H]([C@@H]1[NH+]=c2ccc(F)cc2=[NH+]1)[C@H](O)c1nc2ccc(F)cc2[nH]1,C39577845_decoy,TRY1,Decoy,0,-8.08329,-8.25,-1.5,-8.069448053845308
Oc1ccc(O)c(/C=N/[NH+]=C2/N=NC3=c4ccccc4=[NH+][C@@H]3N2)c1,C39709958_decoy,TRY1,Decoy,0,-7.26251,-7.83,0.55,-5.346567710893115
Cc1ccc2c(c1)=C1N=NC(N/N=C/c3c(C)cc(O)cc3O)=[NH+][C@@H]1[NH+]=2,C39774347_decoy,TRY1,Decoy,0,-7.67462,-8.05,-1.26,-5.200358747497841
Oc1ccc(/C=N/[NH+]=C2/N=NC3=c4ccccc4=[NH+][C@@H]3N2)cc1O,C39935121_decoy,TRY1,Decoy,0,-7.49573,-8.91,-0.42,-6.384768148753189
Cc1cccc2c1=[NH+][C@H]1[NH+]=C(N/N=C/c3ccc(O)c(O)c3)N=NC=21,C39935581_decoy,TRY1,Decoy,0,-7.84167,-8.34,-0.12,-6.989297890398224
C[C@H]([NH2+]CCCC[NH3+])c1ccc(Br)cc1Br,C41652853_decoy,TRY1,Decoy,0,-7.89997,-5.3,-2.14,-7.244773479754229
[NH3+]C1C[C@H]2CC[C@@H](C1)[NH+]2[C@@H]1C(=O)Nc2cc(F)c(Br)cc21,C42135473_decoy,TRY1,Decoy,0,-8.01143,-6.15,-2.12,-4.5685903992981
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1,C42910612_decoy,TRY1,Decoy,0,-7.57006,-4.97,-2.7,-5.065296166367695
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](CC)CCO,C42953993_decoy,TRY1,Decoy,0,-7.78876,-4.98,-2.73,-4.930377430248708
[NH3+]C[C@@H](c1ccc(Br)cc1)[NH+]1CCCC[C@@H]1CO,C42954131_decoy,TRY1,Decoy,0,-7.89599,-4.68,-3.0,-4.910805814031584
C[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+]1CCCC[C@@H]1CO,C42954140_decoy,TRY1,Decoy,0,-7.13434,-5.44,-2.27,-4.528789265914239
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](CCO)C(C)C,C42955234_decoy,TRY1,Decoy,0,-6.89871,-4.25,-1.37,-5.103769775031087
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](CCO)C1CC1,C42955252_decoy,TRY1,Decoy,0,-8.24744,-3.62,-1.97,-4.191966645437271
C[C@@H]([NH3+])[C@@H](c1cccc(Br)c1)[NH+]1CCC(O)CC1,C43019951_decoy,TRY1,Decoy,0,-8.13152,-5.0,-0.5,-5.201448435067252
CC(C)[NH+](CCCO)[C@@H](c1ccccc1Br)[C@@H](C)[NH3+],C43093320_decoy,TRY1,Decoy,0,-7.43911,-3.7,-2.2,-4.226681855848016
C[NH+](CC[NH3+])[C@H]1CC[C@@H]2[C@H]3CC[C@@H]4C[C@H](O)CC[C@@]4(C)[C@H]3CC[C@]21C,C43735900_decoy,TRY1,Decoy,0,-7.1821,-5.1,-1.38,-4.549709629599376
CC(C)c1ccc2c(c1)CC[C@H]1[C@](C)(C[NH2+]CCC[NH3+])CCC[C@@]21C,C44124499_decoy,TRY1,Decoy,0,-8.19973,-6.39,-3.57,-5.961147196856237
CC(C)c1ccc2c(c1)CC[C@@H]1[C@](C)(C[NH2+]CCC[NH3+])CCC[C@@]21C,C44124503_decoy,TRY1,Decoy,0,-9.03657,-6.32,-1.23,-5.846119447149966
[NH3+]C[C@H]1CCC[NH+]([C@@H]2C(=O)Nc3cc(Br)ccc32)C1,C44527931_decoy,TRY1,Decoy,0,-8.55511,-5.68,-0.27,-4.2986766552536535
CC(=O)/[NH+]=c1/ccc2c(CS/C(N)=[NH+]/CC(C)C)cc(O)oc-2c1,C46437695_decoy,TRY1,Decoy,0,-7.80951,-6.31,-2.66,-5.419882654908188
C[NH+](C)CCOc1ccccc1-c1cs/c(=N\C(=O)C[NH3+])[nH]1,C31959731_decoy,TRY1,Decoy,0,-7.72308,-6.8,-1.1,-7.592641201727616
Nc1c[nH+]c2ccc(Br)cc2c1N1CC[NH2+]CC1,C50607428_decoy,TRY1,Decoy,0,-6.93024,-6.41,-2.26,-3.800467762710777
C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(I)cc1,C51694177_decoy,TRY1,Decoy,0,-8.27304,-6.3,0.03,-8.017891176145103
C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(F)c(Br)c1,C51694348_decoy,TRY1,Decoy,0,-8.29882,-6.42,-1.11,-10.345729917013296
Nc1nc(N2C[C@H]3CCC[NH2+][C@H]3C2)c2c([nH+]1)C1(CCCC1)CCC2,C49070280_decoy,TRY1,Decoy,0,-8.60647,-5.09,-1.51,-4.176165892224239
CC[C@H]([NH3+])CN1C(=O)NC2(CC[NH+](CCC(C)C)CC2)C1=O,C57846490_decoy,TRY1,Decoy,0,-7.607,-6.28,-1.43,-9.64711384022397
Cc1cccc2c1=[NH+][C@H]1N=C(N/N=C\c3ccc(O)cc3O)[NH+]=NC=21,C39732711_decoy,TRY1,Decoy,0,-6.89432,-7.54,-0.53,-6.441819508144602
COc1ccc(NC2=C3CN(C)CC[C@H]3C3=C(N)[NH+]=NC3=[NH+]2)cc1,C38752082_decoy,TRY1,Decoy,0,-9.77384,-5.98,-1.02,-5.314784695793433
Cc1cccc([C@H]2NN=C(SCC3[NH+]=c4ccccc4=[NH+]3)N2N)c1,C63619683_decoy,TRY1,Decoy,0,-7.19448,-8.1,-1.31,-8.00985488967821
CCc1[nH]c(C)c([C@H]2N[C@](CO)(c3ccccc3)[C@H]3C[NH+](CC)C[C@@H]23)[nH+]1,C65383407_decoy,TRY1,Decoy,0,-8.02879,-5.03,-1.79,-5.398525899153876
CCc1[nH]c(C)c([C@@H]2[C@H](c3ccccc3)NC[NH+]2CCCO)[nH+]1,C65397692_decoy,TRY1,Decoy,0,-6.38828,-4.57,-1.3,-4.287972735624738
C1=C([C@H]2NCCc3[nH]c[nH+]c32)[C@@H](c2cc[nH+]cc2)NN1c1ccccc1,C65433521_decoy,TRY1,Decoy,0,-7.56271,-7.81,-0.55,-7.669508974623716
CC[C@@H](C)[NH+](C)CCNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C66173784_decoy,TRY1,Decoy,0,-8.38481,-6.14,-2.43,-5.418018428588362
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1,C67122314_decoy,TRY1,Decoy,0,-9.20827,-5.13,-2.67,-5.4163576453678015
Cn1cc(C2=C(c3cn(CCC[NH3+])c4ccccc34)C(=O)NC2=O)c2ccccc21,C02011710_decoy,TRY1,Decoy,0,-8.03891,-6.71,-3.66,-7.088952490519212
C[NH+]1CCC(C(=O)Nc2n[nH]c3nc(-c4ccc(O)cc4)c(Br)cc23)CC1,C03817137_decoy,TRY1,Decoy,0,-7.17926,-7.04,-1.36,-4.867958498579943
COc1cc2c(cc1OC)[C@@H](c1c(O)[nH]c(=O)n(-c3ccccc3C)c1=O)[NH2+]CC2,C03984867_decoy,TRY1,Decoy,0,-7.71105,-4.95,-3.83,-4.615216447222495
COc1cc2c(cc1OC)[C@H](c1c(O)[nH]c(=O)n(-c3ccccc3C)c1=O)[NH2+]CC2,C03984868_decoy,TRY1,Decoy,0,-7.49494,-6.79,-1.5,-5.165591869586804
COc1cc(Cl)cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C(C)C)C4)N2)c1O,C04555306_decoy,TRY1,Decoy,0,-9.52027,-8.26,-1.45,-8.342295790747507
COc1ccc(N2CC[NH+](Cc3nc(N)nc(Nc4ccccc4C)n3)CC2)cc1,C04740283_decoy,TRY1,Decoy,0,-8.719,-6.46,-0.81,-5.343878679039293
CN(C)S(=O)(=O)c1cccc(NC(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C05659374_decoy,TRY1,Decoy,0,-8.13543,-6.31,-4.04,-7.137452078177446
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC[C@@H]1c1ccc2c(c1)OCCO2,C08727144_decoy,TRY1,Decoy,0,-8.24266,-5.93,-0.63,-5.363231212006773
CC[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)cc(OC)c2O)N3)C1,C08928034_decoy,TRY1,Decoy,0,-9.40416,-7.98,-2.77,-9.617175292861171
CCOc1cc([C@@H]2NC(=O)c3c(sc4c3CC[NH+](C)C4)N2)cc(Br)c1O,C02335559_decoy,TRY1,Decoy,0,-7.99937,-4.66,-2.22,-4.247804237661094
CCOc1cc([C@H]2NC(=O)c3c(sc4c3CC[NH+](C)C4)N2)cc(Br)c1O,C02335561_decoy,TRY1,Decoy,0,-9.17308,-5.09,-1.01,-5.126180752672869
CCOc1cc(Cl)c(Cl)c([C@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)c1O,C09333882_decoy,TRY1,Decoy,0,-10.2042,-5.99,-1.64,-6.652049064972555
CCOc1cc(Cl)c(Cl)c([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)c1O,C09333884_decoy,TRY1,Decoy,0,-9.83,-8.25,-2.17,-9.879629681311489
CC1(C)Cc2c(c(N3CCCC3)[nH+]c3sc(C(=O)Nc4nccs4)c(N)c23)CO1,C09488323_decoy,TRY1,Decoy,0,-9.3361,-6.19,-0.95,-5.517111784226985
O=C(NCC1C2CC3CC(C2)CC1C3)c1ccc(C[NH+]2CCC[C@H]2CO)[nH]c1=O,C12190555_decoy,TRY1,Decoy,0,-8.4022,-8.33,-1.73,-5.980083343886471
CC[NH+]1CCc2c([nH]c3ccccc23)[C@H]1c1c(O)nc(O)n(-c2ccc(F)cc2)c1=O,C09013453_decoy,TRY1,Decoy,0,-8.46697,-6.86,-2.06,-5.348878679041506
CC1CCC(CNC(=O)Cn2nc(C(F)(F)F)nc2N)([NH+]2CCCCC2)CC1,C19654762_decoy,TRY1,Decoy,0,-8.8127,-4.95,-1.86,-5.276998883300883
COc1ccc(C)cc1C[NH+](C)[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C29158885_decoy,TRY1,Decoy,0,-10.0142,-6.71,-2.49,-6.793609943381354
C[C@@H](NCC1([NH+]2CCSCC2)CCCC1)C(=O)NC(=O)NC1CCCCC1,C30514313_decoy,TRY1,Decoy,0,-9.41014,-6.15,-1.39,-6.134012034480891
C[C@H](NCC1([NH+]2CCSCC2)CCCC1)C(=O)NC(=O)NC1CCCCC1,C30514318_decoy,TRY1,Decoy,0,-8.75515,-7.23,-2.47,-7.663751841306431
CC[NH+](Cc1nc(N)nc(Nc2ccccc2C)n1)C[C@@H]1COc2ccccc2O1,C32654932_decoy,TRY1,Decoy,0,-7.64082,-7.78,-2.35,-7.347928617657853
COc1ccc(-n2nc3nc(N4CC[NH2+]CC4)nc(-c4ccccc4)c3c2N)cc1,C35576686_decoy,TRY1,Decoy,0,-8.4401,-5.95,-1.82,-5.736041483947546
COc1ccc(-c2nc(NCC[NH+]3CCCCC3)nc3nn(C)c(N)c23)c(F)c1,C35929151_decoy,TRY1,Decoy,0,-7.85071,-8.05,-2.95,-6.501259728662865
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC[C@H]1c1ccc2c(c1)OCCO2,C36386357_decoy,TRY1,Decoy,0,-8.14766,-6.81,-0.69,-5.597012405848121
CNC(=O)c1ccc(-c2sc3[nH+]c(N4CCOCC4)c4c(c3c2N)CCCC4)o1,C04785657_decoy,TRY1,Decoy,0,-8.63665,-8.17,-0.91,-5.762552149715132
CCOc1cc(Br)cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C)C4)N2)c1O,C08589994_decoy,TRY1,Decoy,0,-10.0891,-6.87,-1.72,-6.764293767163889
CNC(=O)c1ccc(-c2sc3[nH+]c(N4CCOCC4)c4c(c3c2N)CC(C)(C)OC4)o1,C08672658_decoy,TRY1,Decoy,0,-9.33905,-6.18,-0.84,-6.1042680818731885
COc1ccc([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)cc1CN1CC([N+](=O)[O-])=CN1,C38550267_decoy,TRY1,Decoy,0,-7.36035,-5.73,-1.01,-4.687391063273717
COc1ccc([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)cc1CN1CC([N+](=O)[O-])=CN1,C38550268_decoy,TRY1,Decoy,0,-7.2537,-7.6,-0.31,-6.769870604477086
O=C(NCc1ccco1)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228067_decoy,TRY1,Decoy,0,-8.6951,-9.83,-1.36,-6.313862789153371
CCc1cccc2c1=[NH+]CC=2C(=O)C(=O)N[C@H]1S[C@H]2CCCC[C@H]2[C@H]1C(N)=O,C39354225_decoy,TRY1,Decoy,0,-8.6593,-6.52,-1.45,-5.9006784928723786
CCc1cccc2c1=[NH+]CC=2C(=O)C(=O)N[C@@H]1S[C@H]2CCCC[C@H]2[C@@H]1C(N)=O,C39354231_decoy,TRY1,Decoy,0,-7.23785,-7.69,-3.51,-5.733889203830073
CC1(C)CC(Nc2ncnc(NCc3ccc(F)cc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645269_decoy,TRY1,Decoy,0,-6.28104,-7.84,-1.96,-7.121521297281348
Nc1c(Nc2ccccc2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40781113_decoy,TRY1,Decoy,0,-8.67843,-6.27,-1.64,-5.471063578840545
COC(=O)[C@H]1[C@@H](O)[C@@H](O)C[C@@H]2C[NH+]3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@H]21,C44606571_decoy,TRY1,Decoy,0,-7.3947,-7.69,-2.21,-4.638372819975832
COc1ccc(NC(=O)[C@@H]2[C@H]3C[C@H]4c5[nH]c6ccccc6c5CC[NH+]4C[C@@H]3CC[C@@H]2O)cn1,C39231312_decoy,TRY1,Decoy,0,-8.19094,-6.09,-2.01,-5.744954739135857
COc1ccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC(F)F,C48604995_decoy,TRY1,Decoy,0,-7.50118,-6.31,-3.69,-4.96867547826385
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccc(-n3ccc(C(F)(F)F)n3)cc2)N1,C54681189_decoy,TRY1,Decoy,0,-8.25191,-6.27,-1.95,-4.783910089079793
[NH2+]=C1Nc2nc3cc4c(cc3n2[C@H](c2ccc(OC(F)(F)F)cc2)N1)OCCCO4,C22018308_decoy,TRY1,Decoy,0,-8.24893,-5.9,-1.88,-4.463664089441304
NC1=[NH+]c2nc3cc4c(cc3n2[C@H](c2ccc(OC(F)F)cc2)N1)OCCCO4,C12507220_decoy,TRY1,Decoy,0,-8.17672,-5.65,-1.37,-4.640460335802413
COc1cc(Br)cc([C@@H]2N=C(O)c3c(sc4c3CC[NH+](C(C)C)C4)N2)c1O,C15947396_decoy,TRY1,Decoy,0,-9.49322,-7.62,-2.96,-5.663620701242821
C[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)CCNc1nc(Cl)nc2[nH]cnc12,C63271877_decoy,TRY1,Decoy,0,-8.39067,-7.48,-1.12,-7.114514799982249
O=C(CCNc1nc(Cl)nc2[nH]cnc12)NCCC1=c2cc(F)ccc2=[NH+]C1,C63279475_decoy,TRY1,Decoy,0,-8.37133,-7.52,-3.19,-6.782108112211759
CC[C@@H](C)n1c(=S)[nH]c([O-])c([C@H]2[NH2+]CCC3=c4cc(Cl)ccc4=[NH+][C@@H]32)c1=O,C63492697_decoy,TRY1,Decoy,0,-7.30826,-6.11,-2.47,-4.774496405150059
CC[C@H](C)n1c(=S)[nH]c([O-])c([C@@H]2[NH2+]CCC3=c4cc(Cl)ccc4=[NH+][C@@H]32)c1=O,C63492702_decoy,TRY1,Decoy,0,-7.5382,-5.99,-1.07,-5.437695840233853
O=C(NCCNC(=O)[C@@H]1C=c2ccccc2=[NH+]1)C(=O)Nc1cccc2ccccc12,C63778216_decoy,TRY1,Decoy,0,-7.63538,-6.85,-3.88,-5.522270751177862
COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(c4cccc(C)c4)[C@H](O)N=C3O)[C@H]1[NH+]=2,C63934031_decoy,TRY1,Decoy,0,-8.47308,-5.91,-1.72,-5.440712873848074
COc1ccc2c(c1)=C1CCN[C@H]([C@H]3C(=O)N(c4cccc5ccccc45)[C@@H](O)N=C3O)[C@@H]1[NH+]=2,C64097937_decoy,TRY1,Decoy,0,-8.38126,-7.31,-2.2,-6.218364036546946
O=C(CN1N=C(c2ccccc2)NN1)Nc1nc(C2=c3ccccc3=[NH+]C2)cs1,C64175206_decoy,TRY1,Decoy,0,-8.53059,-8.93,-1.75,-9.717018878386074
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc2sc3ccccc3c2s1,C64886644_decoy,TRY1,Decoy,0,-8.91192,-7.81,-2.05,-6.497363035415918
CC[NH+](CC)CCCNC(=S)NCCNc1[nH+]c2c(C)cccc2cc1C#N,C04964336_decoy,TRY1,Decoy,0,-8.48629,-5.96,-3.06,-7.028526347543212
CC[NH+]1CCN(c2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])CC1,C09209676_decoy,TRY1,Decoy,0,-8.05404,-4.65,-2.69,-4.664334280270444
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCSC)c1,C11816611_decoy,TRY1,Decoy,0,-9.61897,-4.29,-3.95,-5.594726446687058
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCSC)c1,C11816612_decoy,TRY1,Decoy,0,-9.06906,-5.63,-2.92,-6.793696147157261
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCSC)c1,C12049958_decoy,TRY1,Decoy,0,-9.86303,-5.86,-2.73,-7.620073485915509
O=C1NCCN1CC[NH2+]Cc1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1,C12057718_decoy,TRY1,Decoy,0,-8.18682,-6.12,-0.72,-5.436194723349616
O=C1NCCN1CC[NH2+]Cc1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1,C12057721_decoy,TRY1,Decoy,0,-7.87455,-5.76,-1.51,-5.4855451148169685
COc1ccc(C[NH2+]CCc2cn[nH]c2)cc1OC[C@@H](O)C[NH+](C)C(C)C,C12091053_decoy,TRY1,Decoy,0,-7.73033,-6.46,-2.52,-7.088751172416848
COc1ccc(C[NH2+]CCc2cn[nH]c2)cc1OC[C@H](O)C[NH+](C)C(C)C,C12091055_decoy,TRY1,Decoy,0,-9.14429,-6.07,-0.84,-10.006566314376409
Cc1c[nH]c(CC[NH2+]Cc2ccc(OC[C@@H](O)C[NH+]3CCCCC3)cc2)n1,C11935502_decoy,TRY1,Decoy,0,-7.34026,-6.19,-2.43,-5.040251577416387
CC(=O)NCC[NH2+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCc2ccccc2C1,C12431510_decoy,TRY1,Decoy,0,-7.41341,-6.66,-1.78,-7.915401774054233
COc1cc(C[NH2+]CCc2cn[nH]c2)ccc1OC[C@@H](O)C[NH+]1CCOCC1,C12458622_decoy,TRY1,Decoy,0,-8.13565,-6.76,-2.43,-7.15256289134554
COc1cc(C[NH2+]CCc2cn[nH]c2)ccc1OC[C@H](O)C[NH+]1CCOCC1,C12458624_decoy,TRY1,Decoy,0,-7.97088,-6.99,-1.67,-6.699290764248513
COc1ccc(C[NH2+]CC(C)(C)CO)c(OC[C@@H](O)C[NH+]2CCCCCCC2)c1,C12718631_decoy,TRY1,Decoy,0,-8.00999,-5.3,-1.72,-5.407600126840379
O[C@@H](COc1cccc(C[NH2+]Cc2n[nH]c3c2CCC3)c1)C[NH+]1CCOCC1,C12305183_decoy,TRY1,Decoy,0,-7.68842,-6.83,-2.35,-6.65183709658637
COc1cccc(C[NH2+]CCc2c[nH]cn2)c1OC[C@@H](O)C[NH+]1CCOCC1,C11661290_decoy,TRY1,Decoy,0,-7.54774,-6.54,-2.67,-8.284852434967805
COc1cc(C[NH2+]CCc2cn[nH]c2)ccc1OC[C@@H](O)C[NH+]1CCSCC1,C15071875_decoy,TRY1,Decoy,0,-9.28575,-6.73,-2.49,-7.897553690965716
COc1cc(C[NH2+]CCc2cn[nH]c2)ccc1OC[C@H](O)C[NH+]1CCSCC1,C15071877_decoy,TRY1,Decoy,0,-9.24048,-6.6,-3.24,-9.230376435047784
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCOC(C)C)c1,C15074899_decoy,TRY1,Decoy,0,-8.07281,-6.31,-1.95,-7.120586271332488
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCOC(C)C)c1,C15074900_decoy,TRY1,Decoy,0,-9.41113,-6.19,-2.02,-9.76311487559059
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH2+]CC(C)(C)CO)c2)CC1,C19635379_decoy,TRY1,Decoy,0,-8.46696,-6.47,-2.16,-6.212634577909646
CC1CC[NH+](CC2(NC(=O)[C@@H]3CCC[NH+](CC(N)=O)C3)CCCCC2)CC1,C19663709_decoy,TRY1,Decoy,0,-9.57694,-6.1,-3.64,-6.145439827499181
COc1ccc(C[NH2+]CCSc2cnn[nH]2)cc1OC[C@@H](O)C[NH+]1CCCC1,C19745700_decoy,TRY1,Decoy,0,-8.55149,-6.34,-1.87,-6.896695509978128
C[NH+](CCc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]Cc1ccccn1,C20465818_decoy,TRY1,Decoy,0,-6.11234,-6.22,-2.49,-4.80545168011337
C[NH+]1CCC(NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2[NH+](C)CCc2ccccc2)CC1,C20465821_decoy,TRY1,Decoy,0,-6.28893,-5.8,-1.81,-5.31301631062146
C[C@@H](CCc1c[nH]c2ccccc12)[NH+]1CCC(n2cc(C(C)(C)[NH3+])nn2)CC1,C20995608_decoy,TRY1,Decoy,0,-7.69189,-6.41,-0.93,-5.9071760784203216
[NH3+]CCc1cc(=O)[nH]c(-c2ccc(C[NH+](Cc3ccncc3)C3CC3)cc2)n1,C23399576_decoy,TRY1,Decoy,0,-8.9378,-5.86,-3.61,-6.840397706949487
Cc1nc([C@@H](C)[NH+](C)Cc2ccc(-c3nc(CC[NH3+])cc(=O)[nH]3)cc2)c(C)s1,C23505959_decoy,TRY1,Decoy,0,-9.71499,-6.49,-3.23,-8.152322196009221
C[C@H](C(=O)NCC1([NH+]2CCCCC2)CCCCC1)[NH+]1CCC(C(N)=O)CC1,C25525126_decoy,TRY1,Decoy,0,-8.3065,-5.51,-1.99,-5.578150500117682
[NH3+]CC1=NNN(C[C@H]2CCC[NH+](C[C@@H]3C=NN=C3c3cccc(F)c3)C2)C1,C39490443_decoy,TRY1,Decoy,0,-9.00813,-7.94,-1.48,-8.197877471976726
CC1=C(CCN(C)C(=O)CN2N[NH2+]N[C@H]2C[NH+]2CCCCCC2)[C@@H](C)N=N1,C39515392_decoy,TRY1,Decoy,0,-8.21197,-6.95,-0.8,-6.320243979427599
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H]([NH2+]Cc3ccc(F)cc3)C[NH+]12,C35442252_decoy,TRY1,Decoy,0,-6.78121,-7.41,-2.44,-5.197751202355289
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H]([NH2+]Cc3ccc(F)cc3)C[NH+]12)NC1CC1,C35442302_decoy,TRY1,Decoy,0,-6.96952,-5.88,-1.55,-4.935441980145722
Cn1cc(C[NH2+][C@H]2C[C@H]3C(=O)NC[C@@H](CCC(=O)NC4CC4)[NH+]3C2)c2ccccc21,C22936910_decoy,TRY1,Decoy,0,-8.73109,-5.72,-1.4,-5.973676433711115
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H]([NH2+]Cc3ccc(N(C)C)cc3)C[NH+]12,C22936924_decoy,TRY1,Decoy,0,-8.36746,-6.65,-2.34,-7.12086088562059
CCCNC(=O)C[NH+]1CCC(NC(=O)NCCC[NH+](C)CCOC)CC1,C61988026_decoy,TRY1,Decoy,0,-8.10323,-4.91,-3.37,-5.909254510202792
C[NH+](CCCNC(=O)NNC(=O)C1=c2ccccc2=[NH+]C1)Cc1ccccc1,C63133638_decoy,TRY1,Decoy,0,-7.49895,-7.65,-0.77,-6.533263347875714
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@H](SCC(N)=O)N3N2)[C@@H](C)N=N1,C63708222_decoy,TRY1,Decoy,0,-9.87864,-7.98,-1.53,-14.18539858703989
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](SCC(N)=O)N3N2)[C@@H](C)N=N1,C63708225_decoy,TRY1,Decoy,0,-8.71873,-7.85,-1.85,-7.7126535975300605
COc1ccc([C@@H]2NN=C(SCC3[NH+]=c4ccccc4=[NH+]3)N2N)cc1OC,C63744031_decoy,TRY1,Decoy,0,-7.53333,-8.07,-0.93,-6.752447373878521
COc1ccc([C@H]2NN=C(SCC3[NH+]=c4ccccc4=[NH+]3)N2N)cc1OC,C63744032_decoy,TRY1,Decoy,0,-8.24249,-7.29,-1.79,-6.168474021448343
CCc1[nH]c(C)c([C@@H]2[C@H](c3ccccc3)NC[NH+]2C[C@H](O)c2cccnc2)[nH+]1,C65383284_decoy,TRY1,Decoy,0,-6.94011,-5.68,-1.86,-4.9273868277694834
Cc1c[nH+]c([C@H]2C(c3ccccc3)=NCN2CCC[NH+](CCO)CCO)[nH]1,C65385337_decoy,TRY1,Decoy,0,-6.86337,-6.3,-2.17,-9.526696371740744
Cc1[nH]c[nH+]c1[C@@H]1C(c2ccccc2)=NCN1CCC[NH+](CCO)CCO,C65386664_decoy,TRY1,Decoy,0,-8.67033,-4.81,-3.26,-5.451320254804431
Cc1sc2nc(CC[NH3+])nc(N3CC[NH+](CC4CC4)[C@H](CCO)C3)c2c1C,C65405605_decoy,TRY1,Decoy,0,-10.3237,-5.69,-1.62,-10.0599140327631
CCN1NC(C)=C(NC(=O)C[NH2+]C[C@@H]2C=c3ccc(F)cc3=[NH+]C2=O)[C@H]1C,C65423599_decoy,TRY1,Decoy,0,-8.38048,-7.67,-4.04,-7.52471329046221
CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cc(Cl)c(OCC(N)=O)c(OC)c2)CC1,C67120524_decoy,TRY1,Decoy,0,-8.58302,-6.31,-4.35,-6.919714280728118
COc1cc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc(Cl)c1OCC(N)=O,C67120876_decoy,TRY1,Decoy,0,-8.68803,-6.31,-3.89,-6.9745611034121175
CC1CC[NH+](C[C@H](O)CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)CC1,C67582282_decoy,TRY1,Decoy,0,-8.31483,-5.77,-1.72,-6.288060968703025
CC1CC[NH+](C[C@@H](O)CNC(=O)NC2CC[NH+](CC3CCCC3)CC2)CC1,C67637437_decoy,TRY1,Decoy,0,-8.94092,-7.43,-1.54,-7.282849444131935
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]Cc2ccco2)C(=O)[O-])c1,C05258975_decoy,TRY1,Decoy,0,-6.95922,-6.4,-5.15,-6.31965124934133
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06462273_decoy,TRY1,Decoy,0,-7.56245,-6.58,-1.03,-8.323085781368155
COCCNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06904967_decoy,TRY1,Decoy,0,-7.37448,-6.71,-4.48,-8.068667275735017
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)N[C@H](C(=O)[O-])C(C)C)c1ccc(Cl)cc1,C09136056_decoy,TRY1,Decoy,0,-8.77187,-6.78,-2.01,-6.551697689947392
CC[C@H](Sc1nc(C)c(Cc2ccc(O)cc2)[nH]1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C09288390_decoy,TRY1,Decoy,0,-10.0703,-8.15,-4.0,-6.946345599147222
CC(C)CN(C(=O)CN(C)C(=O)NNC(=O)c1cccs1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C09791215_decoy,TRY1,Decoy,0,-8.3293,-5.15,-3.28,-6.220363247623367
O=C(CCCSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C09956755_decoy,TRY1,Decoy,0,-4.35059,-6.93,-1.86,-5.20658549057515
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1,C12474031_decoy,TRY1,Decoy,0,-8.05476,-7.61,-2.68,-7.465283410784507
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(O)cc2)c1,C12474042_decoy,TRY1,Decoy,0,-7.37854,-6.67,-4.11,-6.2594374197547245
NC(=O)c1nsc(C(=O)N(Cc2cccs2)[C@@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1N,C12702359_decoy,TRY1,Decoy,0,-10.6664,-7.65,-1.89,-9.762828286024597
NC(=O)c1nsc(C(=O)N(Cc2cccs2)[C@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1N,C12702366_decoy,TRY1,Decoy,0,-8.44231,-6.12,-0.89,-6.367919744183677
CC[C@@H](Sc1nc(C)c(Cc2ccc(O)cc2)[nH]1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C09290151_decoy,TRY1,Decoy,0,-10.3606,-8.33,-1.93,-8.385826980215796
CSCC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H]([NH3+])CCSC)C(=O)[O-],C04899465_decoy,TRY1,Decoy,0,-11.544,-4.66,-2.67,-6.918647438220682
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)/C=N/c1ccc(/C=C\c2ccnc3ccccc23)cc1,C17062677_decoy,TRY1,Decoy,0,-8.30062,-8.03,-1.82,-6.076506356665592
COc1ccc(NC(=O)/C=C(\C)NNC(=O)Cc2csc(N)n2)c([N+](=O)[O-])c1,C20158443_decoy,TRY1,Decoy,0,-7.44306,-7.54,-4.05,-6.292779276705289
O=C(CSc1n[nH]c(N/N=C/c2ccccc2O)n1)NNC(=O)C(F)(F)F,C20832481_decoy,TRY1,Decoy,0,-7.94872,-8.3,-2.85,-10.217674903743616
COc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)cc1O,C20833936_decoy,TRY1,Decoy,0,-9.01604,-7.32,-1.58,-6.499329447561272
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)NNC(=O)C(F)(F)F,C20906837_decoy,TRY1,Decoy,0,-7.16194,-8.59,-1.85,-8.744852767469231
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cc(Br)ccc2O)n1N,C21319332_decoy,TRY1,Decoy,0,-9.95947,-8.04,-2.82,-7.267427505863252
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cc(Cl)ccc2O)n1N,C21320124_decoy,TRY1,Decoy,0,-8.46655,-8.21,-3.78,-7.161016842118197
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cc(OC)ccc3OC)n2N)c(O)c1,C21325916_decoy,TRY1,Decoy,0,-8.95807,-6.75,-2.36,-8.604632990060914
CCCCn1c(N)c(N(CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)Cc2ccccc2)c(=O)[nH]c1=O,C23147291_decoy,TRY1,Decoy,0,-6.51291,-6.74,-4.29,-5.290766315346741
CCCCn1c(N)c(N(CC)CC2=C(C(=O)OCC)[C@H](c3ccco3)NC(=O)N2)c(=O)[nH]c1=O,C24956063_decoy,TRY1,Decoy,0,-7.04285,-6.68,-3.42,-5.651273239200549
CCCCn1c(N)c(N(CCC)CC2=C(C(=O)OCC)[C@H](c3ccccc3)NC(=O)N2)c(=O)[nH]c1=O,C25074291_decoy,TRY1,Decoy,0,-7.47225,-7.05,-2.92,-6.64372195275855
Cc1cc(O)oc2cc(=[NH+]C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCC(=O)[O-])ccc1-2,C25667522_decoy,TRY1,Decoy,0,-6.83507,-6.17,-2.45,-5.352912435968615
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1N,C26147082_decoy,TRY1,Decoy,0,-9.35627,-8.29,-0.42,-9.38495199565322
CCc1ccc(/C=C2/SC(=S)N(CCCC(=O)NNC(=O)c3cc(O)c(O)c(O)c3)C2=O)cc1,C28393790_decoy,TRY1,Decoy,0,-9.87084,-6.99,-1.62,-7.399423809925103
C[C@@H](CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O)[C@]1(O)COC(=O)C1,C31167153_decoy,TRY1,Decoy,0,-8.20958,-9.09,-2.75,-8.111831616297547
O=C(NNC(=S)NC1CCCCC1)C(=O)NNC(=S)NC1CCCCC1,C06691833_decoy,TRY1,Decoy,0,-9.51395,-5.03,-3.32,-6.011852059447757
O=C(COc1ccc(Cl)cc1Cl)N/N=C/c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C36047479_decoy,TRY1,Decoy,0,-8.49242,-6.61,-3.81,-5.981333139963653
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)[C@@H]1CCC(=O)N1,C36575681_decoy,TRY1,Decoy,0,-8.11744,-6.77,-3.22,-7.749641394314477
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)[C@@H]1CCC(=O)N1,C36575682_decoy,TRY1,Decoy,0,-8.01673,-5.47,-1.51,-5.9551249051141655
CCOCCCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCC(C)C)c1ccc(F)cc1,C06600131_decoy,TRY1,Decoy,0,-8.42321,-7.02,-2.75,-8.842647043744618
C=C[C@@](C)(CC/C=C(\C)[C@H](O)CC=C(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35271466_decoy,TRY1,Decoy,0,-6.88983,-6.18,-3.6,-5.652191023117489
C=C[C@@](C)(CC/C=C(\C)[C@@H](O)CC=C(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35271463_decoy,TRY1,Decoy,0,-7.24413,-5.99,-3.06,-5.187649985747727
C=C[C@](C)(CC/C=C(\C)[C@H](O)CC=C(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35271459_decoy,TRY1,Decoy,0,-7.3365,-6.35,-2.74,-5.7075498351887335
C=C[C@](C)(CC/C=C(\C)[C@@H](O)CC=C(C)C)O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35271457_decoy,TRY1,Decoy,0,-6.86496,-4.96,-3.31,-4.917519487750778
[H]/N=C(/N/C(N)=N/c1c(C)n(C)n(-c2ccccc2)c1=O)Nc1ccc(OCC)cc1,C04643115_decoy,TRY1,Decoy,0,-7.46029,-5.47,-3.1,-5.13656718093318
CC(C)CCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41301982_decoy,TRY1,Decoy,0,-7.97917,-6.99,-3.4,-8.36442343410175
CCCOc1ccc([C@@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(C(C)(C)C)C(=O)[C@H]32)cc1,C33874704_decoy,TRY1,Decoy,0,-8.51059,-6.91,-1.77,-8.732172026974057
CC(C)[C@H]([NH3+])C(=O)NC[C@@H](CC(=O)N[C@H](C(=O)[O-])C(C)C)c1ccc(Cl)cc1,C43618913_decoy,TRY1,Decoy,0,-9.2789,-6.56,-0.6,-7.038692685557807
O=C1CS[C@@H]([C@H](O)[C@@H](O)[C@H](O)CO)N1c1ccc(S(=O)(=O)Nc2ccccn2)cc1,C45301691_decoy,TRY1,Decoy,0,-9.19156,-7.15,-1.33,-7.702524506225542
Cc1ccccc1[C@H](CC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)NC(N)=O,C58687640_decoy,TRY1,Decoy,0,-7.50466,-7.52,-4.33,-6.397663990144163
C/C(=N\Nc1nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]1)c1ccccc1O,C59883724_decoy,TRY1,Decoy,0,-8.276,-8.18,-1.79,-7.95841819154337
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2ccc3c(c2)OCCO3)n1N,C59914532_decoy,TRY1,Decoy,0,-9.87998,-8.74,-2.93,-7.402351235440531
COc1ccc(OC)c(NC(=O)CSc2nnc(N/N=C/c3c(C)nn(CCO)c3C)n2N)c1,C59914594_decoy,TRY1,Decoy,0,-10.0892,-8.11,-2.93,-7.620759515656866
CC(C)[C@H](Sc1nnc(S[C@@H](C(=O)NC(N)=O)C(C)C)s1)C(=O)NC(N)=O,C36812427_decoy,TRY1,Decoy,0,-10.5874,-6.42,-1.32,-8.582780271823866
CCCN1[C@H](O)NN[C@@H]1SCC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C64684480_decoy,TRY1,Decoy,0,-8.11641,-7.08,-3.53,-7.05970304507932
CCCN1[C@@H](SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])NN[C@@H]1O,C64684483_decoy,TRY1,Decoy,0,-8.25902,-7.08,-2.92,-6.737680848393715
CCOc1cc(/C=N/N=C(\N)c2nonc2N)ccc1OCc1ccccc1C,C06047838_decoy,TRY1,Decoy,0,-7.77814,-7.26,-1.35,-7.137755180739412
O=C(Cc1n[nH]c(=O)c2ccccc12)NCCC(=O)N[C@H](CO)c1ccccc1,C13690619_decoy,TRY1,Decoy,0,-6.5005,-7.94,-2.55,-5.749609029955522
Cc1ccc(C)c(NC(=O)CCC(=O)NNC(=S)NC(=O)/C=C/c2ccc(C)o2)c1,C13978502_decoy,TRY1,Decoy,0,-8.29042,-8.33,-2.95,-7.114454401938628
CCCCn1c(N)c(N(C)C(=O)CSCC(=O)Nc2ccc(C)cc2)c(=O)[nH]c1=O,C14655576_decoy,TRY1,Decoy,0,-8.60895,-7.29,-1.61,-6.7318338481882645
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=S)NC[C@@H]1CCCO1,C15899218_decoy,TRY1,Decoy,0,-9.3238,-6.88,-1.24,-7.202712534932989
CC(C)NC(=O)c1ccccc1NC(=O)CNc1ccccc1C(=O)NC1CC1,C25614375_decoy,TRY1,Decoy,0,-7.28785,-6.95,-2.6,-7.164714601619011
CC(C)CCNC(=S)NNC(=O)CNC(=O)c1ccc(Br)o1,C08420395_decoy,TRY1,Decoy,0,-8.54563,-6.12,-1.01,-6.658819989216933
CCNC(=O)COc1ccc(N[C@H](C)C(=O)NC(=O)NCC(F)(F)F)cc1,C28376917_decoy,TRY1,Decoy,0,-6.37545,-6.01,-2.73,-4.200829813027703
Cc1nc(NC(=O)CSc2nc(N)cc(=O)[nH]2)sc1C(=O)OCC(C)C,C32521404_decoy,TRY1,Decoy,0,-9.07416,-7.6,-1.84,-8.023551564891374
Cc1cccc(C(=O)NCCC(=O)N[C@@H](C)c2ccc(-n3cc(C(N)=O)nn3)cc2)c1,C32926655_decoy,TRY1,Decoy,0,-7.25673,-8.4,-4.21,-7.582805522337334
Cc1cccc(C(=O)NCCC(=O)N[C@@H](C)c2ccc(-n3cc(C(N)=O)nn3)cc2)c1,C32926655_decoy,TRY1,Decoy,0,-7.25673,-8.4,-4.28,-7.582805522337334
CC(C)(C)OC(=O)NCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21,C35636613_decoy,TRY1,Decoy,0,-7.74596,-5.35,-2.8,-5.140813348979098
CCCCCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39915838_decoy,TRY1,Decoy,0,-7.48996,-6.28,-3.38,-7.183980284594135
CCCCCCn1c(S[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39915839_decoy,TRY1,Decoy,0,-7.51889,-6.51,-1.87,-7.158699931533859
CC(C)(C)C(=O)NCCC(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C42660301_decoy,TRY1,Decoy,0,-8.18589,-5.93,-2.59,-5.422091350213981
O=C(NCC1(c2ccccc2)CCC1)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42891730_decoy,TRY1,Decoy,0,-8.30321,-7.46,-0.92,-7.98135265561248
O=C(NCC1(c2ccccc2)CCC1)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42891742_decoy,TRY1,Decoy,0,-7.46819,-7.89,-2.65,-7.183281042373863
COc1ccccc1[C@H](C)NC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42896086_decoy,TRY1,Decoy,0,-7.36587,-6.75,-0.49,-5.5917626161074265
C=CCNc1nnc(S[C@@H](C(=O)Nc2sccc2C(N)=O)C(C)C)s1,C42896203_decoy,TRY1,Decoy,0,-10.2194,-5.91,-0.69,-8.151575507926227
COc1ccc(Nc2nc(C(=O)Nc3nc(CC(N)=O)cs3)cs2)c(OC)c1,C44248977_decoy,TRY1,Decoy,0,-8.65907,-5.15,-2.14,-6.091124326891992
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(NC(N)=O)cc2)c1C,C46327199_decoy,TRY1,Decoy,0,-8.66501,-5.15,-3.82,-6.381112316227275
CSCC[C@H](NC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O)c1nc2ccccc2[nH]1,C46898867_decoy,TRY1,Decoy,0,-7.64529,-8.57,-1.3,-7.665609471410852
COC(=O)CCCCCCNC(=O)NNC(=O)c1cc(Br)c[nH]1,C47069761_decoy,TRY1,Decoy,0,-7.81561,-5.72,-3.32,-5.650768551643227
COc1ccccc1NC(=S)NNC(=O)CCCNC(=O)c1cccs1,C47340467_decoy,TRY1,Decoy,0,-7.93307,-7.07,-3.65,-6.872592741544803
CCCNC(=S)NNC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1,C47682374_decoy,TRY1,Decoy,0,-8.49371,-5.32,-2.7,-5.3972781050401535
CCS(=O)(=O)NCCCNC(=O)NCc1cccc(NC(=O)CC(C)C)c1,C51713246_decoy,TRY1,Decoy,0,-7.86777,-6.6,-3.47,-5.982509590707358
O=C(NCCNC(=O)c1ccccc1F)NC[C@H](O)COc1cccc(F)c1,C52563639_decoy,TRY1,Decoy,0,-8.09543,-7.4,-1.91,-6.466517752248548
CCCCn1c(N)c(N(CC)CC(=O)Nc2nc(C)c(C)s2)c(=O)[nH]c1=O,C54638704_decoy,TRY1,Decoy,0,-7.51075,-6.53,-1.99,-5.304772118071498
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)CNc2ccc(C)cc2C)C1=O,C58079613_decoy,TRY1,Decoy,0,-7.62822,-7.13,-1.81,-7.333188238712582
CCOc1ccc(C[C@@H](CNC(=O)NCc2ccc3c(c2)OCO3)C(N)=O)cc1,C58159845_decoy,TRY1,Decoy,0,-9.42233,-7.71,-4.52,-6.535966910470756
Cc1cccc(NC(=S)NNC(=O)[C@H](NC(=O)c2ccco2)C(C)C)c1C,C28615856_decoy,TRY1,Decoy,0,-7.16784,-7.31,-1.1,-7.796364784138638
CCOC(=O)C1=C(N)OC(C)=C(C(N)=O)[C@@H]1c1cc(OC)c(OC)c(OC)c1,C58949363_decoy,TRY1,Decoy,0,-7.23745,-5.25,-4.43,-5.363774261040326
COc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1,C59015355_decoy,TRY1,Decoy,0,-8.92526,-8.7,-1.93,-7.730301776344429
CC(C)C(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/C=C/c2ccccc2)n1,C59879363_decoy,TRY1,Decoy,0,-8.47921,-6.89,-2.23,-6.8009867624012745
CC/C(C)=N/Nc1nc(SCCC(=O)Nc2ccccc2NC(C)=O)n[nH]1,C59889233_decoy,TRY1,Decoy,0,-8.23526,-7.59,-3.93,-7.892452291102677
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)CCCNC(=O)c1ccco1,C60538319_decoy,TRY1,Decoy,0,-8.24095,-6.53,-3.35,-5.974270179809106
NS(=O)(=O)c1ccc(CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1,C54644929_decoy,TRY1,Decoy,0,-8.08248,-5.87,-3.49,-5.671348622422767
CC(C)c1ccccc1NC(=S)NNC(=O)CCCNC(=O)c1ccco1,C66123055_decoy,TRY1,Decoy,0,-7.27745,-6.92,-2.41,-6.492219265575993
CCCC[C@@H](NC(N)=O)C(=O)Nc1ccnn1Cc1cccc(OC)c1OC,C66663455_decoy,TRY1,Decoy,0,-8.11438,-6.92,-2.13,-8.585580750730312
COc1ccccc1[C@@H](C)NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO,C24220224_decoy,TRY1,Decoy,0,-7.4299,-6.65,-2.18,-5.669569202550448
NC(=O)[C@@H](NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1,C66940137_decoy,TRY1,Decoy,0,-6.79265,-7.74,-2.09,-5.955833050877815
CCc1ccc(C(=O)NNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)cc1,C67128180_decoy,TRY1,Decoy,0,-9.15814,-7.65,-2.83,-7.45930816525784
CCC(=O)Nc1cccc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)c1,C67145178_decoy,TRY1,Decoy,0,-9.36036,-6.9,-1.77,-6.061965811821946
COc1ccc(NC(=S)NNC(=O)[C@H](NC(=O)CC(C)C)C(C)C)cc1F,C67195656_decoy,TRY1,Decoy,0,-8.08735,-7.15,-2.88,-7.371773988961706
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)NCCNC(=O)C1CCCCC1,C67203674_decoy,TRY1,Decoy,0,-10.0448,-7.64,-1.98,-7.875608904723841
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21)NCCNC(=O)C1CCCCC1,C67203681_decoy,TRY1,Decoy,0,-9.21853,-7.65,-1.87,-7.768054619307682
CCCCNC(=O)C1(NC(=O)Cc2ccc(S(N)(=O)=O)cc2)CCCCC1,C67273013_decoy,TRY1,Decoy,0,-10.0205,-6.26,-0.92,-6.672081446358954
CCOCCCNC(=O)NNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2,C67313551_decoy,TRY1,Decoy,0,-8.00963,-5.66,-3.67,-5.715129286960685
CCOc1ccc(F)cc1NC(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C67326163_decoy,TRY1,Decoy,0,-7.44031,-5.49,-2.63,-5.592683209211548
CCOc1cc(NC(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)ccc1C,C67347158_decoy,TRY1,Decoy,0,-7.74596,-4.91,-1.63,-5.406260341070063
CC(C)NC(=O)CCNC(=O)NC[C@H](O)COc1cccc(C(F)(F)F)c1,C67591456_decoy,TRY1,Decoy,0,-7.42362,-7.67,-3.19,-7.529385322684861
CCOc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3ccccc3OC)CC2)n1,C03765298_decoy,TRY1,Decoy,0,-7.95231,-8.0,-1.1,-8.71202757715199
CCCCN(C(=O)C[NH+]1CCc2ccccc2C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C03324748_decoy,TRY1,Decoy,0,-8.47251,-5.72,-2.26,-5.922843421569434
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+]C[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1C,C07546878_decoy,TRY1,Decoy,0,-7.78539,-8.31,-4.2,-7.293811831208565
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH2+]C[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1C,C07546880_decoy,TRY1,Decoy,0,-8.07341,-8.66,-1.59,-7.798732119371784
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+]C[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1C,C07546882_decoy,TRY1,Decoy,0,-8.42574,-8.97,-1.82,-7.965671147467462
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH2+]C[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1C,C07546883_decoy,TRY1,Decoy,0,-8.32319,-8.95,-1.5,-8.841352340998322
CCOc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3cccc(OC)c3)CC2)n1,C09096451_decoy,TRY1,Decoy,0,-7.86482,-7.24,-1.8,-6.748827839536348
CCOc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)n1,C09096452_decoy,TRY1,Decoy,0,-7.33084,-7.54,-2.14,-6.740066145755786
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+]C[C@@H](c2cccs2)c2c[nH]c3ccccc23)c1C,C09256522_decoy,TRY1,Decoy,0,-8.95655,-8.06,-2.6,-7.715309038561389
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+]C[C@H](c2cccs2)c2c[nH]c3ccccc23)c1C,C09256538_decoy,TRY1,Decoy,0,-9.31627,-8.2,-2.24,-7.911102072850607
CC(C)[NH+]1CCc2c(sc(NC(=O)CCCSc3ccc(F)cc3)c2C(N)=O)C1,C09474781_decoy,TRY1,Decoy,0,-9.54071,-7.46,-1.67,-7.3615234748288
CCOc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4ccccc4OC)CC3)n2)cc1,C09971223_decoy,TRY1,Decoy,0,-8.13564,-6.41,-2.63,-5.767776505648673
CCOc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(OC)c4)CC3)n2)cc1,C09971224_decoy,TRY1,Decoy,0,-9.37432,-6.54,-1.36,-6.49186690188367
CCOc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4ccc(OC)cc4)CC3)n2)cc1,C09971225_decoy,TRY1,Decoy,0,-8.30796,-6.89,-0.37,-6.4599500504952045
CCCCN(C(=O)C[NH+]1CCCCC[C@@H]1c1ccc(OC)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C15105690_decoy,TRY1,Decoy,0,-8.82868,-6.46,-2.34,-8.714294404494927
CCOC(=O)C1=C(C[NH+](C)CC(=O)Nc2cccc(C)c2C)NC(=O)N[C@@H]1c1ccco1,C15480296_decoy,TRY1,Decoy,0,-6.80072,-7.16,-1.91,-5.131419086343069
Cc1cccc(NC(=O)C[NH+](C)CC(=O)NCC(=O)Nc2cccc(Cl)c2C)c1C,C17288884_decoy,TRY1,Decoy,0,-8.56159,-7.45,-2.5,-7.321358560481929
Nc1ncc(C[NH+](Cc2ccco2)C[C@@H](O)Cn2c3ccccc3c3ccccc32)cn1,C19376180_decoy,TRY1,Decoy,0,-7.36522,-6.3,-4.44,-6.0427518299747724
Nc1ncc(C[NH+](Cc2ccco2)C[C@H](O)Cn2c3ccccc3c3ccccc32)cn1,C19376181_decoy,TRY1,Decoy,0,-7.47252,-6.21,-3.39,-4.682964005638942
CCCCN(C(=O)C[NH+](C)Cc1ccc(CC)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C19531804_decoy,TRY1,Decoy,0,-7.00401,-6.93,-1.39,-5.546298526333484
CCCCN(C(=O)C[NH+](CCC)Cc1ccccc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C19534483_decoy,TRY1,Decoy,0,-7.76381,-6.33,-1.83,-8.18406258370851
CC(C)(C)NC(=O)COc1ccccc1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1Cl,C20872428_decoy,TRY1,Decoy,0,-8.74833,-6.4,-1.84,-9.255261480136644
COc1cccc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2)c1OCC(=O)NC(C)(C)C,C20872667_decoy,TRY1,Decoy,0,-7.31242,-6.82,-2.48,-6.929866069516736
O=C(CN1CC[NH+](CC(=O)Nc2ccccc2)CC1)NC(=O)NCCC1=CCCCC1,C23664563_decoy,TRY1,Decoy,0,-8.42059,-8.51,-1.42,-7.034274780313639
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)Cc1ccccc1OC(F)(F)F,C25534147_decoy,TRY1,Decoy,0,-9.18218,-6.87,-1.98,-6.208707925249846
CCOc1ccccc1N1CC[NH+](Cc2nc(N)nc(Nc3ccccc3OC)n2)CC1,C26465541_decoy,TRY1,Decoy,0,-7.57107,-7.95,-2.6,-6.61658155145949
O=C(CNC(=O)CNC(=O)c1ccc(Cl)cc1Cl)NC[C@@H](c1cccs1)[NH+]1CCCC1,C27607508_decoy,TRY1,Decoy,0,-9.9354,-6.0,-1.31,-6.26427586041267
COc1ccc(-c2nc(NCC[NH+](C)C)nc3nn(-c4ccc(OC)cc4)c(N)c23)cc1,C35929246_decoy,TRY1,Decoy,0,-9.0552,-6.54,-0.81,-6.14019588187304
CCC[NH+]1CCc2c(sc(NC(=O)/C=C/c3ccc(OC)c(OC)c3)c2C(N)=O)C1,C36629375_decoy,TRY1,Decoy,0,-10.3905,-6.84,-1.99,-9.0263028385652
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)C[NH+](CCC)CCC)c(=O)[nH]c1=O,C36744636_decoy,TRY1,Decoy,0,-7.26814,-5.05,-0.77,-5.429432839355212
CCCC[NH+](C)CCCNC(=O)[C@@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)cc1,C03670384_decoy,TRY1,Decoy,0,-9.14791,-8.06,-1.94,-9.710073775150038
COc1ccc(NC(=O)c2c(NC(=O)C[NH2+]CC(C)C)sc3c2CCC3)c(OC)c1,C12382289_decoy,TRY1,Decoy,0,-7.9521,-6.33,-2.15,-7.284543551211488
c1ccc(N2CC[NH+](CC[C@H]3NN[C@H](SCCc4c[nH]c5ccccc45)O3)CC2)cc1,C39201029_decoy,TRY1,Decoy,0,-10.0891,-8.03,-2.5,-7.339768286715524
c1ccc(N2CC[NH+](CC[C@@H]3NN[C@@H](SCCc4c[nH]c5ccccc45)O3)CC2)cc1,C39201031_decoy,TRY1,Decoy,0,-10.3159,-8.08,-1.37,-6.780055148503417
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH2+]C[C@H](c2c[nH]c3ccccc23)[C@@H]2CC=CS2)c1C,C39727274_decoy,TRY1,Decoy,0,-8.67947,-8.45,-1.82,-8.829993468679266
CCOc1cc(C[NH2+]CCNCCO)cc(Cl)c1OCc1ccc(F)cc1Cl,C40720528_decoy,TRY1,Decoy,0,-9.59225,-5.76,-2.79,-5.9042416889204885
CCOc1cc(C[NH2+]CCNCCO)cc(Cl)c1OCc1c(F)cccc1Cl,C40720536_decoy,TRY1,Decoy,0,-8.22855,-5.93,-2.75,-5.301192690255795
CCOc1c(Br)cc(C[NH2+]CCCS(N)(=O)=O)cc1Br,C45069351_decoy,TRY1,Decoy,0,-8.29899,-4.97,-1.58,-5.179237330517605
CCOc1c(Br)cc(Br)cc1C[NH2+]CCCS(N)(=O)=O,C45069421_decoy,TRY1,Decoy,0,-9.03892,-5.51,-2.26,-7.947577112898895
COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)[NH+]2CCCCC2)cc1,C57366492_decoy,TRY1,Decoy,0,-9.19061,-7.44,-0.77,-6.649443898548826
CCNC(=O)NC(=O)CNc1cc(S(=O)(=O)N(CC)CC)ccc1[NH+](CC)CC,C15318992_decoy,TRY1,Decoy,0,-7.48568,-6.47,-2.97,-8.062106564228824
O=C(NCCNc1ncc(Cl)cc1Cl)NC[C@H](c1cccs1)[NH+]1CCCC1,C59264560_decoy,TRY1,Decoy,0,-9.66024,-6.72,-3.63,-6.597452852744327
O=C(NCCNc1ncc(Cl)cc1Cl)NC[C@@H](c1cccs1)[NH+]1CCCC1,C59264562_decoy,TRY1,Decoy,0,-9.71686,-6.55,-2.06,-6.095703484099959
CCOc1ccc(-c2nc(CC(=O)Nc3ccccc3C[NH+]3CCC[C@@H](C(N)=O)C3)cs2)cc1,C60331545_decoy,TRY1,Decoy,0,-8.31989,-6.77,-1.44,-5.943857873129116
CC(=O)Nc1ccc(C(=O)/N=C(/NCCC2=c3ccccc3=[NH+]C2)Nc2cccc(C)c2C)cc1,C63589375_decoy,TRY1,Decoy,0,-9.38965,-8.32,-2.16,-12.173585677391811
C[C@@H](CNC(=O)[C@H]1NNC2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363325_decoy2,TRY1,Decoy,0,-9.05408,-6.46,,-5.953780123897977
C[C@H](CNC(=O)[C@H]1NNC2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363326_decoy2,TRY1,Decoy,0,-9.04512,-6.55,,-6.618737135429049
C[C@H](CNC(=O)[C@@H]1NNC2=C1CCC2)Oc1cccc(C[NH+](C)Cc2cscn2)c1,C39363328_decoy2,TRY1,Decoy,0,-8.7603,-7.01,,-7.386854155256479
CCOC(=O)C1=C(CS[C@@H]2NN=C(C3=c4ccccc4=[NH+]C3)O2)NC(=O)N[C@H]1CC,C64055385_decoy,TRY1,Decoy,0,-8.15398,-7.61,-4.31,-6.356356818118204
CCOC(=O)C1=C(CS[C@H]2NN=C(C3=c4ccccc4=[NH+]C3)O2)NC(=O)N[C@H]1CC,C64055387_decoy,TRY1,Decoy,0,-7.30167,-5.61,-0.72,-4.794591823137496
CC[NH+]1CCc2c(sc(NC(=O)c3cc(Cl)sc3Cl)c2C(N)=O)C1,C04087188_decoy,TRY1,Decoy,0,-8.79182,-5.92,-1.63,-5.496420882181991
Cc1cc(Cl)cc(Br)c1OC[C@@H](O)C[NH+]1CCC(C(N)=O)CC1,C04324459_decoy,TRY1,Decoy,0,-8.54173,-5.05,-2.17,-5.685378116010287
CC[NH+](CC)CCNc1nc(N)c2nc(-c3ccccc3)c(-c3ccccc3)nc2n1,C01651985_decoy,TRY1,Decoy,0,-8.5938,-5.19,-3.62,-5.270333446096903
CC[NH+]1CCC[C@@H](Nc2cc(C)nc(Nc3nc4cc(Cl)c(Cl)cc4[nH]3)n2)C1,C05053205_decoy,TRY1,Decoy,0,-10.3601,-5.78,-1.08,-6.112971606733415
CCC[NH+]1CCc2c(sc(NC(=O)CSc3ccc(F)cc3)c2C(N)=O)C1,C05192493_decoy,TRY1,Decoy,0,-8.80518,-6.03,-2.2,-5.88069754232403
CCCCCNC(=O)C[NH+]1CC[C@]2(O)CCCC[C@@H]2[C@@H]1c1ccc(O)c(OC)c1,C06264164_decoy,TRY1,Decoy,0,-7.88865,-5.31,-1.62,-5.553108486071456
CC[C@]1(C)Cc2c(sc3c2[C@@H]([NH3+])N=C(SCC(=O)N2CCCCC2)N3)CO1,C06603601_decoy,TRY1,Decoy,0,-9.40882,-6.95,-4.01,-5.970546989121363
CC[C@@]1(C)Cc2c(sc3c2[C@@H]([NH3+])N=C(SCC(=O)N2CCCCC2)N3)CO1,C06603995_decoy,TRY1,Decoy,0,-8.40899,-7.53,-2.31,-5.786658664779375
CSc1ccc(C[NH+](C)CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1,C08092358_decoy,TRY1,Decoy,0,-10.7708,-4.52,-2.79,-6.412850804254024
COc1ccc([C@@H]2[C@H](O)/C(=C3\C=Nc4ccccc43)NN2C(=O)C[NH2+]C(C)C)cc1,C08735628_decoy,TRY1,Decoy,0,-8.22238,-7.14,-0.62,-5.874385076658672
Cc1ccc(SCCCC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C)C3)cc1,C09472921_decoy,TRY1,Decoy,0,-9.21622,-6.88,-2.12,-6.229688404887496
CC(=O)NC1(c2ccc(F)cc2)CC[NH+](Cc2cc(Cl)c(C)c(C)c2N)CC1,C12293084_decoy,TRY1,Decoy,0,-8.32342,-5.86,-1.7,-5.045703614123632
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4cccc5ccccc45)c3)cc12,C14957850_decoy,TRY1,Decoy,0,-8.71154,-5.33,-1.87,-5.105676771103336
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(Cl)c(Cl)c4)c3)cc12,C14961672_decoy,TRY1,Decoy,0,-9.79155,-6.17,-2.48,-5.950811042993909
COc1ccc2c([C@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3ccccc3O4)c[nH]c2c1,C19563122_decoy,TRY1,Decoy,0,-8.84367,-6.5,-1.46,-5.33395884178755
Cc1cccc2c(Nc3ccc(S(N)(=O)=O)cc3)c3ccc([N+](=O)[O-])cc3[nH+]c12,C04815438_decoy,TRY1,Decoy,0,-7.52495,-7.81,-1.2,-6.909802692016338
C=CCSC1=[NH+]C(C)(C)C[C@]2(C[C@@H](c3ccccc3)c3ccc(O)c(O)c3O2)N1,C05823723_decoy,TRY1,Decoy,0,-7.88465,-5.62,-1.67,-5.1240054492082585
C=CCSC1=[NH+]C(C)(C)C[C@@]2(C[C@H](c3ccccc3)c3ccc(O)c(O)c3O2)N1,C05823673_decoy,TRY1,Decoy,0,-8.85792,-6.48,-2.32,-5.986622754152477
CNC(=O)[C@H]1/C(=N/Nc2ccc(Cl)cc2)C[NH+](C2CCCCC2)[C@H]1C(=O)NC,C32106018_decoy,TRY1,Decoy,0,-8.58708,-5.69,-1.39,-5.428843512080904
Cc1ccc(O[C@H](C)C(=O)NNC(=S)[NH+]=c2ccc3c(C)cc(O)oc-3c2)cc1,C32579238_decoy,TRY1,Decoy,0,-7.97111,-6.55,-2.08,-5.445269246533568
Cc1cc(O)oc2cc(=[NH+]C(=S)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc1-2,C32579244_decoy,TRY1,Decoy,0,-8.45923,-8.75,-3.78,-5.976894443904872
[NH3+]C1(CNS(=O)(=O)c2cc(Br)ccc2Br)CCCCC1,C36266626_decoy,TRY1,Decoy,0,-8.65706,-4.97,-0.84,-5.874331991682419
CC(C)C[C@@H]([NH3+])CNS(=O)(=O)c1cc(Br)sc1Br,C36298963_decoy,TRY1,Decoy,0,-9.88135,-5.45,-2.83,-5.957124219465914
NC(=O)COc1c(Br)cc(C[NH2+]C2CCCCCCC2)cc1Br,C36612883_decoy,TRY1,Decoy,0,-8.91965,-5.83,-2.99,-5.458882757760256
Nc1c2c(-c3cccs3)nc(NCC[NH+]3CCCC3)nc2nn1-c1ccccc1,C37358250_decoy,TRY1,Decoy,0,-8.32984,-5.79,-1.53,-6.046022852441308
Cn1nc2nc(NCC[NH+]3CCCCC3)nc(-c3ccc(F)c(Cl)c3)c2c1N,C37360924_decoy,TRY1,Decoy,0,-8.95651,-8.32,-2.54,-8.290892933186424
COc1ccc(N2NC=C([C@@H](C)[NH2+]Cc3[nH]c4ccc(OC)cc4c3C)[C@H]2C)cc1,C39387784_decoy,TRY1,Decoy,0,-7.49017,-6.37,-1.97,-6.024433896314296
Cc1n[nH]c(=O)c2c1[C@@H](C)O[C@H]2NC(=O)C[NH2+]C(c1ccccc1)c1ccccc1,C39454544_decoy,TRY1,Decoy,0,-7.9883,-7.73,-1.64,-7.7360028498898545
C=CC[NH+]1[C@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@H]1c1ccc(C)c(C)c1,C39744823_decoy,TRY1,Decoy,0,-7.50516,-6.11,-1.63,-4.399717548155279
CC1(C)C[C@H]([NH2+]CC2CCCCC2)[C@@]2(CCC(=O)NC3CC3)CC[C@](C)(O)C[C@@H]12,C12531687_decoy,TRY1,Decoy,0,-9.06214,-5.55,-1.49,-5.921658673082447
O=C(NCCCNc1cccc[nH+]1)Nc1cc(C(F)(F)F)ccc1-n1cccn1,C40145979_decoy,TRY1,Decoy,0,-7.09011,-7.99,-2.16,-6.431225140002801
COc1cc(OC)c(Nc2[nH+]cnc(N3CCCc4ccccc43)c2N)cc1Cl,C40780304_decoy,TRY1,Decoy,0,-7.08805,-5.49,-1.81,-4.365649006268874
Nc1c(Nc2ncc(C(F)(F)F)cc2Cl)nc[nH+]c1N1CCCc2ccccc21,C40780431_decoy,TRY1,Decoy,0,-7.40325,-6.7,-2.7,-4.740166450559241
Cc1cccc2sc(Nc3ncnc(N4CCN(c5cccc[nH+]5)CC4)c3N)nc12,C40783513_decoy,TRY1,Decoy,0,-8.80767,-6.76,-1.56,-5.610145597127956
Cc1nn(-c2cc(Cl)cc(CCC[NH3+])c2)c2cc(N[C@@H](C)c3ccccc3)ncc12,C40973378_decoy,TRY1,Decoy,0,-9.47254,-8.0,-2.57,-7.29036142914916
CC[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)cs1,C43227058_decoy,TRY1,Decoy,0,-10.532,-8.77,-2.96,-6.982883142134004
C=C1CCC[C@@]2(C)C[C@H]3OC(=O)[C@H](C[NH2+]CCc4c[nH]c5ccc(O)cc45)[C@H]3C[C@@H]12,C43741126_decoy,TRY1,Decoy,0,-8.32597,-8.6,-1.72,-8.841066557982861
CC(C)(C)c1cc([C@@H]2CSC[C@@H](C(=O)NCc3ccco3)[NH2+]2)cc(C(C)(C)C)c1O,C44169153_decoy,TRY1,Decoy,0,-7.72895,-6.55,-5.11,-4.6905200352665455
Cn1nc(C(F)(F)F)c(C[C@H]([NH3+])CO)c1Sc1ccc(Br)cc1,C44465461_decoy,TRY1,Decoy,0,-8.34751,-4.63,-2.75,-5.879649860526077
CC(C)(C)C[NH2+]CC(C)(C)c1nc(-c2ccc(Cl)c(O)c2)c(-c2ccncc2)[nH]1,C45323888_decoy,TRY1,Decoy,0,-9.51644,-6.65,-0.96,-6.218084297644058
CC[C@@]1(C)NC(=O)N(NC(=O)C[NH2+][C@@H](c2ccc(F)cc2)c2cccs2)C1=O,C46568350_decoy,TRY1,Decoy,0,-9.00498,-6.05,-2.26,-7.286893636505726
CC[C@]1(C)NC(=O)N(NC(=O)C[NH2+][C@H](c2ccc(F)cc2)c2cccs2)C1=O,C46568355_decoy,TRY1,Decoy,0,-9.61137,-7.03,-2.16,-8.077508121868776
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4csc5ccccc45)CC34CC[NH2+]CC4)[nH]c2c1,C39695833_decoy,TRY1,Decoy,0,-8.87163,-7.75,-1.77,-6.271992964473079
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4csc5ccccc45)CC34CC[NH2+]CC4)[nH]c2c1,C44737493_decoy,TRY1,Decoy,0,-9.14341,-8.25,-1.75,-7.635432355242811
O=C(CNc1ccccc1[NH+]1CCC(O)CC1)Nc1ccccc1Br,C55888288_decoy,TRY1,Decoy,0,-7.21896,-6.63,-3.14,-6.7051884225524985
NC1=[NH+]c2nc3ccccc3n2[C@@H](c2ccc(OCc3cn4ccccc4n3)cc2)N1,C15502208_decoy,TRY1,Decoy,0,-9.00535,-8.24,-2.46,-5.859803845370438
C=C(C)CNC(=S)NNC1=NC(=O)[C@@H]2C(=[NH+]1)c1ccccc1CC21CCCCC1,C63393960_decoy,TRY1,Decoy,0,-8.5959,-5.55,-1.95,-5.849103300866531
CCCCn1c(=S)[nH]c([O-])c([C@H]2[NH2+]CCC3=c4cc(Cl)ccc4=[NH+][C@H]32)c1=O,C64416617_decoy,TRY1,Decoy,0,-7.76289,-5.46,-1.7,-5.386874497950744
C=C1C=C([O-])N2C(=NC(NCCC3=c4ccccc4=[NH+]C3)=[NH+][C@@H]2c2ccc(C)cc2)N1,C64480175_decoy,TRY1,Decoy,0,-7.75943,-9.22,-2.25,-9.574497763121313
CCNc1nc(Nc2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)cc(C)[nH+]1,C64814502_decoy,TRY1,Decoy,0,-7.99967,-7.35,-1.89,-5.631408242785984
C[C@]12CCCC[C@H]1CC[C@H]1[C@H]3CC[C@@](O)(C[NH2+]CCO)[C@@]3(C)CC[C@@H]12,C04011477_decoy,TRY1,Decoy,0,-8.61015,-6.78,-2.25,-5.494740174672891
CC1(C)CC(NC(=S)Nc2ccc(F)c(Cl)c2)CC(C)(C)[NH2+]1,C04506742_decoy,TRY1,Decoy,0,-8.58582,-5.59,-1.14,-5.104553474484585
CC(C)[NH+]1CCc2c(sc3c2C(O)=N[C@@H](c2cccc(O)c2)N3)C1,C04554101_decoy,TRY1,Decoy,0,-8.45617,-6.76,-1.87,-5.032458687093441
Cc1c(Cl)cccc1NC(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C04682539_decoy,TRY1,Decoy,0,-7.75704,-5.03,-2.84,-4.497586024911018
Cc1cc[nH+]c(N[C@@H](c2ccccc2O)c2ccc3cccnc3c2O)c1,C13060151_decoy,TRY1,Decoy,0,-8.40413,-7.68,-1.02,-6.317021849464092
C=C(Br)CSC1=Nc2sc3c(c2[C@@H]([NH3+])N1)CCCC3,C27833434_decoy,TRY1,Decoy,0,-10.243,-6.26,-0.8,-5.850989121903055
CC(C)(C)[C@@H]1CCc2c(sc3nc(C[NH2+]CCO)[nH]c(=O)c23)C1,C31934545_decoy,TRY1,Decoy,0,-8.15644,-5.6,-0.91,-5.275353609368645
COC(=O)c1c(NC(=O)CC[NH3+])sc2c1CC[C@@H](C(C)(C)C)C2,C33521149_decoy,TRY1,Decoy,0,-9.17903,-6.29,-0.76,-9.643049756658083
[NH3+][C@@H](c1ccc(Cl)c(Cl)c1)c1cc2c(cc1Cl)NC(=O)C2,C35359422_decoy,TRY1,Decoy,0,-7.9664,-5.35,-0.61,-4.389767161819949
[NH3+][C@@H](c1cc2c(cc1Cl)NC(=O)C2)c1c(Cl)cccc1Cl,C35359495_decoy,TRY1,Decoy,0,-6.7721,-5.64,-1.4,-3.9193899274183406
O=C(N[C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(Br)c[nH]1,C36260939_decoy,TRY1,Decoy,0,-8.21024,-6.63,0.44,-5.051060891622119
C[C@H](Nc1c(N)c[nH+]c2ccc(Br)cc12)[C@@H]1CCCO1,C36813156_decoy,TRY1,Decoy,0,-6.71059,-5.09,-0.56,-3.9520810384050566
C[C@@H](Nc1c(N)c[nH+]c2ccc(Br)cc12)[C@H]1CCCO1,C36813159_decoy,TRY1,Decoy,0,-7.18411,-4.69,-0.71,-3.872930697262512
C[C@H](Nc1c(N)c[nH+]c2ccc(Br)cc12)c1cccs1,C36813160_decoy,TRY1,Decoy,0,-7.18066,-7.61,-0.5,-9.62300931419869
C[C@H]([NH2+][C@@H](C)c1ccc(O)cc1O)c1cccc(Br)c1,C36919946_decoy,TRY1,Decoy,0,-7.75586,-7.7,-2.59,-7.697783100298995
CC[C@H]([NH2+][C@@H]1CCCCNC1=O)c1cc(Br)ccc1O,C36977301_decoy,TRY1,Decoy,0,-7.47105,-6.27,-3.16,-6.464685913690275
[NH3+][C@@H](c1cc(F)cc(Br)c1)c1ccc2c(c1)CCC(=O)N2,C37034257_decoy,TRY1,Decoy,0,-8.08512,-8.14,-0.67,-10.080778233598071
C[C@H]([NH2+]C1CCC(C(N)=O)CC1)c1ccc(Cl)c(Cl)c1Cl,C37319412_decoy,TRY1,Decoy,0,-7.72974,-6.91,-2.91,-5.049017546108459
CC[C@H](C)NS(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl,C37580506_decoy,TRY1,Decoy,0,-8.86858,-4.84,-4.19,-5.1941100021027
CC[C@@H](C)[NH2+][C@](C)(C(N)=O)c1cc2cc(Br)ccc2o1,C38065596_decoy,TRY1,Decoy,0,-7.60626,-5.77,-1.77,-5.240229984127273
CC1=C[C@H](C(=O)N/N=C/c2ccc(I)o2)N[NH2+]1,C38990150_decoy,TRY1,Decoy,0,-7.76208,-4.71,-2.53,-4.461237496539582
Nc1c(NC23CC4CC(CC(C4)C2)C3)nc[nH+]c1N1CCc2ccccc21,C40687329_decoy,TRY1,Decoy,0,-7.24123,-5.5,-1.75,-4.999055920526374
CC1(C)C[C@H]2C[C@](C)(CN2c2ncnc(Nc3cc[nH+]cc3)c2N)C1,C40687539_decoy,TRY1,Decoy,0,-7.02801,-7.91,-2.78,-7.534906621342257
CC1(C)C[C@H]2C[C@](C)(CN2c2nc[nH+]c(Nc3cccnc3)c2N)C1,C40734831_decoy,TRY1,Decoy,0,-7.51973,-5.24,-0.56,-4.729986806610133
CC1(C)CC(NC(=O)[C@@]2(C)Oc3ccccc3NC2=O)CC(C)(C)[NH2+]1,C41546675_decoy,TRY1,Decoy,0,-7.45193,-6.67,-0.64,-5.3464248100063685
CC[C@H]([NH3+])[C@H](Sc1nc(C)n[nH]1)c1ccccc1Br,C43096519_decoy,TRY1,Decoy,0,-8.02824,-4.34,-1.97,-4.445179564857333
CC(=O)Nc1ccc(S[C@H](c2ccc(Cl)s2)[C@@H](C)[NH3+])cc1,C43257324_decoy,TRY1,Decoy,0,-10.9174,-5.73,-1.98,-6.827036872427311
C[C@@]12CCCC[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@@H]1CC[C@]2(O)C[NH2+]CCO,C43736426_decoy,TRY1,Decoy,0,-8.89734,-7.67,-1.7,-5.851980521706912
C[C@@]12CC[C@H]3[C@H](CC[C@@H]4C[C@@H](O)CC[C@]43C)[C@H]1CC[C@@H]2[NH2+]CCO,C43737407_decoy,TRY1,Decoy,0,-8.16229,-6.89,-1.69,-5.50122525030732
Cc1ccc(N(c2ccc(C)cc2)c2ccc([C@@H]([NH3+])CCO)cc2)cc1,C44233525_decoy,TRY1,Decoy,0,-9.54486,-5.65,-1.23,-8.044951189887746
CC[C@@H](C)/[NH+]=C(\N)SCc1nc2sc3c(c2c(=O)[nH]1)CCC3,C19672143_decoy,TRY1,Decoy,0,-8.57948,-6.37,-1.71,-5.7308433225850655
C[C@H](Nc1c(N)c[nH+]c2ccc(Br)cc12)C(=O)N(C)C,C49096523_decoy,TRY1,Decoy,0,-5.84653,-5.36,-1.27,-3.8600400227595046
C[C@H](Cc1ccco1)Nc1c(N)c[nH+]c2ccc(Br)cc12,C49128376_decoy,TRY1,Decoy,0,-6.81025,-5.68,-0.84,-4.393512691307156
C[C@@H]([NH2+][C@H](C)c1ccc(O)cc1O)c1ccc(Br)cc1,C49514636_decoy,TRY1,Decoy,0,-7.98116,-7.65,-1.92,-8.521921921988918
[NH3+][C@@H]1C[C@H]1C(=O)Nc1c(Br)cc(Br)cc1Br,C50458120_decoy,TRY1,Decoy,0,-8.78892,-4.93,-1.49,-5.434336732478753
CC[C@H]([NH3+])[C@@H](Sc1ncnc2nc[nH]c12)c1ccc(Cl)s1,C51036050_decoy,TRY1,Decoy,0,-8.6207,-6.32,-0.06,-7.411642403331151
CC[NH2+][C@@H](c1cc2[nH]c(=O)[nH]c2cc1Br)C1CCCC1,C52094627_decoy,TRY1,Decoy,0,-7.1465,-4.27,-1.53,-4.972119348273909
C[C@](O)(COc1c(Br)cccc1C[NH3+])c1ccccc1,C52096906_decoy,TRY1,Decoy,0,-9.5187,-5.07,-2.1,-5.727210376601675
Cc1cc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)c(C)n1C1CCCCC1,C12520623_decoy,TRY1,Decoy,0,-7.90017,-5.63,-2.18,-4.210974345577671
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccc(-c3cccs3)cc2F)N1,C48367225_decoy,TRY1,Decoy,0,-8.04269,-5.86,-0.95,-5.237331070719202
Cc1cc(C)c(NC(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(Cl)c1,C07325671_decoy,TRY1,Decoy,0,-8.23838,-5.52,-2.29,-4.841075018020504
Cc1cc(C)cc(/[NH+]=c2/oc3c(C)ncc(CO)c3cc2C(N)=O)c1,C12338885_decoy,TRY1,Decoy,0,-6.88815,-7.33,-1.93,-5.253679058790158
Cc1cccc(C(C)C)c1NC(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C59112074_decoy,TRY1,Decoy,0,-7.86798,-5.79,-2.08,-5.198290855368153
CCC[NH2+][C@@H](c1cc2[nH]c(=O)[nH]c2cc1Br)C(C)(C)C,C52094699_decoy,TRY1,Decoy,0,-7.67299,-4.43,-0.69,-4.712685447705936
C[NH2+][C@@H](c1cc2[nH]c(=O)[nH]c2cc1Br)[C@H]1CCCOC1,C62235144_decoy,TRY1,Decoy,0,-6.33962,-4.91,0.39,-4.499612645782158
C[NH2+][C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)[C@H]1CCCOC1,C62235146_decoy,TRY1,Decoy,0,-7.64388,-5.31,-1.69,-5.055946846957842
C[NH2+][C@H](c1cscn1)c1cc2[nH]c(=O)[nH]c2cc1Br,C62357130_decoy,TRY1,Decoy,0,-7.83877,-4.33,-0.34,-4.4775413978231065
CCOc1cc(Br)c([C@H]([NH3+])c2cn[nH]c2)cc1OCC,C62776035_decoy,TRY1,Decoy,0,-6.70068,-6.2,-4.47,-6.230879215562501
N/C(NCC1(c2c(F)cccc2F)CCCC1)=[NH+]\C[C@H]1CCCO1,C66244396_decoy,TRY1,Decoy,0,-7.87481,-5.29,-1.95,-4.946762352077965
Oc1ccc(C[NH2+]CCCc2cccc(Br)c2)c(O)c1,C66594412_decoy,TRY1,Decoy,0,-7.86225,-7.65,-0.72,-12.119027990087153
CCCCCn1c(-c2ccc(OCC(C)C)c(OCC)c2)nc2c1c(=O)[nH]c(=O)n2CCCC,C12539940_decoy,TRY1,Decoy,0,-8.50762,-6.39,-2.73,-6.966665145287803
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccccc2)[C@H]1c1ccc(C(C)C)cc1,C19923353_decoy,TRY1,Decoy,0,-7.24883,-5.58,-3.47,-5.357734032511063
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccccc2)[C@H]1c1ccc(Br)cc1,C25180986_decoy,TRY1,Decoy,0,-8.30283,-6.55,-3.91,-7.35818939224376
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(Cl)cc2)[C@@H]1c1ccco1,C25181399_decoy,TRY1,Decoy,0,-8.36745,-6.7,-3.82,-7.309776332391204
CCCCOc1ccc([C@@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2CCC[NH+](CC)CC)cc1,C33701616_decoy,TRY1,Decoy,0,-7.67874,-5.6,-2.42,-5.95092673083986
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@H]2c2ccc(OCCC)cc2)c(C)c1,C34917641_decoy,TRY1,Decoy,0,-8.22058,-4.94,-2.81,-5.423751961533961
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@H]2c2ccc(OCCCC)cc2)c(C)c1,C34918165_decoy,TRY1,Decoy,0,-7.8125,-6.99,-1.42,-6.720325970095301
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC)cc3)=C([O-])C(=O)N2CC[NH+](CC)CC)cc1,C34919880_decoy,TRY1,Decoy,0,-8.78177,-4.86,-2.47,-5.995594004779514
CCCCNC(=O)[C@@H](c1ccc([N+](=O)[O-])cc1)N(C(=O)[C@H](CC)CCCC)c1cccc(Cl)c1,C36482422_decoy,TRY1,Decoy,0,-8.48567,-5.42,-2.54,-6.452154760005086
CCCCC/C=C\C(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccccc1C,C36495917_decoy,TRY1,Decoy,0,-8.14402,-5.11,-2.86,-5.891449423049297
CCCC[C@@H](CC)C(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)C(CC)CC,C36496534_decoy,TRY1,Decoy,0,-7.95612,-5.48,-3.29,-8.558849276929068
CCCCCC(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc([N+](=O)[O-])cc1,C36504178_decoy,TRY1,Decoy,0,-7.39152,-6.02,-1.97,-5.765524928539596
CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(CCCCCC)C(=O)Cc1ccccc1C,C36509199_decoy,TRY1,Decoy,0,-9.00165,-6.59,-3.52,-7.417736796913817
CCCCC/C=C\C(=O)N(CCCCCC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccco1,C36510131_decoy,TRY1,Decoy,0,-9.06643,-7.27,-3.73,-8.032649390802806
CCCCC/C=C\C(=O)N(CCCCCC)[C@@H](C(=O)NC(C)(C)C)c1ccc([N+](=O)[O-])cc1,C36510179_decoy,TRY1,Decoy,0,-7.15946,-4.82,-2.97,-5.29958766949651
CCCCCCN(C(=O)[C@H](CC)CCCC)[C@@H](C(=O)NCCCC)c1ccc2c(c1)OCO2,C36510803_decoy,TRY1,Decoy,0,-8.36314,-4.85,-3.33,-6.974620928367006
CCCCCCN(C(=O)C[C@H](C)c1ccccc1)[C@H](C(=O)NCCCC)c1ccc([N+](=O)[O-])cc1,C36515910_decoy,TRY1,Decoy,0,-8.56426,-5.53,-2.05,-6.046276584003079
C/C=C\[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(CCCCCC)C(=O)Cc1ccc2c(c1)OCO2,C36516200_decoy,TRY1,Decoy,0,-8.56084,-6.35,-2.15,-8.110782862137748
C/C=C/[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(CCCCCC)C(=O)Cc1ccc2c(c1)OCO2,C36516201_decoy,TRY1,Decoy,0,-7.84296,-6.37,-3.04,-5.702577943434711
CCCCCCN(C(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C(=O)NCCCC)c1ccc(C(F)(F)F)cc1,C36522001_decoy,TRY1,Decoy,0,-7.31213,-4.88,-3.69,-5.447514597073632
CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(Cc1ccc(C)o1)C(=O)/C=C/CCCCC,C36557489_decoy,TRY1,Decoy,0,-9.00839,-6.89,-4.32,-7.343199637749982
CCCCNC(=O)[C@H](c1ccc(Cl)cc1)N(Cc1ccc(C)o1)C(=O)[C@H](CC)CCCC,C36558266_decoy,TRY1,Decoy,0,-8.18384,-5.35,-2.7,-7.694563810397079
CCCCC/C=C\C(=O)N(CCC)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(C)cc1C,C36563062_decoy,TRY1,Decoy,0,-9.52931,-7.5,-2.53,-7.454323937574392
CCCCC/C=C\C(=O)N([C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc(N(C)C)cc1)C(C)(C)C,C36582310_decoy,TRY1,Decoy,0,-9.47211,-7.29,-3.89,-8.919530002129433
CCCCC[C@@H](C(=O)NCCCC)N(Cc1ccc(C)o1)C(=O)Cc1ccc(Br)cc1,C36595225_decoy,TRY1,Decoy,0,-8.99032,-5.93,-4.42,-6.911317572459437
CCCCCC(=O)N(Cc1ccc(C)o1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1cccc(OC)c1,C36600630_decoy,TRY1,Decoy,0,-7.60186,-5.89,-2.83,-7.38517439490919
C=CCOc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCC[NH+](CCCC)CCCC)cc1,C40018742_decoy,TRY1,Decoy,0,-8.41494,-6.44,-2.69,-6.582733322528067
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccccc2)[C@H]1c1ccc(N(CC)CC)cc1,C40019105_decoy,TRY1,Decoy,0,-8.06637,-6.18,-4.14,-6.638293438583216
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)cc2)[C@@H]1c1sccc1C,C40019164_decoy,TRY1,Decoy,0,-8.04414,-6.42,-3.7,-6.588681566034552
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC)cc2)[C@H]1c1sccc1C,C40019321_decoy,TRY1,Decoy,0,-8.82106,-5.83,-3.83,-6.277898440256514
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC)c(C)c2)[C@@H]1c1ccc(C)o1,C40019518_decoy,TRY1,Decoy,0,-8.66606,-6.65,-4.48,-7.160918084507612
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2cc3ccccc3o2)[C@H]1c1ccccc1Cl,C40019719_decoy,TRY1,Decoy,0,-8.9949,-5.6,-2.23,-7.606066798105463
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CCCC)CCCC)[C@@H]2c2ccc(CC)cc2)cc1,C40019851_decoy,TRY1,Decoy,0,-9.04504,-5.28,-4.0,-6.291093986211313
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CCCC)CCCC)[C@@H]2c2ccccc2OC)cc1,C40019865_decoy,TRY1,Decoy,0,-8.14333,-5.37,-4.0,-6.059858625785678
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)c(F)c2)[C@@H]1c1ccc(C)cc1,C40019898_decoy,TRY1,Decoy,0,-8.85646,-7.01,-5.21,-7.040109398553295
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)c(F)c2)[C@H]1c1ccc(OCCC)cc1,C40019945_decoy,TRY1,Decoy,0,-8.90232,-6.06,-4.15,-7.055161074823091
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCC[NH+](CCCC)CCCC)cc1,C40019950_decoy,TRY1,Decoy,0,-9.0271,-6.78,-3.64,-7.30373255163509
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)c(F)c2)[C@H]1c1c(F)cccc1Cl,C40020033_decoy,TRY1,Decoy,0,-8.05125,-5.95,-2.25,-5.83907924183943
CCCC[NH+](CCCC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(C)c(F)c2)[C@@H]1c1ccc(SC)cc1,C40020052_decoy,TRY1,Decoy,0,-9.8313,-6.75,-1.56,-8.259513411667692
C=CCc1ccccc1OCCCCn1c(CCNC(=O)Cc2ccccc2Cl)nc2ccccc21,C40202778_decoy,TRY1,Decoy,0,-9.89812,-7.97,-3.36,-7.99691662353137
C=CCc1ccccc1OCCCn1c(CCCNC(=O)Cc2ccc(Cl)cc2)nc2ccccc21,C40208815_decoy,TRY1,Decoy,0,-9.48236,-7.94,-2.41,-8.033965362486805
CC(C)c1ccccc1OCCCn1c(CCCNC(=O)COc2ccc(Cl)cc2)nc2ccccc21,C40209770_decoy,TRY1,Decoy,0,-9.3598,-8.0,-2.55,-8.018467707832485
C=CCc1ccccc1OCCn1c(CCCCCNC(=O)Cc2ccccc2Cl)nc2ccccc21,C40221462_decoy,TRY1,Decoy,0,-9.82665,-8.05,-4.27,-8.125284864975594
Cc1ccccc1OCCCCn1c(CCCCCNC(=O)Cc2ccccc2Cl)nc2ccccc21,C40221541_decoy,TRY1,Decoy,0,-9.16592,-8.08,-1.57,-8.035432995961644
C=CCn1c(COc2ccc(CCC)cc2)nnc1SCC(=O)Nc1c(CC)cccc1CC,C40978153_decoy,TRY1,Decoy,0,-9.14945,-8.16,-3.72,-7.419623373167547
C=CCOC(=O)C1=C(C)Nc2nc(SCCC)nn2[C@H]1c1ccc(OCCCC)c(OC)c1,C40982660_decoy,TRY1,Decoy,0,-8.2906,-6.03,-5.04,-6.472412122789043
C=CCOC(=O)C1=C(C)Nc2nc(SCCC)nn2[C@@H]1c1ccc(OCCCCC)cc1,C40982703_decoy,TRY1,Decoy,0,-8.80299,-5.64,-3.59,-6.705216004292686
CCCCCCOc1ccc([C@@H]2C(C(=O)OC)=C(C)Nc3nc(SCCCC)nn32)cc1,C41000505_decoy,TRY1,Decoy,0,-8.98193,-4.59,-3.77,-5.452956918934486
C=CCOC(=O)C1=C(C)Nc2nc(SCCCC)nn2[C@@H]1c1ccc(OCC)c(OCC)c1,C41000599_decoy,TRY1,Decoy,0,-9.55054,-5.55,-1.46,-8.641564459570137
CCCCOC(=O)C1=C(C)Nc2nc(SCCCC)nn2[C@@H]1c1ccc(OCc2ccccc2F)cc1,C41001575_decoy,TRY1,Decoy,0,-10.0818,-7.01,-1.63,-7.569225775507243
Cc1ccc(N(C[C@H](O)[C@@H](O)[C@H](O)C(O)O)/N=N/c2ccc([N+](=O)[O-])cc2)cc1C,C04142281_decoy,TRY1,Decoy,0,-7.48532,-8.18,-3.91,-7.840468654913755
CC[C@@H](C(=O)NCCC(C)C)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C04161186_decoy,TRY1,Decoy,0,-7.34837,-6.82,-1.54,-8.162068301410095
CC(C)OC(=O)NN(C(=O)OC(C)C)[C@@H]1C=C(C(=O)NCC(N)=O)C[C@@H](O)[C@H]1O,C04221650_decoy,TRY1,Decoy,0,-8.4205,-6.2,-3.14,-6.4494690100414935
COc1cc2[nH+]c3cc([N+](=O)[O-])ccc3c(NCC[NH2+]CC(C)(C)O)c2cc1OC,C04748027_decoy,TRY1,Decoy,0,-8.24626,-7.45,-2.6,-7.133183376796367
O=C(Cn1cc(I)c(C(=O)NC[C@@H](O)CO)n1)NC[C@H](O)CO,C01634740_decoy,TRY1,Decoy,0,-8.61098,-5.69,-4.02,-5.976363865774349
CC(C)(C)NC(=O)[C@@H](c1ccco1)N(CCCO)C(=O)c1snc(C(N)=O)c1N,C06074622_decoy,TRY1,Decoy,0,-8.28321,-6.74,-3.46,-8.434839903865477
CCOC(=O)CNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C06546735_decoy,TRY1,Decoy,0,-7.5948,-7.42,-3.63,-7.5342932420968065
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCOC)c2ccc(O)cc2)cc1,C06601052_decoy,TRY1,Decoy,0,-8.31126,-5.63,-2.38,-6.215657762321476
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](CC)C(=O)NC(C)(C)C,C06631697_decoy,TRY1,Decoy,0,-7.38246,-6.83,-2.01,-8.130155678765352
CCCc1c(C(=O)N/N=C(\C)c2ccc(OCC(N)=O)cc2)nnn1-c1nonc1N,C09307842_decoy,TRY1,Decoy,0,-9.27679,-7.25,-4.37,-6.741263752836503
CCNc1nc(NCC)nc(N/N=C/c2ccc(-c3ccc(S(N)(=O)=O)cc3)o2)n1,C09317070_decoy,TRY1,Decoy,0,-9.73404,-7.67,-2.6,-7.15517660871044
CC(=O)N[C@H]1[C@@H](OC[C@H](O)[C@H]2O[C@H]3OC(C)(C)O[C@@H]3[C@H]2OCc2ccccc2)O[C@@H](CO)[C@@H](O)[C@@H]1O,C09974832_decoy,TRY1,Decoy,0,-6.04207,-8.74,-4.2,-6.458215299201331
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(CCCO)C(=O)c2snc(C(N)=O)c2N)cc1,C12476778_decoy,TRY1,Decoy,0,-9.16782,-4.9,-2.48,-6.000161433321916
C=C[C@H](CCCCC)O[C@H]1O[C@@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14616883_decoy,TRY1,Decoy,0,-5.05664,-6.24,-4.31,-5.729808899616648
C=C(N)N(C)CC[C@H]([NH3+])CC(=O)N[C@H]1C=C[C@H](n2ccc(N)nc2=O)O[C@@H]1C(=O)[O-],C14806386_decoy,TRY1,Decoy,0,-9.20406,-6.64,-2.92,-6.601275152077332
Cc1ccc(N(C[C@@H](O)[C@H](O)[C@@H](O)C(O)O)/N=N/c2ccc([N+](=O)[O-])cc2)cc1C,C15938551_decoy,TRY1,Decoy,0,-8.14873,-8.29,-1.65,-10.077745630857896
[NH3+]Cc1nnn(Cc2ccccc2)c1/N=C\Nc1c(C[NH3+])nnn1Cc1ccccc1,C17104645_decoy,TRY1,Decoy,0,-8.10969,-6.18,-1.74,-7.386954291305319
OC[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C19879571_decoy,TRY1,Decoy,0,-7.86371,-6.78,-2.22,-7.066149097742854
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/C=C/c3ccccc3)n2)s1,C20834155_decoy,TRY1,Decoy,0,-10.3505,-7.5,-3.96,-7.131372728354354
COc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)c1O,C20834555_decoy,TRY1,Decoy,0,-8.23402,-8.2,-2.81,-9.355352548997606
CCc1cc(C(C)=O)c(O)cc1OCc1cccc(C(=O)NC(CO)(CO)CO)n1,C28468312_decoy,TRY1,Decoy,0,-8.44886,-7.44,-1.07,-5.793930831221398
COc1ccc([C@@H]2Oc3c(OC)cc(CCCO)cc3[C@H]2CO)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31156103_decoy,TRY1,Decoy,0,-8.78349,-7.04,-3.35,-6.962545579630022
[H]/N=C1/N[P@](N(CCO)CCO)[NH+]([C@H](C)C(=O)[O-])CN1/N=C(\C)c1cccs1,C16942090_decoy,TRY1,Decoy,0,-7.3231,-4.12,-3.54,-4.842707092268725
CC(=O)O[C@@H]([C@@H](CO)OC(C)=O)[C@@H](CNc1nc(N)[nH]c(=O)c1[N+](=O)[O-])OC(C)=O,C17175127_decoy,TRY1,Decoy,0,-6.69809,-5.9,-3.36,-7.314433985301075
CCCCn1c(N)c(N(CCC(C)C)C(=O)CSc2n[nH]c(N)n2)c(=O)[nH]c1=O,C09119751_decoy,TRY1,Decoy,0,-7.62889,-7.3,-2.9,-7.733056306836497
CCCCN1C(=O)[C@H]2[C@@H](c3cc(C)ccc3C)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33703743_decoy,TRY1,Decoy,0,-8.40891,-8.07,-1.44,-11.86594604285259
CN(/N=C/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@@H](O)[C@H](O)[C@H](O)CO)c1ccccc1,C33957275_decoy,TRY1,Decoy,0,-7.88351,-7.03,-1.22,-8.519373040347523
CN(/N=C/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@@H](O)[C@@H](O)[C@H](O)CO)c1ccccc1,C33957277_decoy,TRY1,Decoy,0,-7.24705,-8.19,-1.48,-7.241000796197662
COc1cc(/C=C/CO[C@H](CO)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C35465762_decoy,TRY1,Decoy,0,-7.87668,-7.09,-2.95,-6.809162671538917
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C35653057_decoy,TRY1,Decoy,0,-5.45915,-6.97,-1.9,-5.223020157085443
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccco2)cc1,C06601001_decoy,TRY1,Decoy,0,-8.06429,-7.92,-1.08,-10.420392821515668
C[C@H](C[C@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,C31168767_decoy,TRY1,Decoy,0,-7.11585,-7.37,-1.65,-6.922716297086131
CCC[C@@H](C(=O)NC(C)(C)C)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04161170_decoy,TRY1,Decoy,0,-8.31866,-6.89,-1.2,-9.349017247034878
CCOC(=O)[C@H]1[NH+]=c2ccc(OC)cc2=C1NC(=O)CC[NH+]1CCC(C(N)=O)CC1,C38617894_decoy,TRY1,Decoy,0,-8.83444,-7.21,-1.57,-7.606936233768
COc1cc(/C=C/COC[C@@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C39560206_decoy,TRY1,Decoy,0,-6.90427,-6.53,-2.14,-5.906438548092461
COc1cc(CCC(=O)N/N=C/[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc(OC)c1OC,C39775630_decoy,TRY1,Decoy,0,-7.82621,-6.03,-3.44,-5.231722346569598
CCCCN1C(=O)[C@H]2[C@@H](c3cccs3)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33904181_decoy,TRY1,Decoy,0,-8.31133,-7.36,-3.59,-10.937341311887575
COCCn1c(N)c(C(=O)CSc2nc(C)c(CC(N)=O)s2)c(=O)[nH]c1=O,C45697731_decoy,TRY1,Decoy,0,-7.30612,-4.77,-3.55,-4.477669308430439
NC(=O)CCc1nnc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)n1C[C@@H]1CCCO1,C45842343_decoy,TRY1,Decoy,0,-7.93932,-6.6,-2.44,-6.637493938137578
COc1cc([C@@H](O)[C@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C49181385_decoy,TRY1,Decoy,0,-7.88482,-6.92,-2.77,-6.0648298679484665
COc1cc([C@@H](O)[C@@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C49181391_decoy,TRY1,Decoy,0,-7.81322,-7.12,-2.7,-6.741152585460505
CCOc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)ccc1Oc1nnnn1-c1ccccc1,C22937067_decoy,TRY1,Decoy,0,-6.83453,-6.57,-2.99,-5.974119047280386
CCOc1cc(C[NH2+]CC[NH2+]C[C@H](C)O)ccc1Oc1nnnn1-c1ccccc1,C22937070_decoy,TRY1,Decoy,0,-7.24902,-6.0,-1.38,-5.985436228559242
COc1ccc(Cl)cc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(CCO)c2C)n1N,C59914538_decoy,TRY1,Decoy,0,-10.4396,-7.21,-3.46,-8.183522371295108
CCCCN1C(=O)N=C([O-])[C@H](N(CCC(C)C)C(=O)CSc2n[nH]c(N)n2)[C@H]1[NH3+],C39944019_decoy,TRY1,Decoy,0,-8.37459,-6.63,-3.34,-9.044924989258572
CCOc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1nnc(SCC(N)=O)s1)[NH+]=2,C63302005_decoy,TRY1,Decoy,0,-10.0171,-4.22,-1.73,-6.121764503433921
COc1cc(/C=N/NC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)ccc1OCC(N)=O,C63611305_decoy,TRY1,Decoy,0,-8.78614,-6.72,-1.8,-6.8507717078604005
NC(=O)Cc1ccc(OCC2=[NH+][C@@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)ON2)cc1,C63818501_decoy,TRY1,Decoy,0,-7.71672,-9.1,-1.82,-6.86606937684582
CC(C)(C)OC(=O)[C@H](NC(=O)C[NH2+][C@H](CC(N)=O)C(=O)[O-])OC(=O)[C@@H](N)CS,C64219597_decoy,TRY1,Decoy,0,-11.0667,-6.28,-3.1,-8.335268797166254
CC(C)[NH+](CC[C@H](c1ccccc1)c1cc(CO)ccc1O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O)C(C)C,C65742946_decoy,TRY1,Decoy,0,-6.78211,-6.32,-2.38,-5.4889635966462285
Cc1ccc(N(C[C@@H](O)[C@H](O)[C@H](O)C(O)O)/N=N/c2ccc([N+](=O)[O-])cc2)cc1C,C04142253_decoy,TRY1,Decoy,0,-7.95686,-6.16,-3.07,-6.447473185420782
CCCC[C@@H](C(=O)NC1CCCC1)N(CCCO)C(=O)c1snc(C(N)=O)c1N,C04161223_decoy,TRY1,Decoy,0,-9.24395,-6.73,-2.6,-10.17949583749578
COc1cc2[nH+]c3cc([N+](=O)[O-])ccc3c(NCCC[NH2+]CC(C)(C)O)c2cc1OC,C04428889_decoy,TRY1,Decoy,0,-7.71094,-5.7,-3.4,-5.813496013598473
CC1=C/C(=C(/c2ccccc2)c2cc(C)c(O)c(C[NH2+]CC(=O)[O-])c2)C=C(C[NH2+]CC(=O)[O-])C1=O,C05567285_decoy,TRY1,Decoy,0,-7.71629,-6.81,-3.01,-6.659487024334794
COc1ccc2[nH+]c3cc([N+](=O)[O-])ccc3c(NCCC[NH+](CCO)CCO)c2c1,C06005760_decoy,TRY1,Decoy,0,-8.33458,-5.5,-0.46,-5.3017525773549545
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(F)cc2)cc1,C06601035_decoy,TRY1,Decoy,0,-7.00351,-7.71,-1.9,-8.586335022963349
C[C@H](O)[C@H](NC(=O)C[C@@H](CNC(=O)C1CC[NH2+]CC1)c1ccc(Cl)cc1)C(=O)[O-],C08739693_decoy,TRY1,Decoy,0,-7.80092,-6.63,-0.53,-6.125729859083454
COc1cc(C(=O)NCC(=O)NNc2ncnc(N)c2[N+](=O)[O-])cc(OC)c1OC,C09391673_decoy,TRY1,Decoy,0,-6.62785,-7.93,-2.8,-7.962498473135271
CC(=O)N[C@@H]1[C@@H](OC[C@H](O)[C@H]2O[C@H]3OC(C)(C)O[C@@H]3[C@H]2OCc2ccccc2)O[C@@H](CO)[C@@H](O)[C@H]1O,C09974831_decoy,TRY1,Decoy,0,-6.06031,-7.99,-3.0,-6.290101151799518
C[NH+](Cc1n[nH]c(=O)[nH]1)Cc1ccccc1OC[C@@H](O)C[NH+]1CCc2ccccc2C1,C11814883_decoy,TRY1,Decoy,0,-7.62345,-6.33,-1.91,-5.521246887858557
COC(=O)C1CC[NH+](C[C@@H](O)COc2ccc(C[NH2+]Cc3n[nH]c4c3CCC4)cc2)CC1,C12299656_decoy,TRY1,Decoy,0,-8.08848,-6.67,-3.82,-5.681988650218609
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)N[C@H](C(=O)[O-])[C@@H](C)O)c1ccc(Cl)cc1,C12892719_decoy,TRY1,Decoy,0,-10.0139,-6.78,-3.16,-6.777597914460904
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)N[C@H](C(=O)[O-])[C@H](C)O)c1ccc(Cl)cc1,C12892726_decoy,TRY1,Decoy,0,-8.72132,-5.92,-3.75,-6.269172752523911
CC[NH+](CC)C[C@@H](O)COc1ccc(C[NH2+]CCSc2cn[nH]n2)cc1OC,C12303066_decoy,TRY1,Decoy,0,-8.71305,-5.48,-2.42,-7.133242471865768
CC[NH+](CC)C[C@H](O)COc1ccc(C[NH2+]CCSc2cn[nH]n2)cc1OC,C12303069_decoy,TRY1,Decoy,0,-7.92772,-6.3,-2.92,-10.346035065442072
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCn2ccnc2)c1,C12317494_decoy,TRY1,Decoy,0,-8.01625,-6.57,-2.02,-7.508580802990588
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCn2ccnc2)c1,C12317495_decoy,TRY1,Decoy,0,-8.24284,-6.78,-2.45,-7.694662146345273
C[C@@H](O)[C@H](NC(=O)C[C@@H](CNC(=O)C1CC[NH2+]CC1)c1ccc(Cl)cc1)C(=O)[O-],C13548279_decoy,TRY1,Decoy,0,-8.32572,-7.34,-0.65,-7.912430009217694
C=C[C@@H](CCCCC)O[C@H]1O[C@@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14616882_decoy,TRY1,Decoy,0,-4.61194,-5.26,-3.19,-3.720861954801602
COc1cc(C[NH2+]CCc2nc(C)cc(C)n2)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C11661607_decoy,TRY1,Decoy,0,-8.35774,-6.1,-2.11,-5.549134712203188
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCn2cccn2)c1,C14951798_decoy,TRY1,Decoy,0,-7.70212,-6.54,-3.12,-7.040965656483201
Cc1ccc(N(C[C@H](O)[C@@H](O)[C@@H](O)C(O)O)/N=N/c2ccc([N+](=O)[O-])cc2)cc1C,C15938549_decoy,TRY1,Decoy,0,-7.44231,-8.13,-2.1,-7.3771865629707
CC(=O)Nc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2cccc(O)c2)n1,C20906730_decoy,TRY1,Decoy,0,-8.13808,-8.09,-1.82,-7.716664968873785
COc1ccc([C@H]2Oc3c(OC)cc(CCCO)cc3[C@@H]2CO)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31156098_decoy,TRY1,Decoy,0,-8.58962,-6.21,-3.83,-6.2217462518553885
COc1cc(/C=C/CO[C@@H](CO)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C35465759_decoy,TRY1,Decoy,0,-7.48129,-6.98,-4.18,-6.061227598789267
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl,C25386921_decoy,TRY1,Decoy,0,-9.57787,-5.7,-3.28,-7.401998828086215
CN1C(O)=C(C(=O)C[C@H](NC(CO)(CO)CO)c2cccs2)C(=O)[C@H]2C=CC=C[C@H]21,C35614465_decoy,TRY1,Decoy,0,-8.98419,-5.78,-2.78,-6.266486790119744
CCC[C@H](C(=O)NC(C)(C)C)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06501280_decoy,TRY1,Decoy,0,-9.14543,-7.28,-3.67,-9.117201749057388
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccco2)cc1,C06601074_decoy,TRY1,Decoy,0,-6.75036,-6.63,-2.6,-5.873536826182237
C=C[C@](C)(CC/C=C(\C)CC[C@H](O)C(C)(C)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C36374535_decoy,TRY1,Decoy,0,-6.92863,-6.48,-4.15,-6.049806191833704
C[C@H](C[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1,C31168771_decoy,TRY1,Decoy,0,-6.19309,-6.91,-2.12,-7.811791615866888
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)N[C@H](C(=O)[O-])[C@@H](C)O)c1ccc(Cl)cc1,C38573628_decoy,TRY1,Decoy,0,-8.13145,-6.16,-0.97,-8.649030306876755
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)N[C@H](C(=O)[O-])[C@H](C)O)c1ccc(Cl)cc1,C38573629_decoy,TRY1,Decoy,0,-8.89823,-6.98,-1.12,-7.810578047907832
CCOC(=O)[C@@H]1[NH+]=c2ccc(OC)cc2=C1NC(=O)CC[NH+]1CCC(C(N)=O)CC1,C38617897_decoy,TRY1,Decoy,0,-9.84695,-5.59,-1.8,-8.29804445359509
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)C(/C=N/Nc1ccccc1)=N/Nc1ccccc1,C04403687_decoy,TRY1,Decoy,0,-8.63541,-6.11,-1.52,-7.645353045331922
CC(C)[C@H]([NH3+])C(=O)NC[C@@H](CC(=O)N[C@H](C(=O)[O-])[C@@H](C)O)c1ccc(Cl)cc1,C39029815_decoy,TRY1,Decoy,0,-9.29601,-6.69,-1.39,-7.277472502083405
COc1cc(/C=C/COC[C@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C39560205_decoy,TRY1,Decoy,0,-7.09693,-6.89,-2.39,-7.074677105441265
COC[C@@H](C)Nc1ncnc(NNC(=O)COc2ccc(Cl)cc2Cl)c1N,C40795584_decoy,TRY1,Decoy,0,-8.72956,-5.07,-3.13,-5.03503048932166
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cccs1,C33904180_decoy,TRY1,Decoy,0,-8.42314,-5.5,-1.51,-6.291453564442887
C[C@H](O)[C@H](NC(=O)C[C@H](CNC(=O)C1CC[NH2+]CC1)c1ccc(Cl)cc1)C(=O)[O-],C43595223_decoy,TRY1,Decoy,0,-7.65865,-6.19,-1.0,-5.859331519775237
NC(=O)CCc1nnc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)n1C[C@H]1CCCO1,C45842341_decoy,TRY1,Decoy,0,-8.48263,-7.1,-1.46,-6.4111062763190905
CCCC1=CC(=O)N[C@](NCCN[C@]2(SC)NC(=O)C=C(CCC)N2)(SC)N1,C19793955_decoy,TRY1,Decoy,0,-7.72241,-6.8,-1.64,-6.256487355069001
COC(=O)CCCNC(=S)NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl,C18141324_decoy,TRY1,Decoy,0,-10.0928,-6.31,-3.43,-6.630703426847162
CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3O)n2)s1,C58994344_decoy,TRY1,Decoy,0,-10.9499,-9.14,-3.2,-11.79876591883539
COc1ccc(/C=N/Nc2n[nH]c(SCC(=O)Nc3nnc(SCC(N)=O)s3)n2)cc1,C20832333_decoy,TRY1,Decoy,0,-9.94347,-7.9,-2.54,-7.638696462318155
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)c3ccccc3)n[nH]2)c1O,C59813501_decoy,TRY1,Decoy,0,-9.16286,-6.06,-2.9,-5.84025328539093
COc1cccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]2)c1O,C59879513_decoy,TRY1,Decoy,0,-8.33982,-7.09,-2.33,-6.395265523234268
C[NH+](C)CCNC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63270492_decoy,TRY1,Decoy,0,-9.35935,-8.21,-1.74,-8.344106036066169
C=CCOC(=O)[C@](N)(C[C@@H]([NH3+])C(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21,C64219202_decoy,TRY1,Decoy,0,-8.04364,-7.52,-2.33,-6.4158802625612505
CC(C)[NH+](CC[C@H](c1ccccc1)c1cc(CO)ccc1O[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O)C(C)C,C65742945_decoy,TRY1,Decoy,0,-6.23997,-5.89,-2.83,-6.420455290778951
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccc(C)cc3)n2N)n1,C03545191_decoy,TRY1,Decoy,0,-8.97665,-8.03,-1.81,-7.487784022285923
OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)C(Sc1ccccc1)Sc1ccccc1,C04831399_decoy,TRY1,Decoy,0,-8.16148,-7.15,-4.05,-8.177767970994923
OC(CNc1ccc(Nc2ccccc2)cc1)CNc1ccc(Nc2ccccc2)cc1,C04981470_decoy,TRY1,Decoy,0,-7.71528,-7.4,-1.15,-6.3234517448630765
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(OCc1ccccc1)OCc1ccccc1,C05699605_decoy,TRY1,Decoy,0,-6.93766,-7.05,-1.73,-8.398067456212924
CC(C)(C)NC(=O)[C@@H](c1ccco1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1,C06074669_decoy,TRY1,Decoy,0,-8.11786,-4.89,-4.12,-5.700317220576668
CCC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(CC)cc1,C06501174_decoy,TRY1,Decoy,0,-8.2781,-6.62,-4.0,-7.533202674254277
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C)C(=O)NC1CCCC1,C06860566_decoy,TRY1,Decoy,0,-7.87583,-5.23,-0.72,-5.627159078583567
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C)C(=O)NC1CCCCC1,C06860648_decoy,TRY1,Decoy,0,-7.51839,-6.73,-2.1,-5.662189833551867
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2)cc1,C12479541_decoy,TRY1,Decoy,0,-7.36239,-6.47,-1.64,-6.263331309422173
Cc1ccc([C@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)C2CCCC2)cc1,C12701888_decoy,TRY1,Decoy,0,-8.17556,-8.42,-0.61,-8.824340429488007
Nc1nc(N)c(-c2ccc(Cl)cc2)c(CCCCNC(=O)CBr)n1,C13283450_decoy,TRY1,Decoy,0,-8.75301,-7.28,-1.14,-9.055021425479756
O=C(/C=C/c1ccccc1)N[C@H](NC(=S)NNC(=O)c1ccccc1O)C(Cl)(Cl)Cl,C03019061_decoy,TRY1,Decoy,0,-9.13329,-7.56,-1.86,-7.225848034770871
CCOc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2cccc(C(F)(F)F)c2)ccc1OCC(N)=O,C01126842_decoy,TRY1,Decoy,0,-9.86942,-5.82,-2.62,-6.2345070318228295
CCNc1nc(N)nc(OCCNC(=O)Nc2ccc(Cl)c(Cl)c2)n1,C16887213_decoy,TRY1,Decoy,0,-9.2885,-7.5,-1.29,-7.261564789389812
C[NH+](C)C[C@@H](c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)cc1)C1(O)CCCCC1,C22056430_decoy,TRY1,Decoy,0,-6.96234,-7.29,-1.32,-5.19692714071132
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(F)cc2)c1,C26146750_decoy,TRY1,Decoy,0,-7.91054,-5.66,-2.1,-6.020709289695104
CC[C@H]1CCc2sc(C(=O)NNC(=O)[C@@H](NC(N)=O)[C@@H](C)CC)cc2C1,C27327204_decoy,TRY1,Decoy,0,-9.83926,-4.82,-1.75,-6.5318410997817375
Cc1cccc(NC(=O)NCC(=O)NNC(=S)N[C@@H]2CCC[C@@H](C)[C@H]2C)c1,C31544926_decoy,TRY1,Decoy,0,-8.62903,-7.77,-2.54,-6.535369125701144
C[NH+](C)C[C@@H](c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)cc1)C1(O)CCCCC1,C34903853_decoy,TRY1,Decoy,0,-7.80352,-4.92,-3.66,-4.865013373798479
C[NH+](C)C[C@H](c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)cc1)C1(O)CCCCC1,C34903854_decoy,TRY1,Decoy,0,-5.87001,-7.14,-2.62,-4.776160763489419
CN(C(=O)C(O)(c1ccccc1)c1ccccc1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36534584_decoy,TRY1,Decoy,0,-7.84026,-5.18,-1.91,-5.603533411878572
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)c1ccccc1O,C36567671_decoy,TRY1,Decoy,0,-7.03304,-7.07,-3.37,-7.6268166844338205
CCCN(C(=O)C(O)(c1ccccc1)c1ccccc1)[C@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36573060_decoy,TRY1,Decoy,0,-7.98627,-6.55,-4.27,-6.452537735607207
COc1ccc(C2=C[C@@H]([C@H]3NN[C@@H](SCC(=O)Nc4cc(C)ccc4C)N3N)N=N2)cc1,C39016600_decoy,TRY1,Decoy,0,-9.73045,-7.64,-1.71,-8.611486640530652
C=CCNC(=O)N[C@H]1N[C@@H](CC(=O)NCCc2c[nH]c3ccccc23)CS1,C39710039_decoy,TRY1,Decoy,0,-7.58089,-7.54,-1.03,-6.421145384621284
C[NH+](C)C[C@@H](c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)cc1)C1(O)CCCCC1,C39937007_decoy,TRY1,Decoy,0,-6.42639,-7.55,-3.95,-5.2132595380916325
C[NH+](C)C[C@H](c1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)cc1)C1(O)CCCCC1,C39937008_decoy,TRY1,Decoy,0,-5.59274,-6.64,-1.38,-4.744582993053085
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NNC(=O)c2cccnc2)c1N,C40688759_decoy,TRY1,Decoy,0,-8.98566,-10.18,-3.56,-7.955852766172187
Cc1cc(Cl)ccc1Nc1ncnc(NNC(=O)C(c2ccccc2)c2ccccc2)c1N,C40703383_decoy,TRY1,Decoy,0,-8.59544,-6.66,-2.53,-5.846099499893081
COc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)c(OC)c1,C40754553_decoy,TRY1,Decoy,0,-8.85895,-7.4,-2.71,-6.875529648997588
Nc1c(NCCC2=CCCCC2)ncnc1NNC(=O)c1ccccc1Cl,C40756056_decoy,TRY1,Decoy,0,-8.23954,-6.82,-2.48,-5.575568930408719
Nc1c(NNc2ccccc2)ncnc1NC(c1ccccc1)c1ccccc1,C40757491_decoy,TRY1,Decoy,0,-7.31738,-6.49,-1.96,-5.365653228808308
Cc1ccc2cccc(Nc3ncnc(NNC(=O)COc4ccc(Cl)cc4Cl)c3N)c2n1,C40758692_decoy,TRY1,Decoy,0,-9.76411,-8.07,-2.96,-7.413992599784139
COc1ccccc1Nc1ncnc(NNC(=O)c2ccccc2OC)c1N,C40781538_decoy,TRY1,Decoy,0,-7.0219,-6.72,-1.81,-6.791346690178811
Cc1ccc(Nc2ncnc(NNC(=O)COc3ccc(Cl)cc3Cl)c2N)cc1,C40782063_decoy,TRY1,Decoy,0,-7.83865,-6.79,-1.45,-5.571134575598584
Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Nc1ccc(Br)cc1,C40782277_decoy,TRY1,Decoy,0,-8.07092,-5.92,-1.52,-5.6327296580437
Nc1c(NNC(=O)COc2ccc(Cl)cc2Cl)ncnc1Nc1ccc(Br)cc1,C40782280_decoy,TRY1,Decoy,0,-9.46216,-6.89,-2.59,-6.368345280130447
Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Nc1cccc(Br)c1,C40794878_decoy,TRY1,Decoy,0,-9.46796,-7.79,-1.36,-7.339147662480947
NC(=O)CCC/C=C\C[C@@H]1[C@@H](/C=C/[C@H](O)CCc2ccccc2)[C@@H](O)C[C@@H]1O,C43772362_decoy,TRY1,Decoy,0,-9.88544,-6.7,-3.28,-9.059425437740172
NC(=O)C(NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(N)=O,C44389341_decoy,TRY1,Decoy,0,-7.25635,-6.11,-2.39,-6.680290064315972
COCCNC(=O)c1c(Nc2ccc(Cl)cc2)sc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1N,C03246160_decoy,TRY1,Decoy,0,-10.5029,-7.44,-1.46,-7.269035583851012
C[C@H](NC(=O)CNC(=O)NCc1ccco1)c1ccc(S(N)(=O)=O)cc1,C56125886_decoy,TRY1,Decoy,0,-6.54066,-5.6,-1.84,-4.695456878019838
C[C@@H](NC(=O)CNC(=O)NCc1ccco1)c1ccc(S(N)(=O)=O)cc1,C56125887_decoy,TRY1,Decoy,0,-8.2401,-7.3,-3.96,-6.074397306696914
CSCC[C@H](NC(N)=O)C(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12,C57329492_decoy,TRY1,Decoy,0,-8.93982,-7.89,-3.46,-9.74440304831742
CSCC[C@@H](NC(N)=O)C(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12,C57329493_decoy,TRY1,Decoy,0,-9.2046,-7.31,-2.58,-8.834703127862493
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1ccc(F)c(F)c1,C58994258_decoy,TRY1,Decoy,0,-10.7522,-9.63,-2.02,-9.358205099583948
CC(C)c1ccccc1NC(=S)NNC(=O)c1ccc(S(N)(=O)=O)o1,C66147671_decoy,TRY1,Decoy,0,-8.65668,-6.76,-1.62,-5.777557834215787
Cc1cc(OC[C@H](O)CSc2nc(N)cc(N)n2)c(C(C)C)cc1Cl,C66238806_decoy,TRY1,Decoy,0,-8.32932,-7.63,-1.7,-8.181648000386277
C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCc1n[nH]c(N)c1C#N,C66954472_decoy,TRY1,Decoy,0,-8.33168,-5.52,-1.68,-5.398605231244351
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NCCCc2n[nH]c(N)c2C#N)cc1,C67321280_decoy,TRY1,Decoy,0,-7.58317,-8.52,-2.99,-7.380324709794125
C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+]C[C@H](O)c1ccc(O)c(C(N)=O)c1,C04213738_decoy,TRY1,Decoy,0,-8.57167,-7.86,-1.92,-7.135439772391634
C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+]C[C@@H](O)c1ccc(O)c(C(N)=O)c1,C01570644_decoy,TRY1,Decoy,0,-7.92142,-7.92,-0.76,-9.036325325249104
CC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(CC[NH+]1CCOCC1)C(=O)c1snc(C(N)=O)c1N,C06074889_decoy,TRY1,Decoy,0,-8.33417,-6.73,-0.84,-9.233483189112007
O=C(C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1)Nc1ccccc1C(=O)NCc1ccco1,C08709209_decoy,TRY1,Decoy,0,-7.59497,-8.49,-2.11,-7.647097810174948
COc1ccc(Nc2nc(NCCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C09281173_decoy,TRY1,Decoy,0,-8.509,-6.16,-2.24,-6.379641534851228
CCCn1c(N)c(C(=O)C[NH+](C)CC(=O)Nc2ccc(N3CCOCC3)cc2)c(=O)[nH]c1=O,C09958502_decoy,TRY1,Decoy,0,-7.48896,-7.38,-2.76,-5.655643754542438
CC(C)CN(C(=O)C[NH2+][C@@H](C)c1ccccc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C03566894_decoy,TRY1,Decoy,0,-6.77306,-6.42,-2.12,-5.468857475044352
C[C@H](C(=O)Nc1ccc(C#N)cc1)[NH+](C)CC(=O)N(C)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C13130590_decoy,TRY1,Decoy,0,-7.45942,-8.02,-2.89,-6.623394128371744
C[C@@H](C(=O)Nc1ccc(C#N)cc1)[NH+](C)CC(=O)N(C)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C13130592_decoy,TRY1,Decoy,0,-6.66208,-7.75,-2.54,-5.599770344264834
COc1ccc(-c2c(-c3ccc(OCC[NH+]4CCC(C(N)=O)CC4)cc3O)n[nH]c2C)cc1OC,C09410906_decoy,TRY1,Decoy,0,-9.78828,-7.09,-3.63,-6.835304750800884
C[NH+](CCc1ccccc1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1cccc(Cl)c1,C20465808_decoy,TRY1,Decoy,0,-7.74777,-6.21,-1.32,-6.568322578831546
C[NH2+]Cc1cn(C[C@H]2O[C@@H](CC(=O)NCCN3CCOCC3)[C@H](O)[C@@H]2O)nn1,C20504101_decoy,TRY1,Decoy,0,-7.07912,-6.44,-2.08,-5.887491662205448
C[C@H](O)CNCC[NH2+]Cc1cc(Cl)ccc1OCC(=O)NC(C)(C)C,C20873533_decoy,TRY1,Decoy,0,-9.0466,-6.35,-2.14,-9.54905585725434
NS(=O)(=O)c1ccc(CC[NH2+]CC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1,C21265589_decoy,TRY1,Decoy,0,-8.70673,-7.06,-4.24,-6.267278422330748
C[C@@]1(CCCOc2ccccc2C(=O)NCBr)[NH+]=C(N)N=C(N)N1c1ccccc1,C17025401_decoy,TRY1,Decoy,0,-9.50918,-6.23,-2.01,-7.092159862952703
OCC(CO)(CO)[NH2+]C[C@@H](O)CN1c2ccccc2Sc2ccccc21,C04150548_decoy,TRY1,Decoy,0,-6.99704,-6.81,-3.32,-5.433282060928327
Cc1cccc(COc2ccccc2C[NH2+]CCNC(=O)c2nonc2N)c1,C40744479_decoy,TRY1,Decoy,0,-6.96429,-7.56,-1.82,-6.969831106030748
NC(=O)c1ccc(Nc2nc(NCC[NH2+]CCO)nc(N)c2[N+](=O)[O-])cc1,C41300946_decoy,TRY1,Decoy,0,-6.00425,-6.44,-2.15,-6.251881767661434
CCC(CC)[C@H](CNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1)[NH+]1CCCC1,C41327604_decoy,TRY1,Decoy,0,-8.55057,-5.45,-1.76,-6.903620068145504
CC(C)C[C@H]([NH3+])c1nc(C(=O)N[C@@H](CSCc2ccccc2)C(=O)Nc2ccc([N+](=O)[O-])cc2)co1,C43213920_decoy,TRY1,Decoy,0,-9.91123,-7.4,-3.74,-8.055801784414395
CC(C)C[C@H](NC(=O)c1coc([C@@H]([NH3+])CO)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1,C33911812_decoy,TRY1,Decoy,0,-9.03851,-5.58,-1.87,-6.01482459293734
O=C1[C@@H]2[C@@H](C(=O)N1CC[NH2+]Cc1ccccc1)[C@](CO)(C(=O)[O-])[NH2+][C@H]2c1ccc(Cl)c([N+](=O)[O-])c1,C33920001_decoy,TRY1,Decoy,0,-7.7783,-8.49,-2.1,-6.821052703969454
O=C1[C@H]2[C@@H](c3ccc(Cl)c([N+](=O)[O-])c3)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]2C(=O)N1CC[NH2+]Cc1ccccc1,C33920002_decoy,TRY1,Decoy,0,-8.05724,-7.1,-2.91,-5.564759091288247
CCOC(=O)C1=C(CS/C(N)=[NH+]/[C@H](C)CC)NC(=O)N[C@H]1c1ccco1,C44792921_decoy,TRY1,Decoy,0,-7.0935,-5.18,-1.64,-5.078245731383879
CCOC(=O)C1=C(CS/C(N)=[NH+]/[C@H](C)CC)NC(=O)N[C@@H]1c1ccco1,C44792927_decoy,TRY1,Decoy,0,-7.65148,-5.44,-2.8,-5.202198969245656
CC1CC[NH+]([C@@H](CNC(=O)Nc2ccccc2OCCC(N)=O)C(C)C)CC1,C47878046_decoy,TRY1,Decoy,0,-8.74193,-6.59,-3.83,-7.193711924274173
CC1CC[NH+]([C@H](CNC(=O)Nc2ccccc2OCCC(N)=O)C(C)C)CC1,C47878048_decoy,TRY1,Decoy,0,-8.18085,-7.23,-4.94,-6.8995669095652685
C[NH+](C)[C@@H](CNC(=O)NNC(=S)NC1CCCC1)c1cccc(F)c1,C49798368_decoy,TRY1,Decoy,0,-8.20042,-6.21,-2.95,-6.387944186552215
C[NH+](C)[C@H](CNC(=O)NNC(=S)NC1CCCC1)c1cccc(F)c1,C49798369_decoy,TRY1,Decoy,0,-8.27122,-5.6,-1.47,-6.218530203825184
C[C@@H]1CCC[NH+](C(C)(C)CNC(=O)Nc2ccccc2OCCC(N)=O)C1,C54440516_decoy,TRY1,Decoy,0,-8.10877,-6.85,-4.4,-8.520618743398813
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)Nc2ccccc2OCCC(N)=O)C1,C54440520_decoy,TRY1,Decoy,0,-9.22253,-6.75,-2.02,-8.701237465438135
CSCC[C@@H](NC(N)=O)C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1,C57288306_decoy,TRY1,Decoy,0,-8.45807,-4.56,-2.8,-5.634568265511667
CCc1ccc([C@H]2NC(=O)NC(CN3CCC(C(N)=O)([NH+]4CCCCC4)CC3)=C2C(=O)OC)cc1,C57415181_decoy,TRY1,Decoy,0,-8.1043,-5.67,-1.32,-6.422610492099732
CCc1ccc([C@@H]2NC(=O)NC(CN3CCC(C(N)=O)([NH+]4CCCCC4)CC3)=C2C(=O)OC)cc1,C57415184_decoy,TRY1,Decoy,0,-7.5593,-6.82,-3.62,-5.326027018238483
CC1CC[NH+]([C@H](CNC(=O)NCCc2ccc(S(N)(=O)=O)s2)c2cccs2)CC1,C58171868_decoy,TRY1,Decoy,0,-11.0888,-6.11,-3.67,-6.33004872987182
CCc1ccccc1NC(=O)C[NH+](C)CC(=O)Nc1ccccc1C(N)=O,C58338540_decoy,TRY1,Decoy,0,-6.89971,-7.05,-0.51,-6.8786313513881385
NC(=O)C1CC[NH+](CCCCNC(=O)Nc2ccc(C(F)(F)F)cc2)CC1,C58848183_decoy,TRY1,Decoy,0,-7.69933,-6.84,-2.36,-5.658126754896456
CCCCCC[NH+](CCO)CC(=O)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C63507082_decoy,TRY1,Decoy,0,-7.18087,-5.47,-4.07,-6.09151997462722
NC(=O)CCN1C[C@@H](C[NH2+]CCc2n[nH]c3c2CCCC3)c2ccccc21,C63834070_decoy,TRY1,Decoy,0,-7.59745,-6.52,-1.36,-5.407983306139066
NC(=O)CCN1C[C@H](C[NH2+]CCc2n[nH]c3c2CCCC3)c2ccccc21,C63834072_decoy,TRY1,Decoy,0,-8.16817,-7.9,-1.29,-5.809833811255366
CCCNC(=O)NC(C)(C)C(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1,C65909749_decoy,TRY1,Decoy,0,-7.78176,-5.17,-3.08,-5.03159896475239
Cc1ccccc1-[n+]1c(SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)nc2[nH]nc(C)c2c1N,C33726458_decoy,TRY1,Decoy,0,-10.509,-7.09,-2.13,-7.231268951538335
CCCCNC(=O)[C@H]1CC[C@H](C)[NH+](CC(=O)Nc2sccc2C(N)=O)C1,C66474077_decoy,TRY1,Decoy,0,-8.7602,-5.74,-1.63,-6.579882715512261
CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C(N)=O)c2ccc(F)cc2)cc1,C66939577_decoy,TRY1,Decoy,0,-7.31623,-7.16,-2.95,-6.350089922685514
CCN(CC)C(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C(N)=O)c2ccc(F)cc2)cc1,C66939579_decoy,TRY1,Decoy,0,-7.0659,-7.32,-2.12,-5.754489901590369
CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1,C67539273_decoy,TRY1,Decoy,0,-8.73657,-6.91,-3.52,-5.9654275156825145
CC(C)CC(=O)Nc1ccc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)cc1,C67539274_decoy,TRY1,Decoy,0,-8.74553,-6.09,-2.61,-5.535947083290761
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCNC(=O)c2ccccc2Cl)CC1,C67614971_decoy,TRY1,Decoy,0,-8.67794,-7.16,-3.35,-7.086835416540412
CCC(=O)Nc1ccc([C@@H](C)NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)cc1,C67620667_decoy,TRY1,Decoy,0,-8.63983,-6.94,-4.09,-5.842902916813061
CCC(=O)Nc1ccc([C@H](C)NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1,C67620691_decoy,TRY1,Decoy,0,-8.99776,-7.6,-3.84,-6.611185141683894
Oc1c([C@@H](Nc2cccc[nH+]2)c2ccc(C(F)(F)F)cc2)ccc2cccnc12,C01463362_decoy,TRY1,Decoy,0,-8.72267,-6.93,-1.05,-7.11592858201893
O[C@@H](C[NH2+]Cc1ccco1)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21,C04190379_decoy,TRY1,Decoy,0,-7.66393,-5.75,-2.51,-4.779000442330752
O[C@H](C[NH2+]CCc1ccc(C(F)(F)F)cc1)CO[C@@H]1CCCc2ccccc21,C02652719_decoy,TRY1,Decoy,0,-7.17642,-6.27,-1.78,-4.94283811021415
CCOc1cc2c(cc1OCC)[C@H](c1cc(Cl)cc(Cl)c1O)[NH2+]CC2,C04577373_decoy,TRY1,Decoy,0,-9.3671,-6.42,-2.82,-6.161857144479283
CCOc1ccc(C2=N[C@H](c3ccc(C)cc3)[NH2+][C@@H](c3ccccc3O)C2)cc1,C04729394_decoy,TRY1,Decoy,0,-8.29074,-7.83,-0.11,-7.361601157633316
Cc1sc2nc(-c3cccs3)nc(NCCC[NH2+]C(C)(C)C)c2c1C,C06084927_decoy,TRY1,Decoy,0,-9.38698,-5.38,-2.84,-5.464985490665366
CC[C@@H]([NH2+]C[C@H](O)CO[C@@H](C)c1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2,C06086994_decoy,TRY1,Decoy,0,-8.58876,-6.08,-2.85,-5.474705218712918
CC[C@@H]([NH2+]C[C@@H](O)CO[C@@H](C)c1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2,C06086999_decoy,TRY1,Decoy,0,-8.37789,-7.47,-1.16,-8.075763318383974
CC[C@H]([NH2+]C[C@@H](O)COCc1ccccc1Cl)c1ccc(Br)cc1,C03441520_decoy,TRY1,Decoy,0,-8.80074,-5.29,-1.86,-5.252436803804832
O[C@H](C[NH2+]CCC12CC3CC(CC(C3)C1)C2)COc1ccc(Cl)cc1Cl,C06638121_decoy,TRY1,Decoy,0,-9.78645,-6.47,-1.24,-5.792254416302336
CCc1cccc2c([C@@H](CC(=O)NCC[NH+](C)C)c3ccc(Cl)cc3)c[nH]c12,C06740197_decoy,TRY1,Decoy,0,-8.7896,-5.22,-1.13,-5.291714221000235
C[C@H](O)c1ccc(-c2ccc(C[NH2+][C@H](C)C34CC5CC(CC(C5)C3)C4)o2)cc1,C07540785_decoy,TRY1,Decoy,0,-8.49297,-6.0,-3.14,-5.242673004456015
CCOc1ccc(C2=N[C@H](c3cccc(Br)c3)[NH2+][C@H](c3ccccc3O)C2)cc1,C09542052_decoy,TRY1,Decoy,0,-8.17172,-7.29,-1.72,-6.774292243409436
CCOc1cccc([C@@H]2CC(c3ccc(Cl)cc3)=N[C@@H](c3ccc(C)cc3C)[NH2+]2)c1O,C09542406_decoy,TRY1,Decoy,0,-8.10018,-6.13,-1.42,-5.36401607189242
COc1cc(C[NH3+])cc(Cl)c1OCCOc1cc(C)ccc1C(C)(C)C,C11799983_decoy,TRY1,Decoy,0,-9.66599,-5.72,-2.9,-6.021639139480607
Cc1c([C@@H](C)[NH2+]Cc2ccc(C#CCCO)cc2)cnn1-c1cccc(F)c1,C12195259_decoy,TRY1,Decoy,0,-8.09084,-5.69,-2.67,-5.866544019292327
C[C@H]1Cc2cc([C@H](O)C[NH+]3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)ccc2O1,C12361297_decoy,TRY1,Decoy,0,-8.65838,-7.21,-0.93,-5.95465387777861
Cc1ccc(-c2c(C)sc3nc(C[NH2+][C@@H](C)c4ccc(F)cc4F)[nH]c(=O)c23)cc1,C12977834_decoy,TRY1,Decoy,0,-8.08681,-8.27,-2.29,-5.832649456495101
Oc1ccc2c(c1)CC[C@]21C=C(c2ccc(OCC[NH+]3CCCCC3)c(F)c2)c2cc(O)ccc21,C13587753_decoy,TRY1,Decoy,0,-8.94879,-7.83,-2.44,-5.871673083195808
CO[C@H](C[NH2+]Cc1c[nH]nc1-c1ccc(-c2ccccc2)cc1)c1cccs1,C12444605_decoy,TRY1,Decoy,0,-7.16901,-6.45,-1.95,-5.238150020711049
CC1(C)CC(N(Cc2ccccc2)C(=S)Nc2ccccc2F)CC(C)(C)[NH2+]1,C17081771_decoy,TRY1,Decoy,0,-7.68922,-6.61,-2.38,-5.309428962606356
OC12C[C@H]3C[C@@H](C1)CC([NH2+]Cc1ccc(OCc4ccccc4Cl)cc1)(C3)C2,C13728231_decoy,TRY1,Decoy,0,-10.0606,-7.97,-1.27,-6.375692584092784
CCOc1cccc([C@@H]2CC(c3ccc(CC)cc3)=N[C@H](c3ccc(C(F)(F)F)cc3)[NH2+]2)c1O,C20764305_decoy,TRY1,Decoy,0,-8.62151,-4.32,-2.02,-5.627992954186528
CC(C)c1ccc(CN(C[C@H]2CCCO2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C21263062_decoy,TRY1,Decoy,0,-9.2542,-6.94,-3.19,-6.584463280220674
COc1cccc(O)c1C[NH+]1CCC[C@](CO)(Cc2ccc(F)cc2F)C1,C23213996_decoy,TRY1,Decoy,0,-8.08271,-6.81,-1.99,-5.803091391014049
CC[C@@H]([NH2+][C@H](C)c1cccc(Br)c1)c1cc(Br)ccc1O,C36919967_decoy,TRY1,Decoy,0,-7.54811,-5.32,-3.08,-4.699181937558927
CC(C)[NH2+]C[C@H](O)COc1c(Br)cc(Br)cc1Br,C36949154_decoy,TRY1,Decoy,0,-8.00405,-4.09,-1.57,-5.269332594875618
Cc1cccc(C)c1OC[C@H](O)C[NH+](Cc1ccccc1O)C1CCCCC1,C06082959_decoy,TRY1,Decoy,0,-8.12179,-7.53,-3.47,-8.655610478776898
Cc1ccc(C[NH+](C[C@@H](O)COc2cccc3[nH]cc(C)c23)C(C)(C)C)cc1,C02450149_decoy,TRY1,Decoy,0,-6.54046,-4.92,-1.94,-4.2323074678379005
O[C@H](C[NH2+]Cc1ccc(Br)s1)COc1ccc(Cl)cc1,C37984935_decoy,TRY1,Decoy,0,-8.0704,-4.57,-1.56,-5.741110278264187
CC(C)(CO)[NH2+]Cc1cc(Br)ccc1OCc1c(Cl)cccc1Cl,C40739444_decoy,TRY1,Decoy,0,-7.59152,-6.42,-2.58,-5.19349218608841
OCCC[NH2+]Cc1c(OCc2c(Cl)cccc2Cl)ccc2ccccc12,C40743771_decoy,TRY1,Decoy,0,-7.64049,-5.27,-2.13,-6.694412011867934
OCCCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1,C40744339_decoy,TRY1,Decoy,0,-8.24988,-5.66,-2.65,-7.285345188298484
CCCNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1Br,C41648680_decoy,TRY1,Decoy,0,-7.94909,-6.03,-2.82,-5.615170661738344
C[C@H]([NH3+])[C@H](c1ccc(Cl)cc1)N(C)Cc1cc(Br)cs1,C42946428_decoy,TRY1,Decoy,0,-8.75337,-4.89,-1.71,-5.679338964910108
CC[C@H]([NH3+])[C@H](Oc1ccccc1I)c1ccc(Cl)s1,C43256473_decoy,TRY1,Decoy,0,-8.52323,-4.94,-1.58,-5.457946055468544
C[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(C)Cc1ccc(Cl)cc1,C43286438_decoy,TRY1,Decoy,0,-8.21392,-4.49,-2.42,-4.814726979330923
C[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(C)Cc1csc(Br)c1,C43287013_decoy,TRY1,Decoy,0,-9.50307,-3.77,-3.58,-5.161848802303462
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)Cc1cc(Br)cs1,C43287119_decoy,TRY1,Decoy,0,-9.81479,-3.5,-1.42,-5.292163073547233
CN(Cc1ccccc1Br)[C@@H](C[NH3+])c1ccc(Br)cc1F,C48892195_decoy,TRY1,Decoy,0,-8.60037,-5.24,-1.26,-5.78975226671611
[NH3+]CCCCOc1c(Br)cc(Br)cc1Br,C53562520_decoy,TRY1,Decoy,0,-7.78164,-4.51,-1.14,-10.062298361762306
Cc1c(Cl)cccc1NC(=S)N(Cc1cccs1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59199750_decoy,TRY1,Decoy,0,-9.32847,-4.96,-1.58,-5.751141173145636
C[C@H](c1ccc(Cl)cc1)N(C)[C@@H](C[NH3+])c1cc(Br)cs1,C62012312_decoy,TRY1,Decoy,0,-7.32414,-4.51,-1.01,-5.893328357594527
C[C@H](c1ccccc1Cl)N(C)[C@@H](C[NH3+])c1ccc(Br)s1,C62012414_decoy,TRY1,Decoy,0,-8.04737,-4.3,-3.18,-4.652800321899077
C[C@H](c1ccccc1Cl)N(C)[C@@H](c1cc(Br)cs1)[C@@H](C)[NH3+],C62012416_decoy,TRY1,Decoy,0,-8.77994,-3.69,-1.18,-5.046338861135585
C[C@H]1[NH+]=c2ccc(Cl)cc2=C1CCNC(=S)Nc1ccccc1Cl,C63664011_decoy,TRY1,Decoy,0,-8.46233,-5.88,-2.72,-5.875746085885847
C[C@H]1[NH+]=c2ccc(Cl)cc2=C1CCNC(=S)Nc1cccc(Br)c1,C63664030_decoy,TRY1,Decoy,0,-10.5052,-4.12,-2.16,-6.122943620723065
CCC[NH+]1Cc2cccc(N[C@H](C)C(=O)Nc3c(C)cccc3C(C)C)c2C1,C66968151_decoy,TRY1,Decoy,0,-7.45741,-5.21,-2.89,-5.131235708197706
O[C@H](COc1ccccc1)C[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67400985_decoy,TRY1,Decoy,0,-7.68871,-5.86,-2.13,-5.143675999000039
Cc1ccccc1C[C@@]1(CO)CCCN(c2[nH+]c3ccccc3cc2CO)C1,C67642120_decoy,TRY1,Decoy,0,-7.53943,-5.84,-1.14,-4.9765746272144655
Cc1ccccc1C(=O)NC(Nc1ccc(Cl)c[nH+]1)(C(F)(F)F)C(F)(F)F,C02050238_decoy,TRY1,Decoy,0,-7.72834,-6.56,-2.39,-5.970315401846323
CCC[C@@H]1[C@H](c2ccccc2)[NH2+][C@H](c2ccccc2)C[C@]1(O)c1ccc(F)cc1,C04477948_decoy,TRY1,Decoy,0,-7.56712,-6.58,-2.11,-4.872272211543135
CCOc1ccccc1[C@@H]1N=C(c2ccc(CC)cc2)C[C@H](c2ccccc2O)[NH2+]1,C04730130_decoy,TRY1,Decoy,0,-7.74239,-6.93,-2.59,-6.756926112963217
C=CCC1(O)[C@H](C)[C@@H](c2ccc(N(C)C)cc2)[NH2+][C@H](c2ccc(N(C)C)cc2)[C@@H]1C,C04819857_decoy,TRY1,Decoy,0,-8.37017,-6.22,-4.99,-5.658960001715543
CC[NH+](CC)Cc1cc2[nH]c3c(c2cc1OC)CCNc1cc(Cl)ccc1-3,C01571822_decoy,TRY1,Decoy,0,-8.65353,-6.47,-0.12,-5.03862601965447
C[C@H]([NH2+]C[C@@H](O)COc1c(F)cc(Br)cc1F)c1ccccc1,C06007600_decoy,TRY1,Decoy,0,-7.78531,-6.57,-3.34,-5.302893755365478
CCOc1cccc([C@H]2CC(c3cccc(Br)c3)=N[C@@H](c3ccc(C)cc3)[NH2+]2)c1O,C09541855_decoy,TRY1,Decoy,0,-8.31916,-6.62,-2.03,-5.204725119973346
Cc1cccc(-n2cc(C[NH2+]C3CCC(O)CC3)c(-c3cccc(F)c3)n2)c1,C11842928_decoy,TRY1,Decoy,0,-8.62978,-5.44,-3.08,-5.80048219395339
O[C@@H](C[NH+]1CCC(O)(c2cccc(C(F)(F)F)c2)CC1)c1ccc(Cl)cc1,C12292426_decoy,TRY1,Decoy,0,-7.06395,-6.57,-1.88,-4.286180251977449
S=C(Nc1ccc(Cl)cc1)NC1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccco1,C12498761_decoy,TRY1,Decoy,0,-8.05142,-6.96,-1.32,-6.5490797094742295
OCCOc1cccc(C[NH+]2CCc3c([nH]c4ccccc34)[C@H]2c2ccccc2F)c1,C12584976_decoy,TRY1,Decoy,0,-7.53094,-7.04,-1.19,-5.711650763258856
CCc1cccc(CC)c1NC(=S)N(Cc1ccc(F)cc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C06284674_decoy,TRY1,Decoy,0,-8.46831,-5.26,-1.58,-5.188593066415863
CC(C)(CO)[NH2+]Cc1ccc(-c2ccc(Br)cc2Br)o1,C13730630_decoy,TRY1,Decoy,0,-8.5449,-4.53,-0.96,-4.803380855925972
CCCC1(O)[C@@H](C)[C@H](c2ccc(N(C)C)cc2)[NH2+][C@@H](c2ccc(N(C)C)cc2)[C@@H]1C,C13810041_decoy,TRY1,Decoy,0,-8.7739,-7.18,-1.48,-7.140076328568468
OC12C[C@H]3C[C@@H](C1)CC([NH2+]Cc1cc(Br)ccc1OCc1ccccc1F)(C3)C2,C13728547_decoy,TRY1,Decoy,0,-9.5455,-6.58,-1.95,-6.198987672490273
CCOc1ccc(C2=N[C@H](c3ccc(Br)cc3)[NH2+][C@H](c3ccccc3O)C2)cc1,C20763236_decoy,TRY1,Decoy,0,-7.54921,-5.96,-1.51,-5.580008139721085
Oc1ccc(C2=CC[NH+](C[C@H](O)COc3cccc4ccccc34)CC2)cc1,C24751740_decoy,TRY1,Decoy,0,-6.79224,-8.69,-1.17,-6.72241159798143
CCOc1cc(Cl)c([C@H]([NH3+])c2ccc(Br)o2)cc1OCC,C35382223_decoy,TRY1,Decoy,0,-9.22752,-4.39,-2.48,-5.388595541715032
COc1ccc(C2=C[C@H](c3ccccc3)[C@@H]3CCCC[C@]3(SCC[NH3+])S2)cc1,C35982130_decoy,TRY1,Decoy,0,-8.27985,-5.82,-1.63,-5.658394836057751
CC[C@H]([NH2+][C@H](C)c1cccc(Br)c1)c1cc(Br)ccc1O,C36919966_decoy,TRY1,Decoy,0,-7.61902,-6.31,-3.0,-6.893054413422352
CCOc1cc(C[NH3+])cc(Br)c1OCc1ccc(Cl)s1,C37712064_decoy,TRY1,Decoy,0,-9.56691,-5.56,-1.69,-7.9138004782471665
OCC[NH2+]Cc1cc(Br)ccc1OCc1ccc(Cl)cc1Cl,C02845718_decoy,TRY1,Decoy,0,-8.00079,-4.63,-2.32,-5.254229519979692
Cc1ccc(C[NH+](C[C@H](O)COc2cccc3[nH]cc(C)c23)C(C)(C)C)cc1,C02450147_decoy,TRY1,Decoy,0,-7.07155,-5.54,-0.94,-5.375202594082971
CC[C@H]1CCCC[C@H]1OC[C@H](O)C[NH2+]Cc1ccc(Br)s1,C37984926_decoy,TRY1,Decoy,0,-8.611,-4.74,-3.02,-6.075007410461401
O[C@@H](C[NH2+]Cc1ccc(Br)s1)COc1ccc(Cl)cc1,C37984936_decoy,TRY1,Decoy,0,-8.68007,-6.07,-1.59,-5.6837025461464
O[C@@H](C[NH2+]Cc1ccc(Br)s1)COc1c(Cl)cccc1Cl,C37984952_decoy,TRY1,Decoy,0,-8.99854,-5.9,-1.48,-6.066348589047313
F[C@@H]1CN([C@@H](C[NH2+]Cc2ccccc2)c2ccc(Cc3ccccc3)cc2)CCN1,C39531198_decoy,TRY1,Decoy,0,-8.17344,-6.9,-1.4,-7.250853583983673
CN(Cc1cc(Br)cs1)[C@@H](C[NH3+])c1cccc(Br)c1,C42398764_decoy,TRY1,Decoy,0,-8.5266,-3.99,-1.5,-5.000421700037779
C[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)N(C)Cc1csc(Br)c1,C42954820_decoy,TRY1,Decoy,0,-9.23302,-5.27,-1.35,-7.708115496402957
COc1ccc([C@@H](Oc2ccc(I)cc2)[C@@H](C)[NH3+])cc1,C42963778_decoy,TRY1,Decoy,0,-6.92678,-5.78,-0.85,-6.174022121605008
CC[C@@H]([NH3+])[C@H](Oc1ccccc1I)c1ccccc1F,C43048603_decoy,TRY1,Decoy,0,-7.53776,-5.83,-2.07,-6.950447913931853
C[C@@H]([NH3+])[C@@H](c1ccc(Cl)s1)N(C)Cc1ccc(Br)cc1,C43253203_decoy,TRY1,Decoy,0,-8.05762,-4.6,-0.96,-4.593210635141232
C[C@@H]([NH3+])[C@H](c1ccc(Br)s1)N(C)Cc1cccc(Cl)c1,C43261384_decoy,TRY1,Decoy,0,-9.15372,-5.53,-1.86,-5.379755848262488
CCN(CC)c1ccc([C@@H]2CSC[C@@H](C(=O)NC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C)[NH2+]2)cc1,C43261700_decoy,TRY1,Decoy,0,-8.39877,-6.87,-2.04,-5.738377555239006
C[C@@H]([NH3+])[C@H](Oc1ccc(C(F)(F)F)cc1)c1ccc(Br)s1,C43265198_decoy,TRY1,Decoy,0,-8.02705,-4.56,-0.79,-4.831832057418621
C[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)Cc1ccc(Cl)cc1,C43286446_decoy,TRY1,Decoy,0,-7.59988,-5.24,-1.62,-5.020641939073699
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)Cc1cc(Br)cs1,C43287117_decoy,TRY1,Decoy,0,-9.22939,-3.88,-3.6,-5.391846981028132
CC[C@H]([NH3+])Cc1c(-c2ccccc2)nn(C)c1Sc1ccc(Br)cc1,C44400934_decoy,TRY1,Decoy,0,-8.42719,-6.66,-2.73,-7.823878408250595
C[C@@H]([NH3+])Cc1c(-c2ccccc2)nn(C)c1Sc1ccc(C(C)(C)C)cc1,C44460693_decoy,TRY1,Decoy,0,-5.94826,-6.68,-3.54,-5.580460647861417
CN(Cc1ccccc1Br)[C@H](C[NH3+])c1cc(Br)ccc1F,C48892363_decoy,TRY1,Decoy,0,-9.26548,-4.7,-1.48,-5.3673479632258605
COc1ccc([C@@H](C[NH3+])N(C)Cc2ccc(Cl)s2)cc1Br,C48971697_decoy,TRY1,Decoy,0,-10.1024,-4.17,-0.36,-5.605297121042169
CCN(c1cccc(C)c1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50361996_decoy,TRY1,Decoy,0,-8.70369,-4.78,-0.59,-5.165357870610937
C[C@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)CCCSc1ccccc1Cl,C58356718_decoy,TRY1,Decoy,0,-8.74965,-6.02,-2.0,-5.761425744576622
CCN(CC)c1ccc2cc(C(N)=S)/c(=[NH+]/c3cccc(Cl)c3)oc2c1,C59170897_decoy,TRY1,Decoy,0,-7.707,-5.61,-1.6,-4.6433046312285295
CC[C@H]([NH3+])[C@@H](Sc1nnc2ccccn12)c1ccc(Br)s1,C61406045_decoy,TRY1,Decoy,0,-8.4095,-6.22,-2.46,-5.945648932540555
CCOc1ccc(NC(=S)NCc2ccc3c(c2)=C2CCCC[C@H]2[NH+]=3)cc1,C63486099_decoy,TRY1,Decoy,0,-7.89447,-7.35,-1.24,-7.969410132025785
C[C@H]1[NH+]=c2ccc(F)cc2=C1CCNC(=S)Nc1ccc(Br)cc1,C63663924_decoy,TRY1,Decoy,0,-8.47573,-7.23,-3.19,-7.188472368868892
C[C@@H]1[NH+]=c2ccc(Cl)cc2=C1CCNC(=S)Nc1cccc(Br)c1,C63664033_decoy,TRY1,Decoy,0,-8.92167,-7.07,-0.72,-5.640812144735674
OCC1CCN(c2ccc(C[NH2+]Cc3cccc(Cl)c3Cl)cc2)CC1,C67247438_decoy,TRY1,Decoy,0,-8.45972,-6.62,-1.79,-5.53878229591432
Cc1cccc(OC[C@@H](O)C[NH+]2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c1,C67486439_decoy,TRY1,Decoy,0,-8.75538,-7.32,-1.77,-6.066316468720593
CCNC(=O)[C@@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@@H](O)[C@H]1O,C03872015_decoy,TRY1,Decoy,0,-7.81329,-5.92,-2.0,-5.903753065753455
CCNC(=O)[C@@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@@H](O)[C@@H]1O,C03872017_decoy,TRY1,Decoy,0,-6.32964,-8.12,-4.43,-6.423109610356333
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(SCc1ccccc1)SCc1ccccc1,C05734795_decoy,TRY1,Decoy,0,-8.65511,-6.91,-3.27,-8.792932876284423
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06135953_decoy,TRY1,Decoy,0,-8.21277,-8.24,-4.14,-8.344760247488608
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c(=O)oc2c1,C08764597_decoy,TRY1,Decoy,0,-7.51055,-7.44,-3.89,-6.065986167155609
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C)C(=O)NC[C@H]2CCCO2)cc1,C12715197_decoy,TRY1,Decoy,0,-8.44146,-6.72,-1.76,-7.434643525050701
COCCOC(=O)c1c(NC(=O)CSc2nnc(N)s2)sc(C(N)=O)c1C,C14013899_decoy,TRY1,Decoy,0,-9.27094,-5.89,-2.26,-6.537712024705187
NC(=O)CC[C@@H](NC(=O)c1cc(Cl)c(NCc2cnc3nc(N)nc(N)c3n2)c(Cl)c1)C(N)=O,C17421398_decoy,TRY1,Decoy,0,-9.12008,-8.24,-2.35,-9.007472636589268
CC(C)CC(=O)N[C@@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177670_decoy,TRY1,Decoy,0,-11.0499,-5.93,-2.41,-10.906550204808328
CC(C)CC(=O)N[C@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177669_decoy,TRY1,Decoy,0,-11.5453,-4.63,-1.64,-8.869599813377295
CCCC(=O)N[C@@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177630_decoy,TRY1,Decoy,0,-11.1745,-5.45,-2.66,-6.9940188707344575
CCCC(=O)N[C@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177629_decoy,TRY1,Decoy,0,-11.6045,-5.2,-1.68,-6.555468469514229
C=CCc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3nccs3)n2N)c1O,C20527560_decoy,TRY1,Decoy,0,-9.66571,-7.84,-1.73,-7.436545685861112
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)cc1,C20832856_decoy,TRY1,Decoy,0,-10.0518,-7.55,-3.51,-9.13153596984874
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1)c1cccs1,C20835950_decoy,TRY1,Decoy,0,-10.8233,-7.47,-3.84,-7.571353328966832
CC(=O)Nc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(C(C)C)c2C)n1N,C20912004_decoy,TRY1,Decoy,0,-9.41813,-8.83,-3.57,-8.519589207934157
CC(=O)Nc1ccccc1NC(=O)CCSc1nnc(N/N=C/c2ccc(C)cc2)n1N,C20918193_decoy,TRY1,Decoy,0,-7.99127,-7.83,-1.58,-6.528012323927827
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@@H]1O[C@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]1O,C22066094_decoy,TRY1,Decoy,0,-5.65393,-7.55,-3.46,-6.07831404146714
CC/C=C/C/C=C/C/C=C/C=C/C=C/[C@@H](SC[C@H]([NH3+])C(=O)NCC(=O)[O-])[C@@H](O)CCCC(=O)[O-],C04556800_decoy,TRY1,Decoy,0,-9.88987,-5.15,-3.67,-6.197629475846782
CC/C=C/C/C=C/C/C=C/C=C/C=C/[C@H](SC[C@H]([NH3+])C(=O)NCC(=O)[O-])[C@@H](O)CCCC(=O)[O-],C04556799_decoy,TRY1,Decoy,0,-10.5679,-6.3,-3.08,-7.40445760332178
CCCCCC[C@@H](O)CCCCCC/C=C/[C@H](O)[C@@H](OC(C)=O)[C@H](O)[C@H]([NH3+])C(=O)[O-],C31156841_decoy,TRY1,Decoy,0,-9.45764,-5.62,-3.18,-7.909876247369416
CCCCCC[C@H](O)CCCCCC/C=C/[C@H](O)[C@@H](OC(C)=O)[C@H](O)[C@H]([NH3+])C(=O)[O-],C31156846_decoy,TRY1,Decoy,0,-8.61281,-5.67,-3.32,-6.354827762077115
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C31163236_decoy,TRY1,Decoy,0,-9.27877,-9.68,-3.03,-8.800056249186103
C[C@](O)(CC(=O)[O-])CC(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C31167901_decoy,TRY1,Decoy,0,-5.60992,-5.93,-3.22,-5.373979705467952
CN1C(O)=C(C(=O)C[C@@H](NC(CO)(CO)CO)c2cccs2)C(=O)[C@H]2C=CC=C[C@H]21,C13406212_decoy,TRY1,Decoy,0,-8.75557,-6.25,-1.44,-6.440066165837962
CN1C(O)=C(C(=O)C[C@@H](NC(CO)(CO)CO)c2cccs2)C(=O)[C@H]2C=CC=C[C@@H]21,C13406216_decoy,TRY1,Decoy,0,-8.65647,-6.16,-2.8,-6.306728716607629
CC/C=C/C/C=C/C/C=C/C=C/C=C/[C@H](SC[C@H]([NH3+])C(=O)NCC(=O)[O-])[C@H](O)CCCC(=O)[O-],C04556797_decoy,TRY1,Decoy,0,-8.0406,-7.18,-3.15,-6.668431846624661
CC/C=C/C/C=C/C/C=C/C=C/C=C/[C@@H](SC[C@H]([NH3+])C(=O)NCC(=O)[O-])[C@H](O)CCCC(=O)[O-],C04556798_decoy,TRY1,Decoy,0,-9.3786,-6.77,-3.88,-6.591038968348516
CCCCCCC(=O)CCCCCC/C=C/[C@H](OC(C)=O)[C@@H](O)[C@H](O)[C@](C)([NH3+])C(=O)[O-],C35458484_decoy,TRY1,Decoy,0,-10.4821,-5.38,-4.11,-7.874640832650586
CCCCCCN(C(=O)CO)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36517761_decoy,TRY1,Decoy,0,-7.60111,-8.12,-4.08,-8.404097017407961
Oc1ccc(CCCC[C@@H](CCc2ccc(O)cc2)O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,C36378828_decoy,TRY1,Decoy,0,-7.56653,-8.43,-2.91,-7.454180083171797
Oc1ccc(CCCC[C@H](CCc2ccc(O)cc2)O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,C36378831_decoy,TRY1,Decoy,0,-7.09459,-8.26,-3.48,-7.561513916233811
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@H](O)[C@H]1O,C04475123_decoy,TRY1,Decoy,0,-7.22526,-6.26,-2.52,-5.750175171269016
CCC[C@@H](C(=O)NC1CCCC1)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04374130_decoy,TRY1,Decoy,0,-8.50806,-7.05,-2.06,-8.268183296603967
CC(C)C[C@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06190441_decoy,TRY1,Decoy,0,-7.28456,-7.08,-4.28,-7.587283027791955
CCCCCC[C@H](O)CCCCCC/C=C/[C@H](OC(C)=O)[C@@H](O)[C@H](O)[C@H]([NH3+])C(=O)[O-],C36374489_decoy,TRY1,Decoy,0,-9.1577,-6.39,-3.49,-8.4852909475453
CCCCCC[C@@H](O)CCCCCC/C=C/[C@H](OC(C)=O)[C@@H](O)[C@H](O)[C@H]([NH3+])C(=O)[O-],C36374491_decoy,TRY1,Decoy,0,-9.86064,-5.43,-2.34,-7.751642901966917
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@H](O)[C@@H]1O,C03918045_decoy,TRY1,Decoy,0,-6.51551,-8.32,-1.45,-6.213371467359432
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@@H](O)[C@@H]1O,C03872016_decoy,TRY1,Decoy,0,-6.45444,-6.0,-2.79,-4.889435009687337
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@@H](O)[C@H]1O,C03872014_decoy,TRY1,Decoy,0,-6.84736,-5.76,-1.6,-5.887478690989991
COc1c(C)c(OC/C=C(\C)C(=O)OC[C@H](O)[C@H](O)[C@H](O)CO)cc(CO)c1CO,C39559841_decoy,TRY1,Decoy,0,-7.70696,-6.39,-3.62,-5.810536927434447
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]1O,C39937412_decoy,TRY1,Decoy,0,-6.28714,-6.04,-2.26,-5.7362130573566406
CCCCC[C@H](O)/C=C/[C@H]1[C@@H](C/C=C\CCCC(=O)OC[C@H](O)CO)[C@@H](O)C[C@H]1O,C43771970_decoy,TRY1,Decoy,0,-10.2977,-6.98,-3.03,-7.794768350201415
CC(C)Cc1cc(-c2ccc(CC[NH2+]C[C@H](O)c3ccc(N)nc3)cc2)ccc1C(=O)[O-],C45498386_decoy,TRY1,Decoy,0,-8.40597,-7.91,-2.51,-6.271842478265292
CCO/C([O-])=C1\C(COCCNC(=O)NCC[NH3+])=NC(C)=C(C(=O)OC)[C@@H]1c1ccccc1Cl,C27656497_decoy,TRY1,Decoy,0,-8.05265,-7.1,-2.87,-8.399976175892066
S=C(N/N=C1/CCC=C(NNC(=S)Nc2ccccc2Cl)C1)Nc1ccccc1Cl,C03306025_decoy,TRY1,Decoy,0,-10.4442,-7.54,-2.68,-7.598388049272838
C=CCc1cccc(/C=N/Nc2nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]2)c1O,C59878803_decoy,TRY1,Decoy,0,-8.81556,-7.54,-3.56,-7.960587308345002
COc1cccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)c1O,C59879509_decoy,TRY1,Decoy,0,-8.15508,-8.3,-3.78,-7.462644053685334
CCCCC[C@H](O)/C=C/[C@H]1[C@@H](C/C=C\CCCC(=O)OC[C@@H](O)CO)[C@@H](O)C[C@H]1O,C64857598_decoy,TRY1,Decoy,0,-9.23551,-5.25,-2.79,-6.02610808800111
CC(=O)N[C@@H](C=O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)[C@H](O)CO,C04535955_decoy,TRY1,Decoy,0,-7.8382,-4.15,-4.66,-5.76048132089775
CC(=O)N[C@H](C=O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)[C@H](O)CO,C04535956_decoy,TRY1,Decoy,0,-7.7311,-4.83,-1.97,-5.777726938561126
CC(=O)N[C@H](C=O)[C@@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)[C@H](O)CO,C04535961_decoy,TRY1,Decoy,0,-7.41366,-4.8,-3.05,-5.688735608118497
CC(=O)N[C@@H](C=O)[C@H](O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)CO,C04546309_decoy,TRY1,Decoy,0,-6.88829,-4.77,-3.23,-5.597791804600824
CC(=O)N[C@H](C=O)[C@H](O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)CO,C04546317_decoy,TRY1,Decoy,0,-7.30484,-4.81,-2.42,-5.525909774056983
CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)CO,C04546322_decoy,TRY1,Decoy,0,-7.38124,-6.04,-3.94,-5.879902352525552
O[C@@H](C[NH2+]CCCCCC[NH2+]C[C@H](O)COc1ccccc1)COc1ccccc1,C04602728_decoy,TRY1,Decoy,0,-7.93844,-5.62,-3.15,-6.072664223979963
O[C@H](C[NH2+]CCCCCC[NH2+]C[C@@H](O)COc1ccccc1)COc1ccccc1,C04602730_decoy,TRY1,Decoy,0,-6.98554,-5.17,-2.42,-5.780667378954126
CC(C)[NH2+]C[C@@H](O)COc1cc2ccccc2cc1OC[C@H](O)C[NH2+]C(C)C,C04655706_decoy,TRY1,Decoy,0,-8.29026,-6.14,-1.69,-8.006223004508747
C[NH+](CCO)C[C@H](O)COc1ccc(OC[C@H](O)C[NH+](C)CCO)cc1,C04764997_decoy,TRY1,Decoy,0,-7.45134,-5.42,-3.75,-5.718638723810485
Nc1nc(Cl)cc(NCCCCCCNc2cc(Cl)nc(N)n2)n1,C01620413_decoy,TRY1,Decoy,0,-7.99926,-7.14,-2.96,-6.899359664182211
CCc1cccc(C)c1NC(=S)NNC(=O)[C@@H](CCSC)NC(N)=O,C07258103_decoy,TRY1,Decoy,0,-9.21075,-6.41,-1.34,-6.506482282979524
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OCC(N)=O,C08253719_decoy,TRY1,Decoy,0,-8.60572,-5.69,-2.49,-6.466071192709795
OCC(CO)[NH2+]Cc1cccc(OC[C@H](O)C[NH+]2CCc3ccccc3C2)c1,C11950449_decoy,TRY1,Decoy,0,-8.73655,-8.14,-4.78,-6.834624842418264
OCC(CO)[NH2+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCc2ccccc2C1,C12441224_decoy,TRY1,Decoy,0,-8.24429,-6.58,-1.62,-9.064013144127708
OCC(CO)[NH2+]Cc1ccccc1OC[C@H](O)C[NH+]1CCc2ccccc2C1,C12441226_decoy,TRY1,Decoy,0,-8.36157,-6.06,-2.96,-6.156873893342419
CCCCCCC(=O)CCCCCC/C=C/C[C@@H](O)[C@@H](O)[C@@]([NH3+])(CO)C(=O)[O-],C13515427_decoy,TRY1,Decoy,0,-7.09086,-4.78,-4.22,-5.506682254720627
CCCCCCC(=O)CCCCCC/C=C/C[C@@H](O)[C@H](O)[C@]([NH3+])(CO)C(=O)[O-],C13515786_decoy,TRY1,Decoy,0,-9.53226,-5.74,-3.55,-7.119877654699767
OCC(CO)[NH2+]Cc1cc(Cl)ccc1OC[C@@H](O)C[NH+]1CCCCCC1,C14975237_decoy,TRY1,Decoy,0,-8.89878,-7.4,-2.2,-7.436925846113824
O[C@H](C[NH2+]CCCCCC[NH2+]C[C@H](O)COc1ccccc1)COc1ccccc1,C15277015_decoy,TRY1,Decoy,0,-7.3901,-5.55,-2.07,-5.706001106759016
COC[C@H](C)NC(=S)NNC(=O)C(=O)NNC(=S)N[C@@H](C)COC,C16221212_decoy,TRY1,Decoy,0,-8.43122,-5.24,-1.27,-5.692039277300334
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@H](NC(=O)[C@H]([NH3+])CCCC[NH3+])[C@H]1O,C17021331_decoy,TRY1,Decoy,0,-9.28152,-7.8,-2.23,-7.272454355589663
CC(C)[NH2+]C[C@@H](O)COc1cc2ccccc2cc1OC[C@@H](O)C[NH2+]C(C)C,C17144018_decoy,TRY1,Decoy,0,-8.32987,-6.55,-2.69,-7.9664056165938835
CCN(CC[NH+](CC)CCN(CC)CC(N)=O)CC[NH+](CC)CC(N)=O,C19898991_decoy,TRY1,Decoy,0,-8.94346,-5.05,-2.03,-7.97420543757958
[NH3+]CCNC(=O)/C(Cc1c2ccccc2cc2ccccc12)=C(/[O-])NCC[NH3+],C25763585_decoy,TRY1,Decoy,0,-9.32306,-6.14,-1.3,-6.390726198678387
CCCCCCC(=O)CCCCCC/C=C/C[C@H](O)[C@@H](O)[C@]([NH3+])(CO)C(=O)[O-],C27643794_decoy,TRY1,Decoy,0,-8.94449,-5.42,-3.48,-7.334083655443273
COc1cc(CC[NH3+])c(Cc2cc(OC)c(OC)cc2CC[NH3+])cc1OC,C30769045_decoy,TRY1,Decoy,0,-7.33917,-5.18,-2.86,-5.366907787356894
Cc1[nH+]cc(COP(=O)([O-])[O-])c(C[NH2+]CCCC[C@H]([NH3+])C(=O)[O-])c1[O-],C34941080_decoy,TRY1,Decoy,0,-6.21717,-6.34,-2.68,-5.367433678982847
[NH3+]CCSSCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12,C35636581_decoy,TRY1,Decoy,0,-10.111,-5.36,-4.08,-7.008101921582346
[NH3+]CCSSCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C35636583_decoy,TRY1,Decoy,0,-10.2721,-5.55,-2.8,-7.298169165804367
[NH3+]CCSSCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C35636585_decoy,TRY1,Decoy,0,-10.9402,-4.73,-1.86,-7.604575997759901
[NH3+]CCSSCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21,C35636586_decoy,TRY1,Decoy,0,-9.85624,-5.69,-2.75,-6.598787180425802
O[C@@H](C[NH2+]C1CCCCC1)CN1CCN(C[C@@H](O)C[NH2+]C2CCCCC2)CC1,C20436792_decoy,TRY1,Decoy,0,-10.4326,-5.44,-1.81,-6.35355299458934
CSCC[C@@H](NC(N)=O)C(=O)NNC(=S)Nc1cccc(C)c1C,C41957881_decoy,TRY1,Decoy,0,-8.68683,-6.68,-1.51,-6.731303022574473
N/C(=N/O)c1ccc(OCCCCCOc2ccc(/C(N)=N\O)nc2)cn1,C43077731_decoy,TRY1,Decoy,0,-7.1773,-7.01,-2.65,-6.4700825241824855
C=CCNC(=S)NN=C/C(=N\NC(=S)NCC=C)[C@H]([O-])[C@@H](O)[C@H](O)CO,C43224437_decoy,TRY1,Decoy,0,-7.60162,-5.31,-2.64,-5.720892325338812
CNc1cc(/C=C/c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc[nH+]1,C52627545_decoy,TRY1,Decoy,0,-10.1292,-8.43,-2.25,-7.781559509060549
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N(CC(N)=O)CC(N)=O,C61805084_decoy,TRY1,Decoy,0,-9.51711,-3.95,-2.57,-6.018846140069303
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)N(CC(N)=O)CC(N)=O,C61805089_decoy,TRY1,Decoy,0,-8.94036,-4.05,-3.83,-5.722814031933069
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(CC(N)=O)CC(N)=O,C61805094_decoy,TRY1,Decoy,0,-8.83631,-4.13,-5.34,-5.692466200037111
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N(CC(N)=O)CC(N)=O,C61805099_decoy,TRY1,Decoy,0,-9.95703,-3.34,-4.29,-5.265607835538507
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)N(CC(N)=O)CC(N)=O,C61805101_decoy,TRY1,Decoy,0,-8.58431,-3.71,-2.54,-5.443052688436267
CC(C)[NH2+]C[C@@H](O)COc1cccc2c1ccn2C[C@@H](O)C[NH2+]C(C)C,C32219247_decoy,TRY1,Decoy,0,-9.47312,-5.51,-2.14,-6.570444774440431
CC(C)[NH2+]C[C@@H](O)COc1cccc2c1ccn2C[C@H](O)C[NH2+]C(C)C,C32219249_decoy,TRY1,Decoy,0,-8.87013,-6.24,-3.42,-5.86921181709243
CC(C)[NH2+]C[C@H](O)COc1cccc2c1ccn2C[C@@H](O)C[NH2+]C(C)C,C32219248_decoy,TRY1,Decoy,0,-7.99138,-5.26,-3.26,-5.615542619324328
CCC[C@@](C)(COC(N)=O)COC(=O)N[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65743205_decoy,TRY1,Decoy,0,-6.60311,-5.82,-4.07,-5.129408997541064
CCC[C@](C)(COC(N)=O)COC(=O)N[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65743206_decoy,TRY1,Decoy,0,-6.53074,-5.17,-3.93,-4.892754650321197
CCC[C@@](C)(COC(N)=O)COC(=O)N[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65743207_decoy,TRY1,Decoy,0,-5.64278,-5.82,-2.65,-5.067776008885501
CCC[C@](C)(COC(N)=O)COC(=O)N[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65743208_decoy,TRY1,Decoy,0,-6.74695,-5.87,-3.54,-4.957676080858878
C=CCNC(=S)N/N=C/C(=N\NC(=S)NCC=C)[C@H]([O-])[C@H](O)[C@H](O)CO,C16855330_decoy,TRY1,Decoy,0,-9.81357,-5.59,-2.26,-7.292663212885203
CCCCCNC(=O)c1csc(CN(C(=O)Nc2ccc(OC)cc2)C(C)C)n1,C05096311_decoy,TRY1,Decoy,0,-7.67223,-7.05,-4.56,-6.036704997892595
CCOc1ccccc1Nc1nnc(S[C@H](C)C(=O)NCc2ccco2)s1,C04843431_decoy,TRY1,Decoy,0,-7.53236,-6.79,-2.28,-5.706752247135964
CCc1ccc(CNc2nc(NCc3ccc(CC)cc3)n(S(C)(=O)=O)n2)cc1,C04703245_decoy,TRY1,Decoy,0,-9.28768,-8.12,-1.84,-6.450035318814323
CCSc1nc(NC(C)C)c2cnn(CCNC(=O)c3ccccc3SC)c2n1,C08948743_decoy,TRY1,Decoy,0,-8.84495,-6.85,-3.12,-7.958927934918558
CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](NC(=O)c2ccc(F)cc2)C(C)C)c(OC)c1,C10000827_decoy,TRY1,Decoy,0,-8.11313,-6.29,-1.84,-5.854988909655165
C=CCOc1c(/C=N/NC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)cccc1OC,C10001517_decoy,TRY1,Decoy,0,-8.98798,-5.93,-3.18,-6.365170305261199
CCOC(=O)C1=C(COC(=O)CSc2ccccc2C)NC(=O)N[C@H]1c1ccccc1,C10330399_decoy,TRY1,Decoy,0,-7.80057,-7.1,-4.0,-6.00264554133417
CCOC(=O)C1=C(COC(=O)CCSc2ccccc2)NC(=O)N[C@@H]1c1ccccc1,C10553877_decoy,TRY1,Decoy,0,-7.4881,-7.01,-2.75,-5.891653169661333
CCOc1ccccc1C(=O)NCC(=O)OCC(=O)N[C@@H](c1ccccc1)C(C)C,C10574639_decoy,TRY1,Decoy,0,-7.94341,-7.62,-3.82,-6.499834425466051
CCOC(=O)C1=C(COC(=O)Cc2cccs2)NC(=O)N[C@H]1c1ccc(Cl)cc1,C11298076_decoy,TRY1,Decoy,0,-8.42917,-6.58,-1.53,-7.263370484324161
CCCn1ccnc1SCC1=C(C(=O)OCC)[C@H](c2ccc(Cl)cc2)NC(=O)N1,C11394894_decoy,TRY1,Decoy,0,-8.23375,-5.9,-3.08,-5.852512731450744
C=CCNc1nnc(SCC(=O)N(CCC)CC(=O)Nc2ccccc2C)s1,C11526767_decoy,TRY1,Decoy,0,-8.83413,-6.45,-3.31,-7.083084385787899
COc1ccc(O[C@@H](C)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1,C11660564_decoy,TRY1,Decoy,0,-9.60645,-5.6,-2.45,-5.874218296115067
CCCC(=O)Nc1ccc(C(=O)[C@@H](C)Sc2nnc(NCc3ccco3)s2)cc1,C13001942_decoy,TRY1,Decoy,0,-7.57763,-7.54,-2.93,-6.282931514974646
CCN(CC)S(=O)(=O)c1ccc(NCC2([NH+](C)C)CCCCC2)c(C(=O)[O-])c1,C13091397_decoy,TRY1,Decoy,0,-7.10901,-6.23,-4.47,-5.140354953076766
CCC(C)(C)NC(=O)CN(C(=O)CCC(=O)Nc1cc(C)ccn1)c1cccc(C)c1C,C13503715_decoy,TRY1,Decoy,0,-7.45721,-7.15,-2.14,-6.952589654805242
COCCCNc1ncnc2sc(C(=O)N[C@H](c3ccccc3)c3ccco3)c(C)c12,C14967343_decoy,TRY1,Decoy,0,-7.44515,-7.07,-2.0,-5.782200845691469
CC[C@@H](C)[C@H](NC(=O)CCCCl)C(=O)Nc1nnc(-c2ccc(N(C)C)cc2)s1,C16606768_decoy,TRY1,Decoy,0,-10.2723,-6.62,-2.28,-8.07970504370557
CCOc1ccccc1NC(=O)COC(=O)[C@@H](NC(=O)c1ccccc1Cl)C(C)C,C18243255_decoy,TRY1,Decoy,0,-6.95363,-7.8,-3.39,-7.081776835550401
CCCN(Cc1ccc(C)cc1)C(=O)CSc1nnc(-c2ccc(OCC)cc2)n1N,C19352034_decoy,TRY1,Decoy,0,-7.03086,-7.23,-1.65,-6.184969582993768
CCOc1cc(C=NNC(=O)[C@@H](NC(=O)c2ccc(C)cc2)C(C)C)ccc1OC,C19720269_decoy,TRY1,Decoy,0,-9.68493,-6.28,-3.59,-6.6905110424247525
Cc1[nH]c(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)c(C)c1C(=O)OC(C)C,C22307087_decoy,TRY1,Decoy,0,-7.90298,-7.14,-2.68,-6.130587848258115
CC(C)c1ccc(C(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)c(C(C)C)c1,C22765200_decoy,TRY1,Decoy,0,-9.1801,-7.77,-4.07,-6.866803263632472
CCOc1cc(C(=O)NNC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)cc(OCC)c1OCC,C24713932_decoy,TRY1,Decoy,0,-8.62484,-5.54,-2.02,-5.597086296098944
O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(SCc2cccnc2)cc1,C25463265_decoy,TRY1,Decoy,0,-7.8534,-6.0,-4.52,-5.626333811001127
CCOC(=O)c1c(NC(=O)COc2ccc(C(C)(C)C)cc2)sc(C(=O)NC)c1C,C26889566_decoy,TRY1,Decoy,0,-9.56782,-6.5,-1.72,-6.335965545143148
CCOC(=O)c1sc(NC(=O)CSc2nnc(NCC(C)C)s2)cc1C,C29518613_decoy,TRY1,Decoy,0,-9.70854,-4.44,-2.61,-5.890507518744885
CCCCNC(=O)N1CCN(C(=O)[C@H](NC(=O)CC(C)(C)C)[C@@H](C)CC)C[C@H]1C,C35098171_decoy,TRY1,Decoy,0,-6.62933,-5.67,-2.62,-5.368507137221072
CCCCNC(=O)N1CCN(C(=O)[C@@H](NC(=O)C(C)(C)CCl)[C@@H](C)CC)C[C@@H]1C,C35098195_decoy,TRY1,Decoy,0,-7.63762,-3.89,-1.54,-4.719084099577004
CCCCNC(=O)N1CCN(C(=O)[C@@H](NC(=O)C(C)(C)CCl)[C@@H](C)CC)C[C@H]1C,C35098197_decoy,TRY1,Decoy,0,-8.29866,-6.07,-2.58,-5.765624799179224
CCOc1nc(-c2ccc(C)cc2)n(-c2ccc(NC[C@@H](O)COC(C)C)cc2)n1,C35742772_decoy,TRY1,Decoy,0,-7.66144,-6.68,-2.15,-7.347719062022522
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(Cc1ccc(C)o1)C(=O)CC(C)C,C36556293_decoy,TRY1,Decoy,0,-7.97084,-5.93,-1.21,-7.166439231846367
CC[C@@H](C)NC(=O)CCN(Cc1ccco1)C(=O)c1csc(Nc2ccccc2)n1,C37426258_decoy,TRY1,Decoy,0,-8.22765,-6.39,-1.82,-5.909376994382508
CCOc1ccccc1C(=O)NCC(=O)OCC(=O)Nc1c(Cl)cccc1Cl,C39590116_decoy,TRY1,Decoy,0,-7.49349,-7.71,-3.81,-6.431729753723513
COc1ccc(C)cc1NC(=O)COC(=O)[C@H](NC(=O)c1ccccc1Cl)C(C)C,C39611928_decoy,TRY1,Decoy,0,-8.4815,-7.36,-2.9,-7.687452421404926
CC(C)[C@H](NC(=O)c1cccs1)C(=O)O[C@@H](C)C(=O)Nc1ccccc1OC(F)F,C27931811_decoy,TRY1,Decoy,0,-7.39551,-7.53,-2.48,-7.038989616434765
CCOCCCN1C(=O)c2[nH]nc(-c3ccccc3O)c2[C@H]1c1ccc(OCC)cc1,C06744869_decoy,TRY1,Decoy,0,-7.00794,-6.2,-3.17,-5.884256713271129
COCCOC(=O)c1ccc(N[C@H](c2ccco2)c2ccc3cccnc3c2O)cc1,C54620255_decoy,TRY1,Decoy,0,-8.46442,-7.22,-0.9,-7.715763213391748
C/C=C/C=C/C(=O)Nc1ccc(N(CC)CC)c(S(=O)(=O)Nc2ccccc2OC)c1,C26638769_decoy,TRY1,Decoy,0,-7.52335,-5.21,-3.98,-4.836637518402342
CCCC(=O)Nc1ccc(C(=O)CSc2nnc(NCc3ccco3)s2)cc1,C07161916_decoy,TRY1,Decoy,0,-8.47869,-8.03,-1.46,-7.76708565345692
CCCC[C@]1(c2ccccc2)NC(=O)N(C[C@@H](O)COc2ccc(OCC)cc2)C1=O,C24096566_decoy,TRY1,Decoy,0,-8.08278,-7.07,-2.93,-6.838274952310082
CC[C@]1(c2ccc(OC)cc2)NC(=O)N(C[C@@H](O)COc2ccccc2C(C)C)C1=O,C58013135_decoy,TRY1,Decoy,0,-7.66712,-6.88,-2.03,-6.151424194231269
CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1,C58894773_decoy,TRY1,Decoy,0,-8.76495,-8.66,-2.28,-7.280433804132734
CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(Cl)c(OC)c(OCC)c2)cc1,C58894867_decoy,TRY1,Decoy,0,-9.67809,-6.76,-3.35,-8.09426503684044
C[C@H](OC(=O)CNS(=O)(=O)c1cccs1)C(=O)Nc1ccc(C(C)(C)C)cc1,C58938561_decoy,TRY1,Decoy,0,-8.53987,-7.92,-1.35,-6.971881050104825
CC(C)COC(=O)CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1,C59015623_decoy,TRY1,Decoy,0,-9.12167,-6.71,-2.77,-6.59073136890753
O=C(COc1ccc(Br)cc1)NCCCNc1ccc([N+](=O)[O-])cc1,C59400640_decoy,TRY1,Decoy,0,-7.3098,-6.56,-2.4,-5.275855061981582
C=CCn1c(CNc2ccc(C)cc2)nnc1SCC(=O)N/N=C(\C)CC(C)C,C59915683_decoy,TRY1,Decoy,0,-7.75273,-6.96,-1.22,-7.728064958119507
CCCCCOc1ccc([C@H]2C3=C(c4ccccc4O)N=N[C@H]3C(=O)N2CCCO)cc1,C09409204_decoy,TRY1,Decoy,0,-7.40552,-5.46,-1.59,-6.2563738693491375
CCCCOc1cccc([C@H]2C3=C(c4cc(C)ccc4O)N=N[C@@H]3C(=O)N2CCCO)c1,C21782749_decoy,TRY1,Decoy,0,-9.55287,-6.07,-1.33,-6.999142992540054
Cc1cc(C(=O)N[C@H]2CCN3C(=O)c4cc(-c5ccco5)ccc4NC(=O)[C@H]23)nn1C,C03839503_decoy,TRY1,Decoy,0,-7.84177,-7.3,-1.76,-4.876730550050083
O=C([O-])c1cn(-c2ccc([N+](=O)[O-])cc2)c2cc(N3CC[NH2+]CC3)c(F)cc2c1=O,C01914408_decoy,TRY1,Decoy,0,-6.51735,-6.21,-1.82,-4.928453249759568
CCOc1ccc([C@H]2C3=C(COC3=O)Nc3c2c(=O)[nH]c(=O)n3CC)cc1OC,C04495946_decoy,TRY1,Decoy,0,-7.64216,-7.24,-3.08,-7.722353091285488
COc1cc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc(OC)c1OC,C07758233_decoy,TRY1,Decoy,0,-7.80132,-6.34,-1.58,-6.661353452167195
Cc1[nH]c(=O)nc(SCC(=O)N2CC(=O)NC(=O)C23CCCCC3)c1C#N,C08883358_decoy,TRY1,Decoy,0,-6.53756,-6.5,-2.68,-4.806989590295629
Cn1ncc2c(SCC(=O)N3C[C@H](C(N)=O)Oc4ccccc43)ncnc21,C11685781_decoy,TRY1,Decoy,0,-7.5593,-6.82,-1.01,-5.208573022790925
CCn1c(CN2CCCCCC2=O)nnc1S[C@@H](C)C(=O)NC(=O)NC,C12127165_decoy,TRY1,Decoy,0,-8.4421,-5.39,-1.39,-5.627228596887812
Cc1nc(C)n([C@@H](C)CC(=O)N2CCC3(CC2)NC(=O)c2ccccc2N3)n1,C12145763_decoy,TRY1,Decoy,0,-7.41835,-7.98,-2.89,-5.949959082899515
CCn1cc(NC(=O)CCn2cc(Br)c(C)n2)c(C(=O)NC)n1,C02802441_decoy,TRY1,Decoy,0,-7.87503,-6.62,-2.05,-7.371833037136938
COc1ccc(-c2n[nH]cc2CN2CCN(C(=O)c3nnc[nH]3)CC2)c(F)c1,C20537166_decoy,TRY1,Decoy,0,-7.11311,-5.7,-1.64,-4.9860066374760414
COC(=O)c1c(NC(=O)C(=O)N2CCN(CCO)CC2)sc2c1CCC2,C20573446_decoy,TRY1,Decoy,0,-9.3516,-5.84,-2.43,-6.841760938885917
CSc1ccc(CN2CCc3nnc(CNC(=O)[C@H]4CCC(=O)N4)n3CC2)cc1,C15069643_decoy,TRY1,Decoy,0,-8.36802,-6.73,-1.78,-6.48741092770267
CCN(C(=O)[C@H](C)OC(=O)c1c(C)nsc1N)[C@H]1CCS(=O)(=O)C1,C25066782_decoy,TRY1,Decoy,0,-8.01035,-4.6,-3.51,-4.983285398812798
CC(=O)Nc1cccc([C@@H](C)NC(=O)CCn2cnc3c(cnn3C)c2=O)c1,C30271989_decoy,TRY1,Decoy,0,-6.96851,-7.45,-3.25,-5.363896756648845
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1,C31153376_decoy,TRY1,Decoy,0,-10.218,-7.01,-4.32,-6.7417217151595565
Cc1c([C@H]2C[C@@H](C(=O)Nc3ccc(C#N)cc3)N(C)S(=O)(=O)N2)cnn1C,C35360857_decoy,TRY1,Decoy,0,-8.08012,-5.11,-0.76,-4.8523575899751785
CC(=O)Nc1ccc([C@@H]2[C@H](S(=O)(=O)NC[C@@H]3CCCO3)CON2C)cc1,C35820216_decoy,TRY1,Decoy,0,-7.74964,-5.38,-4.4,-5.427492055719225
CNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C36569591_decoy,TRY1,Decoy,0,-6.58085,-5.1,-0.68,-5.017697193083096
CCN1C(=O)/C(=C\Nc2c(C)n(C)n(-c3ccccc3)c2=O)C(=O)NC1=S,C16977465_decoy,TRY1,Decoy,0,-7.16991,-7.91,-1.32,-6.078759589797086
Cc1n[nH]c(=O)c2c1[C@@H](C)O[C@H]2NC(=O)CSc1nnc2n1CCCCC2,C39460461_decoy,TRY1,Decoy,0,-8.05592,-8.19,-1.78,-5.53249880002527
COC1=C[C@H]2C[NH+]3N[P@@](=O)([O-])OC[C@H]3C[C@H]2C=C1S(=O)(=O)C(C)C,C39469287_decoy,TRY1,Decoy,0,-6.40012,-5.04,-0.31,-3.684576456333297
O=C(CCc1cc2cc3c(cc2[nH]c1=O)OCCO3)N[C@H]1CCS(=O)(=O)C1,C41187336_decoy,TRY1,Decoy,0,-8.3257,-7.74,-1.59,-6.045392106242916
C[C@@]1(c2ccc(C(F)(F)F)cc2)NC(=O)N(CC(=O)N2CCNC2=O)C1=O,C42178839_decoy,TRY1,Decoy,0,-6.24515,-5.5,-1.71,-4.811273642859616
CCN1C(=O)[C@H]2[C@@H](c3cn(C(C)=O)c4ccccc34)[NH2+][C@](C(=O)[O-])(C(C)C)[C@@H]2C1=O,C43211697_decoy,TRY1,Decoy,0,-6.9544,-5.33,-2.19,-4.821951076593356
C[C@]1(C(=O)[O-])[NH2+][C@@H](c2cccs2)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21,C43218617_decoy,TRY1,Decoy,0,-6.97879,-6.96,-1.63,-6.534087102793897
CC[C@@H](C)[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc3c(c2)OCCO3)[C@H]2C(=O)N(C(C)(C)C)C(=O)[C@@H]21,C43221798_decoy,TRY1,Decoy,0,-6.17005,-6.22,-2.57,-4.6412790974776135
C[C@@H](CNC(=O)[C@@]12CC[C@@](C)(C(=O)O1)C2(C)C)NC(=O)[C@]12CC[C@](C)(C(=O)O1)C2(C)C,C43618837_decoy,TRY1,Decoy,0,-7.44436,-6.13,-2.84,-5.396260184610082
CN1CCc2nc(NC(=O)CCNC3=NS(=O)(=O)c4ccccc43)sc2C1,C18104050_decoy,TRY1,Decoy,0,-9.20993,-7.67,-0.75,-6.985154603800708
Cc1[nH]n(-c2ccccc2)c(=O)c1[C@@]1(C(F)(F)F)C(=O)Nc2c1c(=O)n(C)c(=O)n2C,C03636115_decoy,TRY1,Decoy,0,-6.67867,-6.89,-1.3,-4.732348496412374
Cc1nn(C)c2ncc(NC(=O)C(=O)N3CCC[C@H](C(=O)NC4CC4)C3)cc12,C51840079_decoy,TRY1,Decoy,0,-7.05399,-6.47,-1.61,-5.052916687470813
CNS(=O)(=O)c1ccc([C@@H](C)Nc2c(C#N)c(=O)n(C)c(=O)n2C)cc1,C53577400_decoy,TRY1,Decoy,0,-6.72984,-6.29,-3.61,-4.531295352881265
Cc1c([C@@H]2C[C@@H](C(=O)Nc3sc4c(c3C#N)CCC4)N(C)S(=O)(=O)N2)cnn1C,C57730538_decoy,TRY1,Decoy,0,-8.71809,-5.8,-1.36,-5.248158130880493
Cn1cc(Br)cc1C(=O)NNC(=O)c1cnc2n(c1=O)CCS2,C33234632_decoy,TRY1,Decoy,0,-9.43127,-5.34,-2.09,-6.102970884097608
CS(=O)(=O)c1ccc2nc(NC(=O)C(=O)Nc3nncs3)sc2c1,C59770863_decoy,TRY1,Decoy,0,-8.9261,-4.67,-1.75,-5.831878270200068
CC[C@H](C)N(C(=O)CSC1=NC(=O)CC(N)=N1)[C@@H]1CCS(=O)(=O)C1,C63216970_decoy,TRY1,Decoy,0,-7.01208,-6.68,-1.22,-8.633554847619745
Cc1csc(NC(=O)CCC2=N[C@H](NC(=O)C3=CCC(=O)N=C3)SC2)n1,C64409357_decoy,TRY1,Decoy,0,-9.17707,-6.75,-2.77,-6.414948541360418
O=C(C1=C[C@@H]2N=CC=C2C=C1)N1CCN(C(=O)[C@@H]2C=C(c3ccncc3)NN2)CC1,C64469999_decoy,TRY1,Decoy,0,-8.27416,-5.48,-0.55,-5.365272728983544
CC(=O)N1N/C(=C2/C(=O)NC(=O)N(C3CCCCC3)C2=O)C[C@@H]1c1cccnc1,C64788951_decoy,TRY1,Decoy,0,-7.48221,-6.73,-2.37,-5.723144809150701
Cn1c(=O)c(=O)[nH]c2cc(C3=NO[C@H]([C@H]4CC(=O)N(c5ccccc5)C4)N3)ccc21,C64890561_decoy,TRY1,Decoy,0,-8.06128,-8.63,-2.91,-5.666935832548697
Cc1nn(C(C)C)c(C)c1NC(=O)c1cc(S(=O)(=O)N2CCOCC2)c[nH]1,C65002984_decoy,TRY1,Decoy,0,-8.04869,-6.25,-4.21,-5.718305005066594
CSc1ccc(NC(=O)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)cn1,C66210097_decoy,TRY1,Decoy,0,-8.20658,-5.87,-1.67,-5.479914163678076
O=C(NCc1n[nH]c(=S)n1C1CC1)c1nnn(-c2ccc(F)cc2)c1C1CC1,C66638425_decoy,TRY1,Decoy,0,-8.22674,-7.67,-3.31,-7.541861824488529
CC1CCC(N2C[C@@H](C(=O)N3CCC4(CC3)NC(=O)NC4=O)CC2=O)CC1,C66820899_decoy,TRY1,Decoy,0,-7.47586,-7.29,-0.66,-5.484398464617729
CC1CCC(N2C[C@@H](C(=O)NNC(=O)C[C@H]3CCS(=O)(=O)C3)CC2=O)CC1,C66928625_decoy,TRY1,Decoy,0,-9.23609,-5.59,-1.75,-5.830733652080456
Cc1cc(F)cc2c1N(C(=O)C(=O)NCCCN1C(=O)CNC1=O)CCC2,C67000084_decoy,TRY1,Decoy,0,-6.73545,-7.15,-2.06,-5.095132895637574
CN(C)C(=O)N1CCN(C(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67162958_decoy,TRY1,Decoy,0,-6.87567,-6.25,-1.54,-4.912974649684808
CCCc1c(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)[nH]c(C)c1C(C)=O,C67278706_decoy,TRY1,Decoy,0,-8.26201,-5.23,-1.78,-5.749409694730394
O=C(NCc1nnc2n1CCCCC2)C(=O)Nc1ccn(-c2ccccc2)n1,C67492458_decoy,TRY1,Decoy,0,-7.27108,-8.52,-1.54,-6.433644384991491
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)N1CCN(C(=O)C(=O)NC(C)C)CC1,C67535213_decoy,TRY1,Decoy,0,-6.82789,-6.72,-2.32,-6.033647517164782
CNC(=O)[C@@H](NC(=O)c1cn(CC(=O)N(C)C)nn1)c1ccc(F)c(F)c1,C67571647_decoy,TRY1,Decoy,0,-8.26969,-5.73,-0.71,-5.772492115971757
Cn1c(N)c(C(=O)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(=O)n(C)c1=O,C01596690_decoy,TRY1,Decoy,0,-5.71906,-6.63,-1.37,-4.790713343540722
CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@H](CO)O[C@@H]1n1cnc2c(=O)[nH]c(N)nc21,C04543654_decoy,TRY1,Decoy,0,-6.10778,-7.34,-0.74,-9.15119579487596
O=C1NC(=O)C(C(c2ccc([N+](=O)[O-])cc2)C2C(=O)NC(=O)NC2=O)C(=O)N1,C01863755_decoy,TRY1,Decoy,0,-6.47435,-6.86,-1.3,-5.189553618660784
O=C(CNC(=O)c1ccccc1Cl)N/N=C/c1cc(=O)[nH]c(=O)[nH]1,C01877440_decoy,TRY1,Decoy,0,-7.14649,-7.47,-1.5,-6.33832039640814
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1C(=O)C[C@H]2C,C05015104_decoy,TRY1,Decoy,0,-6.16203,-5.56,-1.38,-4.728157767648892
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@@H]1C(=O)C[C@@H]2C,C05015109_decoy,TRY1,Decoy,0,-6.93185,-5.0,-0.74,-4.509009022094732
N#C/C(=C\c1c(N2CCC(C(N)=O)CC2)nc2ccccn2c1=O)C(N)=O,C02209064_decoy,TRY1,Decoy,0,-6.64147,-6.1,-0.95,-4.839007462418723
COC1=C(C)C(=O)c2c(c(COC(N)=O)c3n2CC[C@@H]3OC(N)=O)C1=O,C01578026_decoy,TRY1,Decoy,0,-6.5012,-6.32,-1.24,-5.602340922460031
CSc1nc2c(nnn2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=O)n1C,C05760129_decoy,TRY1,Decoy,0,-5.22655,-4.78,-2.51,-3.4607839809673555
CC(=O)N[C@H]1[C@@H](OC2=C[C@@H]3OC(=O)CC(C)=C3C=C2)O[C@H](CO)[C@H](O)[C@H]1O,C13382198_decoy,TRY1,Decoy,0,-8.71808,-5.8,-1.89,-5.472964229971774
O=C1NC(=O)C(C(c2ccccc2[N+](=O)[O-])C2C(=O)NC(=O)NC2=O)C(=O)N1,C16449436_decoy,TRY1,Decoy,0,-5.69378,-5.72,-3.72,-4.516682062434269
COc1nc(N[C@H]2O[C@@H](OC)[C@H](O)[C@@H](O)[C@@H]2O)c(C(C)=O)c(=O)n1C,C16952251_decoy,TRY1,Decoy,0,-6.60138,-5.05,-2.7,-4.375597537944713
OC[C@@H]1O[C@H](n2cc(Br)c3c(NO)ncnc32)[C@@H](O)[C@@H]1O,C17419753_decoy,TRY1,Decoy,0,-6.71338,-5.09,-0.44,-4.701803772080194
C[C@@H](Nc1n[nH]c(=O)[nH]c1=O)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1,C16994027_decoy,TRY1,Decoy,0,-6.58203,-6.32,-2.53,-4.823664806592984
N#CC1=C(N)N(c2ccc(Cl)cc2)C2=C(C(=O)OC2)[C@]12C(=O)N(CC(N)=O)c1ccccc12,C20745831_decoy,TRY1,Decoy,0,-6.46598,-6.59,-2.99,-5.47264253634049
C=CCn1c(-c2ccncc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C22172811_decoy,TRY1,Decoy,0,-5.96576,-5.58,-2.57,-4.595416709419876
Cn1ccc(C(=O)NCCCNC(=O)c2ccn(C)c(=O)c2O)c(O)c1=O,C26576164_decoy,TRY1,Decoy,0,-6.6293,-7.46,-3.53,-6.314421327164509
Cn1cc(C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cc1C(N)=O,C31851275_decoy,TRY1,Decoy,0,-6.44427,-7.12,-2.37,-6.408194130063595
O=C(O[C@H]1[C@H](O)[C@H](O)O[C@@H](CO)[C@H]1O)c1cc2ccccc2oc1=O,C32603119_decoy,TRY1,Decoy,0,-6.16614,-7.83,-1.57,-7.471696550573847
CC(=O)N[C@H]1[C@@H](OC2=C[C@@H]3OC(=O)C=C(C)[C@@H]3C=C2)O[C@@H](CO)[C@@H](O)[C@H]1O,C35052812_decoy,TRY1,Decoy,0,-8.3863,-6.56,-2.99,-5.690008447205688
C/C=C1\COC(=O)C[C@@H]1/C(=C\O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(=O)OC,C35459011_decoy,TRY1,Decoy,0,-6.50777,-5.5,-1.48,-4.891607980215291
C/C=C1\COC(=O)C[C@H]1/C(=C\O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(=O)OC,C35459014_decoy,TRY1,Decoy,0,-6.86729,-5.2,-1.91,-4.787391043163247
NNc1nc2sccn2c1S(=O)(=O)N[C@@H]1CCS(=O)(=O)C1,C37555936_decoy,TRY1,Decoy,0,-7.64659,-5.03,-2.06,-4.98684082959068
CO[C@@H]1O[C@@H](COC(=O)CNC(=O)OC(C)(C)C)[C@@H](O)[C@H](O)[C@@H]1O,C04322519_decoy,TRY1,Decoy,0,-6.3568,-6.04,-3.08,-6.268661604082292
O=C1N=CN=C2C1=N[C@H](N1CCN(CCO)CC1)N2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C38549893_decoy,TRY1,Decoy,0,-8.13355,-6.24,-1.77,-6.080954313493976
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(C2CC2)N1C,C38770053_decoy,TRY1,Decoy,0,-8.69827,-7.63,-1.27,-7.138571442512852
COc1cc(/C=N/NC(=O)[C@H](C)N[C@H]2N=NC(=O)NC2=O)ccc1O,C38810818_decoy,TRY1,Decoy,0,-7.34559,-7.05,-1.31,-6.246288398290216
C[C@H](N[C@H]1N=NC(=O)NC1=O)C(=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1,C38811080_decoy,TRY1,Decoy,0,-7.45655,-5.35,-1.78,-5.225024037250031
CNC(=O)NC(=O)CSc1nnc(Cc2c(C)[nH]c(=O)[nH]c2=O)o1,C38924769_decoy,TRY1,Decoy,0,-6.4294,-5.94,-4.18,-5.186213288766847
CC1=N[C@H](NN)[C@@H]2C(=O)NN=C(C[C@@H]3C=NN=C3c3cccc([N+](=O)[O-])c3)C2=C1,C39217826_decoy,TRY1,Decoy,0,-6.07747,-5.67,-0.73,-4.905356648045196
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)OCC(=O)NC(N)=O)C2=O,C22208389_decoy,TRY1,Decoy,0,-7.8729,-7.98,-2.7,-7.091244770104182
O=C1N=CN=C2C1=N[C@@H](N1CCN(CCO)CC1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39697835_decoy,TRY1,Decoy,0,-7.05739,-6.41,-1.51,-5.24323016030529
O=C1N=CN=C2C1=N[C@@H](NCc1ccccc1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39699646_decoy,TRY1,Decoy,0,-6.18939,-7.82,-0.95,-7.221398948604745
NC(=O)NC(=O)C[C@@H]1S/C(=N/N=C2\C(=O)Nc3ccccc32)NC1=O,C39881909_decoy,TRY1,Decoy,0,-7.41154,-6.34,-0.86,-6.162273474707297
Cn1cc(CCNC(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1,C42890748_decoy,TRY1,Decoy,0,-7.6201,-7.48,-2.08,-9.528993021349413
O=C(O[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@@H]1O)c1cc2ccccc2oc1=O,C44608789_decoy,TRY1,Decoy,0,-6.29222,-6.64,-1.22,-4.989420156319016
COCc1[nH]nc2c1[C@@]1(C(=O)Nc3ccc([N+](=O)[O-])cc31)C(C#N)=C(N)O2,C09329171_decoy,TRY1,Decoy,0,-4.65962,-5.17,-2.52,-3.0967813995524462
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C20548389_decoy,TRY1,Decoy,0,-7.07459,-5.04,-1.14,-5.198787118177886
CC(=O)[C@@H](O)[C@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)[C@@](O)(C(C)=O)[C@@]1(O)C(C)=O,C22116279_decoy,TRY1,Decoy,0,-6.83165,-8.13,-1.85,-7.960866836996341
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C1/C(=O)Nc3ccccc31)n2CCO,C08386813_decoy,TRY1,Decoy,0,-7.41681,-6.14,-1.48,-5.856313163010287
COc1cc(/C=N/Nc2nc(SCCO)n[nH]2)c([N+](=O)[O-])cc1O,C59820582_decoy,TRY1,Decoy,0,-7.30584,-7.11,-1.87,-7.144904532298452
O=C(CNC(=O)NCc1ccco1)NNC(=O)[C@@H]1COc2ccccc2O1,C56075356_decoy,TRY1,Decoy,0,-7.62424,-7.68,-3.91,-6.725097684391931
NC(=O)C1CCN(c2nc3c(c(=O)[nH]2)[C@H](c2cccnc2)CC(=O)N3)CC1,C61720088_decoy,TRY1,Decoy,0,-8.28164,-6.96,-3.19,-5.348043552070048
O=C(CNc1n[nH]c(=O)[nH]c1=O)N/N=C/c1ccc(Br)o1,C05594870_decoy,TRY1,Decoy,0,-7.95379,-6.81,-1.5,-6.230269896684651
COCCCNC(=O)[C@H]1N[C@@H](CC(=O)NC2=C[C@H]3N=CC=C3C=C2)NO1,C63818231_decoy,TRY1,Decoy,0,-7.31343,-5.61,-1.57,-5.80220852820243
O=C(/C=C/c1ccco1)NCCC(=O)NNC(=O)NC[C@@H]1CCCO1,C65146256_decoy,TRY1,Decoy,0,-8.02295,-6.61,-1.39,-6.925728100753139
CC(C)CNC(=O)NNC(=O)CNC1=NS(=O)(=O)c2ccccc21,C65181011_decoy,TRY1,Decoy,0,-7.23658,-6.66,-1.66,-5.6095865011270645
Nc1c(C(=O)CN2CCC[C@@H](C(=O)NC3CC3)C2)c(=O)[nH]c(=O)n1C1CC1,C51046226_decoy2,TRY1,Decoy,0,-7.82579,-7.76,,-7.465879799924084
Cc1sc2[nH]c(CCC(=O)NCC(=O)Nc3cn[nH]c3)nc(=O)c2c1C,C51412584_decoy,TRY1,Decoy,0,-8.15524,-7.61,-3.34,-6.50389302751914
Cc1n[nH]c([C@H](C)NS(=O)(=O)c2sc3c(c2C(=O)[O-])CC[NH2+]C3)n1,C67447081_decoy,TRY1,Decoy,0,-8.10551,-6.93,-1.29,-7.478028909911675
C=CCOc1ccc(C2C3=C(CC(C)(C)CC3=O)N(CC(=O)[O-])C3=C2C(=O)CC(C)(C)C3)cc1Cl,C08437901_decoy,TRY1,Decoy,0,-8.33604,-5.24,-0.75,-5.188487156244732
Cc1ccc(C(=O)[O-])cc1N1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S,C08821532_decoy,TRY1,Decoy,0,-8.46629,-5.89,-3.01,-4.781234189187407
Cc1ccc([C@@H]2CC(=O)C3C(=Nc4ccccc4N(C(=O)CCC(=O)[O-])[C@H]3c3ccccc3Cl)C2)cc1,C09934343_decoy,TRY1,Decoy,0,-7.77133,-7.43,-3.07,-6.104950277809523
O=C([O-])c1ccc2c(=O)n(-c3ccc(F)cc3)c(SCc3cc(Cl)cc4c3OCOC4)nc2c1,C13016687_decoy,TRY1,Decoy,0,-8.73812,-7.6,-1.47,-5.674616379013351
O=C([O-])c1ccc2c(=O)n(-c3ccc(F)cc3)c(SCc3cc(Cl)cc4c3OCOC4)nc2c1,C13016687_decoy,TRY1,Decoy,0,-8.73812,-7.6,-2.83,-5.674616379013351
COc1cc(/C=C/C(=O)[O-])cc(Br)c1OS(=O)(=O)c1ccccc1Br,C13463081_decoy,TRY1,Decoy,0,-7.94367,-6.19,-2.14,-5.016086971067189
COc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3C(F)(F)F)C2=O)c(C(=O)[O-])c1OC,C16906189_decoy,TRY1,Decoy,0,-9.0205,-6.74,-3.32,-5.73832625353165
O=C([O-])/C=C/C(=O)N1CCN(c2nc(-c3ccccc3Cl)c3cc(Br)ccc3n2)CC1,C10151832_decoy,TRY1,Decoy,0,-10.3398,-6.12,-1.88,-7.154778327852127
O=C1N=C([O-])/C(=C/c2cn(Cc3ccccc3)c3ccccc23)C(=O)N1c1ccc(Br)cc1,C09013980_decoy,TRY1,Decoy,0,-7.91192,-6.78,-2.53,-5.683809131287049
C=CCOc1cccc([C@H]2C(C(=O)c3ccc(Br)cc3)=C([O-])C(=O)N2c2cc(C)on2)c1,C09312700_decoy,TRY1,Decoy,0,-8.03619,-6.59,-2.09,-7.183870325751963
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1nn(Cc2ccc(Cl)cc2Cl)cc1Br,C20508262_decoy,TRY1,Decoy,0,-8.09116,-6.06,-2.17,-6.033266760158348
C[C@H]1CCc2c(sc3nc(CN4CCOCC4)nc([N-]S(=O)(=O)c4ccc(Cl)cc4)c23)C1,C25664703_decoy,TRY1,Decoy,0,-10.5781,-7.8,-2.01,-7.049118837616007
Cc1ccc(C)c(C(=O)C2=C([O-])C(=O)N(c3nnc(SCc4ccccc4)s3)[C@H]2c2ccco2)c1,C33587626_decoy,TRY1,Decoy,0,-10.1682,-6.25,-2.46,-5.873610025273232
COC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OC)cc3C)[C@H]2c2ccc(Cl)cc2)nc1C,C09085869_decoy,TRY1,Decoy,0,-8.15571,-6.1,-1.48,-5.957704681348506
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(Cc3ccco3)[C@@H]2c2ccc(Br)cc2)cc1Cl,C16733525_decoy,TRY1,Decoy,0,-8.69041,-5.83,-3.16,-5.544103190655192
COc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2c2nc3ccc(C)cc3s2)cc1OC,C35421542_decoy,TRY1,Decoy,0,-9.33617,-7.78,-1.95,-6.803353880461606
CC[C@@H]1Oc2ccc([N-]S(=O)(=O)c3ccccc3C#N)cc2CN(Cc2ccccc2Cl)C1=O,C35548123_decoy,TRY1,Decoy,0,-7.08758,-6.84,-2.98,-5.447547404815304
COc1cccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2c2nc3ccc(C)cc3s2)c1OC,C35566462_decoy,TRY1,Decoy,0,-7.40149,-5.54,-3.1,-5.6357101825081015
Cc1ccc(-n2nc(-c3ccccc3)c3c2N(CC(=O)[O-])C(=O)CS[C@H]3c2ccccc2Cl)c(C)c1,C37263900_decoy,TRY1,Decoy,0,-6.84501,-4.81,-2.39,-4.37187886155334
CCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3ccc(C)cc3)SC2=S)c(C)c(C#N)c1=O,C38616572_decoy,TRY1,Decoy,0,-8.10436,-7.37,-1.79,-5.88279795148654
Cc1c(C(=O)c2oc3ccc(Br)cc3c2C)c([O-])n([C@@H](C)c2ccccc2)c(=O)c1C#N,C38623469_decoy,TRY1,Decoy,0,-8.78839,-6.21,-2.66,-5.728256066875734
CSc1cc2c([O-])n3c(nc-2cc1=O)-c1c(c2ccccc2n1S(=O)(=O)Oc1ccccc1)CC3,C39542036_decoy,TRY1,Decoy,0,-7.93131,-7.45,-2.5,-5.416304541086915
C=CCN1C(=O)/C(=C2/SC(=S)N(CCCCCC(=O)[O-])C2=O)c2cc(Br)ccc21,C01835147_decoy,TRY1,Decoy,0,-6.78023,-5.35,-3.23,-5.449097272434066
O=C(C1=C([O-])C(=O)N(c2nnc(SC/C=C/c3ccccc3)s2)[C@H]1c1cccnc1)c1ccco1,C40000557_decoy,TRY1,Decoy,0,-9.24423,-6.13,-1.02,-6.747221102290913
Cc1nnc(N2C(=O)C([O-])=C(C(=O)c3c(C)nc4c(C)cccn34)[C@H]2c2ccc(Cl)c(Cl)c2)s1,C40003371_decoy,TRY1,Decoy,0,-8.56491,-5.89,-1.79,-5.188045940872937
CCOc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)N(S(=O)(=O)c2ccc(F)cc2)CCC3)cc1F,C49503823_decoy,TRY1,Decoy,0,-7.51651,-7.76,-3.41,-7.130207814125419
CC(C)CCN1C(=O)C(C)(C)COc2cc([N-]S(=O)(=O)c3ccc(Br)s3)ccc21,C49507656_decoy,TRY1,Decoy,0,-9.38231,-7.73,-4.1,-6.424446043310276
O=C1N=C([O-])N(c2ccc(I)cc2)C(=O)/C1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl,C01739758_decoy,TRY1,Decoy,0,-9.15417,-5.91,-2.31,-5.821350773023831
O=C1N=C([O-])/C(=C\c2cn(Cc3ccc(F)cc3)c3ccccc23)C(=O)N1c1ccc(Br)cc1,C01834360_decoy,TRY1,Decoy,0,-10.3414,-9.19,-1.03,-8.015270224778217
COc1ccc([C@@H]2c3sc([S-])nc3S[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@H]23)cc1OC,C40475444_decoy,TRY1,Decoy,0,-9.84636,-5.22,-1.82,-5.645429113373131
CCCCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4ccc(Cl)cc4)C(=O)N=C3[O-])o2)cc1,C13809806_decoy,TRY1,Decoy,0,-7.82445,-6.89,-2.84,-5.792933388565142
COc1cc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2[O-])cc(Cl)c1OCc1ccccc1Cl,C59135215_decoy,TRY1,Decoy,0,-8.90958,-7.04,-2.78,-5.754743016027166
CCOc1cc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2[O-])cc(I)c1OC,C59135492_decoy,TRY1,Decoy,0,-7.36585,-5.82,-1.5,-4.909559819903889
C=CCc1cc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2[O-])cc(OC)c1OCc1ccccc1C#N,C59135588_decoy,TRY1,Decoy,0,-8.63221,-7.79,-3.3,-6.007474274781255
CCOc1cc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2[O-])cc(Cl)c1OCc1ccccc1,C59136292_decoy,TRY1,Decoy,0,-9.40771,-7.32,-1.5,-8.452952374109156
C=CCc1cc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2[O-])cc(OC)c1OCc1ccc(F)cc1,C59136383_decoy,TRY1,Decoy,0,-8.32823,-7.74,-2.75,-6.90601851679739
CCc1ccccc1-n1c(C)cc(/C=C2/C(=O)N(c3ccc(Br)cc3)C(=O)N=C2[O-])c1C,C59198224_decoy,TRY1,Decoy,0,-8.16626,-7.21,-3.41,-5.475064037295942
O=C1N=C([O-])/C(=C\c2ccccc2OCc2ccc(Cl)cc2)C(=O)N1c1ccc(Br)cc1,C59198275_decoy,TRY1,Decoy,0,-8.78797,-8.38,-1.46,-6.50012990624598
O=C1N=C([O-])/C(=C\c2ccc(OCc3ccccc3F)cc2)C(=O)N1c1cccc(Br)c1,C59198351_decoy,TRY1,Decoy,0,-9.47601,-8.78,-3.58,-7.003895616434667
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2/C(=O)N(c3ccc(Br)cc3)C(=S)N=C2[O-])o1,C59198521_decoy,TRY1,Decoy,0,-8.19997,-8.74,-1.58,-7.152290581277809
O=C([O-])c1ccc(N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)N=C2c2ccc(Br)cc2)cc1,C59229091_decoy,TRY1,Decoy,0,-9.02295,-5.76,-0.83,-5.251965669779847
CCO/C([O-])=C1\C(=O)/C(=C/c2cc(Br)c(OC)c(OC)c2)S\C1=N/c1ccc(C)cc1,C59364651_decoy,TRY1,Decoy,0,-9.9317,-6.69,-3.94,-7.38364648893601
CCO/C([O-])=C1\C(=O)/C(=C/c2cc(Cl)c(OCC#N)c(OC)c2)S\C1=N/c1ccc(OC)cc1,C59364772_decoy,TRY1,Decoy,0,-9.71321,-5.78,-2.76,-7.055970847762125
C=CCOc1ccc(/C=C2\SC(=N\c3ccc(OC)cc3)/C(=C(\[O-])OCC)C2=O)cc1Br,C59366057_decoy,TRY1,Decoy,0,-9.78104,-6.04,-2.01,-5.816299784681695
CCOc1c(Cl)cc(/C=C2\C(=O)N(c3ccc(Br)c(C)c3)C(=O)N=C2[O-])cc1Cl,C33336465_decoy,TRY1,Decoy,0,-8.40483,-5.4,-2.11,-5.149083780080277
O=C1N=C([O-])/C(=C\c2cn(Cc3ccc(Cl)c(Cl)c3)c3ccccc23)C(=O)N1Cc1ccco1,C13536038_decoy,TRY1,Decoy,0,-10.0399,-8.08,-1.38,-6.397581632304139
CC1(C)CC2=NC3=NC(SCc4ccccc4F)=NC(=O)[C@H]3[C@H](c3ccc([N+](=O)[O-])cc3)C2=C([O-])C1,C39730380_decoy,TRY1,Decoy,0,-8.79855,-8.04,-2.54,-7.029788459486083
COc1cc([C@H]2C3=C([O-])CCCC3=NC3=NC(SCc4ccccc4F)=NC(=O)[C@H]32)cc(OC)c1OC,C39731248_decoy,TRY1,Decoy,0,-9.2709,-7.05,-1.73,-6.976787211204621
O=C1N=C(SCc2ccc([N+](=O)[O-])cc2)N=C2N=C3CCCC([O-])=C3[C@@H](c3ccc(Cl)cc3)[C@H]12,C39749154_decoy,TRY1,Decoy,0,-9.48655,-6.76,-2.29,-6.445289642725697
CCOc1ccc(N2C(=O)C(=O)/C(=C([O-])\C=C\c3ccccc3)[C@H]2c2ccc(Br)cc2)cc1,C09370660_decoy,TRY1,Decoy,0,-8.44797,-6.05,-0.53,-6.28334131036836
COc1ccc([C@H]2CC3=NC(C)=C(C(=O)OC(C)C)[C@@H](c4ccccc4OC)C3=C([O-])C2)cc1OC,C00648004_decoy,TRY1,Decoy,0,-7.00379,-6.47,-2.67,-5.0552888894975645
CCNc1nc(NCC)nc(NC(=S)NNc2nc3c(n2C(=O)OCC)CCCC3)n1,C02546618_decoy,TRY1,Decoy,0,-9.03051,-7.67,-1.97,-12.333836288692495
CC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O)[C@@H](NC(C)=O)[C@@H](Oc3ccc(N)cc3)O[C@H]2CO)O[C@@H](CO)[C@@H](O)[C@@H]1O,C04513873_decoy,TRY1,Decoy,0,-6.6023,-4.96,-2.06,-4.879192801423025
O=S(=O)(NCCO)c1ccc2c(c1)C(=NO)c1cc(S(=O)(=O)NCCO)ccc1-2,C01956085_decoy,TRY1,Decoy,0,-8.8509,-7.28,-1.36,-7.883006051446941
CC(C)(C)NC(=O)[C@H](c1ccc2ncccc2c1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06075024_decoy,TRY1,Decoy,0,-9.04429,-5.92,-3.32,-6.354374342098617
CC(C)c1ccc(N(CC(=O)NC[C@H]2CCCO2)C(=O)c2snc(C(N)=O)c2N)cc1,C06190787_decoy,TRY1,Decoy,0,-8.68773,-7.89,-0.15,-8.703931242201042
CCC[C@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06501514_decoy,TRY1,Decoy,0,-7.36566,-6.95,-4.28,-8.623605297210439
CC[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C2CCCCC2)cc1,C06631762_decoy,TRY1,Decoy,0,-8.06872,-5.65,-2.05,-5.4032363311632885
CC[C@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C06821184_decoy,TRY1,Decoy,0,-7.24484,-4.54,-2.51,-5.059171427641925
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccc(C)o2)cc1,C06822214_decoy,TRY1,Decoy,0,-7.90409,-7.01,-1.74,-7.71149236017425
C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CNc1ccccc1C(N)=O)c1ccccn1,C09108893_decoy,TRY1,Decoy,0,-8.61298,-8.46,-2.49,-9.022829342553154
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2c[nH]c3ccccc23)nnn1-c1nonc1N,C09308168_decoy,TRY1,Decoy,0,-9.79251,-7.01,-3.31,-7.027711120651532
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C12467431_decoy,TRY1,Decoy,0,-7.1849,-5.76,-1.02,-6.840418767744283
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)cc1C,C12473273_decoy,TRY1,Decoy,0,-7.47057,-6.29,-1.56,-5.967146061108791
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12477077_decoy,TRY1,Decoy,0,-7.95802,-5.07,-2.4,-5.517552813415306
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccco2)c(C)c1,C12479950_decoy,TRY1,Decoy,0,-7.88691,-5.68,-2.59,-5.698519500169549
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C[C@@H]2CCCO2)C(=O)c2snc(C(N)=O)c2N)o1,C12716081_decoy,TRY1,Decoy,0,-10.2707,-7.55,-1.69,-10.741527646387446
CC(=O)OC[C@@H](COC(=O)/C=C/c1ccc(O)cc1)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C17192892_decoy,TRY1,Decoy,0,-7.32007,-7.39,-1.89,-8.090814474018385
COC(=O)[C@H](CC1=C(O)Nc2ccccc2N1)/C(=N/NC(N)=O)C(=O)Nc1ccccc1C,C17211548_decoy,TRY1,Decoy,0,-7.16066,-7.27,-1.87,-6.281253342459387
Cc1nnc(SCc2cc(O)nc(NC(=[NH2+])Nc3ccccc3Sc3ccccc3)n2)s1,C09350614_decoy,TRY1,Decoy,0,-10.0513,-7.34,-3.19,-7.489748809298793
NC(=O)COc1ccc(/C=N/NC(=O)c2c(-c3ccccc3)nnn2-c2nonc2N)cc1,C19808504_decoy,TRY1,Decoy,0,-8.94859,-8.35,-2.15,-7.976142321200557
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(NN=C3CCCCC3)n2)s1,C20836522_decoy,TRY1,Decoy,0,-9.88776,-5.84,-2.5,-6.18443995635275
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccncc3)n2)s1,C20837719_decoy,TRY1,Decoy,0,-9.19872,-7.19,-2.32,-6.533381160624317
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCC(=O)NCCc1ccccc1Cl,C20914744_decoy,TRY1,Decoy,0,-9.7676,-8.75,-1.09,-7.80658548483446
O=C(CSc1n[nH]c(N/N=C/c2ccccc2O)n1)NNC(=O)c1ccc(Cl)cc1,C20923250_decoy,TRY1,Decoy,0,-9.28643,-8.15,-3.5,-9.23740348856299
Cc1ccccc1Nc1nc(N)nc(CSc2nnc(COc3ccc(C(C)(C)C)cc3)n2N)n1,C23601477_decoy,TRY1,Decoy,0,-9.29399,-6.67,-2.0,-6.185775648993866
CC(C)NC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1,C25514091_decoy,TRY1,Decoy,0,-8.56828,-7.18,-2.77,-9.632586392185418
N#CCc1ccc([C@H](C#N)/C(CCC(=O)Nc2cccc([N+](=O)[O-])c2)=N\NC(=O)NN)cc1,C25586159_decoy,TRY1,Decoy,0,-7.49633,-8.76,-2.73,-7.746844053394678
COc1cc(O)c(C(=O)CCc2ccc(O)cc2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1,C31164435_decoy,TRY1,Decoy,0,-7.87278,-7.41,-1.52,-7.124512307179531
Cc1ccc(S(=O)(=O)N(CCCc2c(C)[nH]c(N)nc2=O)Cc2ccc(N)cc2)cc1,C17039327_decoy,TRY1,Decoy,0,-7.90657,-8.04,-2.04,-7.625439111331314
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586650_decoy,TRY1,Decoy,0,-6.1358,-5.31,-3.89,-5.162518497526118
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)C(C)(C)C,C36586917_decoy,TRY1,Decoy,0,-7.69884,-6.44,-1.71,-6.7561292507976605
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccc(OC)cc3)n2N)n1,C36806224_decoy,TRY1,Decoy,0,-8.56129,-8.04,-2.33,-9.186909169260185
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@@H]1O[C@@H]2CO[P@](=O)([O-])O[C@H]2[C@H]1O,C13829327_decoy,TRY1,Decoy,0,-8.14013,-7.35,-1.71,-8.84339922594663
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1O,C13829329_decoy,TRY1,Decoy,0,-7.65415,-7.35,-1.81,-8.477619832183501
COc1cc([C@@H](O)CCO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc2cc(-c3ccc4c(c3)OCO4)oc12,C35456621_decoy,TRY1,Decoy,0,-8.35445,-7.94,-4.28,-5.950198469406639
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@@H](SCC(=O)Nc4ccccc4C(C)C)N3N)N=N2)cc1,C38999128_decoy,TRY1,Decoy,0,-9.58218,-9.08,-1.32,-7.9795384497918995
CCCCc1ccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39007635_decoy,TRY1,Decoy,0,-10.7553,-8.15,-1.31,-11.95578450931759
CCOC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@H]1c1cc(OC)c(OC)c(OC)c1,C39327067_decoy,TRY1,Decoy,0,-8.43148,-6.16,-1.07,-8.925577389669586
C[C@@H](O)C/C=C\CCCCc1cc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)cc(O)c2c(=O)o1,C39560026_decoy,TRY1,Decoy,0,-7.94029,-7.18,-3.73,-6.860696811612224
CC[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@@H]1c1ccco1,C39680095_decoy,TRY1,Decoy,0,-8.23324,-7.41,-2.12,-6.699386173263559
CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc1sc(C)c(C)c1C(N)=O,C40174570_decoy,TRY1,Decoy,0,-7.5732,-5.33,-1.7,-5.53790330857658
CCc1ccccc1Nc1ncnc(NNC(=O)COc2ccc(Cl)cc2Cl)c1N,C40688316_decoy,TRY1,Decoy,0,-8.08119,-6.26,-2.68,-5.561508456815169
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NNC(=O)c3ccco3)c2N)cc1,C40759499_decoy,TRY1,Decoy,0,-6.87146,-6.98,-3.9,-5.828061649945998
CC1=C(CC[C@H](C)O[C@@H]2O[C@@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@H]2O)C(C)(C)CCC1,C49601493_decoy,TRY1,Decoy,0,-6.34409,-8.29,-2.85,-5.753150102590846
O=C(CCCC(=O)NNC(=S)NC1CCCCC1)NNC(=S)NC1CCCCC1,C17420439_decoy,TRY1,Decoy,0,-10.1787,-7.55,-3.21,-10.010464618353978
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C)NC(N)=O,C58687642_decoy,TRY1,Decoy,0,-7.72411,-7.03,-1.66,-5.981890735907811
Cc1ccccc1[C@H](CC(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C)NC(N)=O,C58687649_decoy,TRY1,Decoy,0,-7.9763,-7.73,-2.91,-6.359729381228991
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)NCc1ccc2c(c1)OCO2,C58994232_decoy,TRY1,Decoy,0,-9.62837,-9.97,-3.57,-11.438695214193658
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1,C58994387_decoy,TRY1,Decoy,0,-9.28146,-8.07,-3.08,-11.00007981123645
CC[NH+](CC)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)cc1,C59015391_decoy,TRY1,Decoy,0,-8.92287,-8.94,-4.32,-7.466743687786219
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@@H]1O[C@H]2CO[P@](=O)([O-])O[C@@H]2[C@H]1O,C03871257_decoy,TRY1,Decoy,0,-8.70351,-6.99,-3.84,-8.155599206813024
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@@H]1O[C@H]2CO[P@](=O)([O-])O[C@@H]2[C@@H]1O,C03871259_decoy,TRY1,Decoy,0,-8.49272,-7.47,-2.8,-7.664737801089137
CC(=O)N[C@@H]1[C@@H](O[C@H]2[C@@H](O)[C@@H](NC(C)=O)[C@@H](Oc3ccc(N)cc3)O[C@H]2CO)O[C@@H](CO)[C@@H](O)[C@H]1O,C04513872_decoy,TRY1,Decoy,0,-5.72853,-6.85,-2.28,-7.841384033633616
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCCCCO)ccc(NCCCCCO)c21,C05386704_decoy,TRY1,Decoy,0,-9.59915,-7.67,-2.29,-9.418586954618023
COc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC(C)(C)C)c1ccco1,C06075086_decoy,TRY1,Decoy,0,-5.81959,-6.97,-1.51,-6.748454892233753
CC(C)CCNC(=O)[C@H](c1ccco1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06134584_decoy,TRY1,Decoy,0,-7.05406,-6.6,-1.16,-7.214874033847207
CC(C)c1ccc(N(CC(=O)NC[C@@H]2CCCO2)C(=O)c2snc(C(N)=O)c2N)cc1,C06190786_decoy,TRY1,Decoy,0,-9.08118,-8.05,0.0,-9.535888308041452
CCC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06501200_decoy,TRY1,Decoy,0,-7.56722,-6.89,-3.31,-7.5714858262021245
CC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C06631842_decoy,TRY1,Decoy,0,-7.03786,-6.24,-4.61,-6.689940250863659
CC[C@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06632161_decoy,TRY1,Decoy,0,-8.26034,-6.28,-0.83,-8.47328689685154
CCOc1cccc(-c2c(C(=O)N/N=C/c3ccc(OCC(N)=O)cc3)nnn2-c2nonc2N)c1,C02209413_decoy,TRY1,Decoy,0,-9.66911,-7.48,-2.07,-11.926111663235368
CCCOc1cccc(C=NNc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c1,C12340634_decoy,TRY1,Decoy,0,-8.2304,-7.85,-3.6,-8.465547334532731
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(O)cc2)cc1,C12473803_decoy,TRY1,Decoy,0,-8.48601,-8.01,-1.53,-8.645013839991389
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](CC(C)C)C(=O)NC(C)(C)C)cc1,C12476683_decoy,TRY1,Decoy,0,-8.21287,-5.08,-0.63,-5.998887416566321
CCC[C@@H](C(=O)NCCC(C)C)N(CCCOCC)C(=O)c1snc(C(N)=O)c1N,C06501144_decoy,TRY1,Decoy,0,-8.50194,-6.21,-3.3,-8.005182318917916
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccco2)c1,C12479924_decoy,TRY1,Decoy,0,-6.90395,-6.99,-2.88,-6.696531407745626
Cc1ccc(Nc2nc(N)nc(CSCc3nc(N)nc(Nc4ccc(C)cc4)n3)n2)cc1,C12610156_decoy,TRY1,Decoy,0,-8.14945,-7.81,-2.57,-6.684735489835632
COCCNC(=O)[C@H](c1ccc2ncccc2c1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06443976_decoy,TRY1,Decoy,0,-8.5301,-6.82,-2.92,-6.501858646378043
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccncc2)nnn1-c1nonc1N,C02453709_decoy,TRY1,Decoy,0,-7.12338,-8.25,-2.56,-6.616803301536149
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccccc3OC)n2N)n1,C09163094_decoy,TRY1,Decoy,0,-9.15399,-6.76,-1.51,-6.7206274917421736
COc1cc([C@H](O)CCO[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc2cc(-c3ccc4c(c3)OCO4)oc12,C15112228_decoy,TRY1,Decoy,0,-8.62475,-7.79,-2.39,-6.247679739824045
COC(=O)[C@@H](CC1=C(O)Nc2ccccc2N1)/C(=N/NC(N)=O)C(=O)Nc1ccccc1C,C16957748_decoy,TRY1,Decoy,0,-6.47195,-7.63,-1.47,-6.477877730382626
NC(=O)CCc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1Cc1ccco1,C22408057_decoy,TRY1,Decoy,0,-11.697,-6.26,-1.94,-8.863328829148179
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1ccc(C#N)cc1,C33516262_decoy,TRY1,Decoy,0,-7.87895,-6.94,-1.73,-8.054832499642536
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CO,C36503744_decoy,TRY1,Decoy,0,-7.3431,-5.66,-3.27,-6.260417233467103
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc(O)cc1)c1ccccc1Cl,C36544973_decoy,TRY1,Decoy,0,-7.77474,-6.42,-3.44,-6.403659230642608
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586649_decoy,TRY1,Decoy,0,-7.25723,-5.67,-3.32,-5.750375921761148
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)C(C)(C)C,C36586920_decoy,TRY1,Decoy,0,-6.83883,-5.83,-4.26,-6.964035892799052
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)o2)c1,C12714933_decoy,TRY1,Decoy,0,-7.83575,-7.64,-3.01,-11.073913113461169
Cc1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)o1,C12715042_decoy,TRY1,Decoy,0,-7.82734,-7.27,-2.27,-7.884323856933188
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4ccccc4C(C)C)N3N)N=N2)cc1,C38999127_decoy,TRY1,Decoy,0,-9.83653,-9.51,-1.42,-7.956681483053094
CCCCc1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39007633_decoy,TRY1,Decoy,0,-11.1325,-9.02,-1.98,-8.64469089012881
CCOC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@@H]1c1cc(OC)c(OC)c(OC)c1,C39327066_decoy,TRY1,Decoy,0,-7.0327,-4.45,-1.17,-4.99039529916922
O=C(CCCCCCCC(=O)N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C08871552_decoy,TRY1,Decoy,0,-8.93207,-7.96,-3.25,-7.981442786852446
C[C@H](O)C/C=C\CCCCc1cc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)cc(O)c2c(=O)o1,C39560025_decoy,TRY1,Decoy,0,-9.0063,-5.88,-2.41,-7.962053622537599
CC[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@H]1c1ccco1,C39680094_decoy,TRY1,Decoy,0,-8.42417,-7.09,-2.84,-6.359343045374532
Nc1cc(C(=O)N/N=C\c2cccc(/C=N/NC(=O)c3cc(N)cc([N+](=O)[O-])c3)c2)cc([N+](=O)[O-])c1,C32600966_decoy,TRY1,Decoy,0,-7.87789,-7.12,-5.14,-6.817356717261476
O=C(CCCCCCC(=O)N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C09871767_decoy,TRY1,Decoy,0,-9.87488,-8.13,-2.31,-8.38775072058802
COc1ccc(C)cc1Nc1ncnc(NNC(=O)COc2ccc(Cl)cc2Cl)c1N,C40684431_decoy,TRY1,Decoy,0,-9.58397,-7.47,-1.86,-7.151510347303793
NC(=O)c1c(Nc2nc(NCCC3=CCCCC3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41302072_decoy,TRY1,Decoy,0,-8.7007,-7.65,-2.53,-8.407317552029951
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)NCCNC(C)=O,C43554253_decoy,TRY1,Decoy,0,-9.03102,-7.24,-4.18,-6.95583917359608
CCCOc1ccc(-c2n[nH]c3c2[C@H](c2ccc(OCC(N)=O)cc2)C(C#N)=C(N)O3)cc1,C09350732_decoy,TRY1,Decoy,0,-6.86306,-4.92,-2.64,-5.12246962486394
CCOc1ccc(C[C@H](CNC(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)C(N)=O)cc1,C58162192_decoy,TRY1,Decoy,0,-9.573,-6.63,-1.34,-6.43507260111455
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C)NC(N)=O,C58687647_decoy,TRY1,Decoy,0,-7.44081,-6.93,-3.78,-5.839747776728107
Nn1c(CCc2ccccc2)nnc1SCCCC(=O)N/N=C/c1ccc(O)cc1O,C58987239_decoy,TRY1,Decoy,0,-8.85323,-8.03,-3.9,-8.060137404913103
COc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3O)n2)c(OC)c1,C58994157_decoy,TRY1,Decoy,0,-9.48708,-9.12,-3.38,-8.332683814254342
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)NCCc1ccccc1Cl,C58994308_decoy,TRY1,Decoy,0,-10.9224,-10.08,-3.8,-9.51665018675688
CCCC/C(C)=N/Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1,C59891494_decoy,TRY1,Decoy,0,-9.76163,-5.26,-4.54,-5.708131975876484
C/C(CC(C)C)=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1,C59892512_decoy,TRY1,Decoy,0,-9.49866,-7.26,-4.03,-7.268432141135366
CC[NH+](CC)c1ccc(NC(=O)COC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(N)=O)cc1,C63209611_decoy,TRY1,Decoy,0,-9.71739,-8.44,-1.74,-8.551247717668112
CC[C@@H](C(=O)NC1CCCC1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C04161213_decoy,TRY1,Decoy,0,-8.26624,-7.3,-1.37,-8.69606487892606
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)Nc1cccc(O)c1,C04237018_decoy,TRY1,Decoy,0,-10.6308,-8.75,-2.58,-9.39929484961924
CC(=O)NCCNC(=O)C[C@@H]1c2nc(Nc3cccnc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03841645_decoy,TRY1,Decoy,0,-10.7957,-8.74,-1.49,-9.440995662576684
CC(C)(C)NC(=O)[C@H](c1ccc(Cl)cc1)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06074856_decoy,TRY1,Decoy,0,-8.50149,-4.3,-3.21,-5.124239019611022
CC(C)CCNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06134319_decoy,TRY1,Decoy,0,-8.97317,-5.31,-3.31,-6.795829048497192
CC(C)CCNC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06134628_decoy,TRY1,Decoy,0,-7.51532,-7.43,-1.76,-8.35664321111155
CC(C)CCNC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06134632_decoy,TRY1,Decoy,0,-8.39496,-5.71,-2.45,-5.980377945749621
CCC[C@H](C(=O)NCCC(C)C)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06501476_decoy,TRY1,Decoy,0,-9.24905,-6.14,-2.56,-8.141501717733956
CCOC(=O)CN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@H]1CCCO1)c1ccc(F)cc1,C06546228_decoy,TRY1,Decoy,0,-8.49201,-7.62,-1.43,-9.999233761792444
CCOC(=O)CN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@H]1CCCO1)c1ccc(F)cc1,C06546306_decoy,TRY1,Decoy,0,-8.22351,-7.03,-4.11,-8.46977431895806
CCOc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2C)cc1,C06601407_decoy,TRY1,Decoy,0,-8.10064,-6.12,-2.5,-6.456006921229577
CCOc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2C)cc1,C06601671_decoy,TRY1,Decoy,0,-8.51767,-7.13,-1.67,-7.868967550312194
CC[C@@H](C(=O)NC1CCCC1)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06631727_decoy,TRY1,Decoy,0,-8.58335,-7.33,-1.41,-9.39823738463656
CC[C@H](C(=O)NC1CCCC1)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06820983_decoy,TRY1,Decoy,0,-7.51123,-6.84,-3.67,-6.455273261379642
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](CC(C)C)C(=O)NCCC(C)C)cc1,C06821938_decoy,TRY1,Decoy,0,-8.44147,-6.67,-1.06,-7.97190982658984
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](CC(C)C)C(=O)NCCC(C)C)cc1,C06822109_decoy,TRY1,Decoy,0,-8.57391,-5.48,-3.13,-6.067628841243817
CSCC[C@@H](NC(N)=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1,C09631468_decoy,TRY1,Decoy,0,-10.2191,-5.73,-2.02,-8.160785455233137
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1,C12479598_decoy,TRY1,Decoy,0,-7.44224,-7.07,-1.84,-7.543345750233356
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1,C12479603_decoy,TRY1,Decoy,0,-7.29888,-4.28,-3.54,-5.284590037189896
N#Cc1c(CCCNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)n[nH]c1N,C09378412_decoy,TRY1,Decoy,0,-8.81995,-7.49,-1.47,-9.98893226050983
CCCC[C@@H](C(=O)NC1CCCC1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06481334_decoy,TRY1,Decoy,0,-8.65359,-5.39,-1.55,-6.198476729429864
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](CC(C)C)C(=O)NC2CCCC2)c1,C12701855_decoy,TRY1,Decoy,0,-8.221,-7.23,-4.12,-9.735948189782414
Cc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2ccccc2Cl)C(=O)c2snc(C(N)=O)c2N)o1,C12703839_decoy,TRY1,Decoy,0,-8.76684,-7.94,-3.19,-8.920410984497428
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(Cc2ccccc2Cl)C(=O)c2snc(C(N)=O)c2N)o1,C12703844_decoy,TRY1,Decoy,0,-9.55673,-6.6,-4.2,-6.93094214047509
CCOC(=O)CNC(=O)[C@H](c1ccc(F)cc1)N(Cc1cccnc1)C(=O)c1snc(C(N)=O)c1N,C06089350_decoy,TRY1,Decoy,0,-9.37357,-7.5,-4.68,-9.73975324804398
CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1,C14361417_decoy,TRY1,Decoy,0,-10.8823,-7.21,-3.64,-7.238848989164554
CC(C)c1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccncc2)cc1,C06077034_decoy,TRY1,Decoy,0,-8.73696,-6.13,-3.28,-6.353184657227
Nn1c(N/N=C/c2cccc(O)c2)nnc1SCCC(=O)Nc1cccc(Cl)c1,C20915213_decoy,TRY1,Decoy,0,-8.88093,-8.37,-3.64,-7.075881500792997
Nn1c(N/N=C/c2c(O)ccc3ccccc23)nnc1SCCC(=O)Nc1nc2ccccc2s1,C20916981_decoy,TRY1,Decoy,0,-9.0637,-7.87,-3.12,-6.054035182354294
Cc1ccc(/C=N/Nc2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)cc1,C20924160_decoy,TRY1,Decoy,0,-8.30099,-7.83,-1.8,-7.480950937350465
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2ccc(O)cc2)n1N,C21315554_decoy,TRY1,Decoy,0,-8.39448,-7.98,-2.65,-6.623052027252576
COc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3c(F)cccc3F)n2N)c1O,C21319082_decoy,TRY1,Decoy,0,-9.82402,-9.1,-2.35,-10.54562539171599
CCCCCCN(C(=O)c1ccc(O)cc1)[C@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36514270_decoy,TRY1,Decoy,0,-7.1981,-6.59,-3.89,-7.178805203640708
CCCCCCN(C(=O)c1ccc(O)cc1)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36514271_decoy,TRY1,Decoy,0,-8.30627,-6.28,-4.83,-7.689454221206221
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2c(O)cc(O)cc2O)N(C(=O)CO)C(C)(C)C)cc1,C36590533_decoy,TRY1,Decoy,0,-8.17058,-7.5,-2.41,-6.667651495999563
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2cccs2)c1,C12711266_decoy,TRY1,Decoy,0,-7.26603,-7.19,-1.51,-11.38890067532759
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1,C12711275_decoy,TRY1,Decoy,0,-8.15102,-7.12,-2.58,-8.296667514051467
COc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2cccs2)c1,C12711312_decoy,TRY1,Decoy,0,-9.03076,-7.08,-1.12,-13.088470056200514
COc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2cccs2)c1,C12711320_decoy,TRY1,Decoy,0,-7.39599,-6.36,-1.31,-8.007515821005484
NC(=O)c1nsc(C(=O)N(Cc2ccc(F)cc2)[C@@H](C(=O)NC2CCCC2)c2ccco2)c1N,C12703356_decoy,TRY1,Decoy,0,-7.89389,-6.72,-3.02,-7.258587900796905
CCC[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@@H]1c1cccc(C)c1,C39692225_decoy,TRY1,Decoy,0,-8.73328,-8.21,-2.95,-6.426709365061592
CCOc1ccc(Nc2ncnc(NNS(=O)(=O)c3ccc(C)cc3)c2N)cc1,C40782687_decoy,TRY1,Decoy,0,-7.78152,-7.63,-1.93,-6.700020082605626
CC(C)COC(=O)c1ccc(Nc2ncnc(NNC(=O)c3ccc(F)cc3)c2N)cc1,C40782980_decoy,TRY1,Decoy,0,-9.29081,-7.93,-2.34,-7.432324200189906
CC[C@H](CO)Nc1nc(Nc2sc3c(c2C(N)=O)CCCC3)c2cnn(-c3ccccc3)c2n1,C41026023_decoy,TRY1,Decoy,0,-9.61864,-7.52,-2.76,-10.213084421454832
Cc1ccc(NC(=S)NNC(=O)CNC(=O)CNC(=O)c2ccc(Cl)cc2Cl)cc1C,C46772533_decoy,TRY1,Decoy,0,-9.67059,-7.66,-3.09,-7.426207550691664
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1ccccc1,C36610302_decoy,TRY1,Decoy,0,-9.29435,-5.5,-3.83,-6.613886727855107
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1ccccc1,C36610303_decoy,TRY1,Decoy,0,-9.4754,-7.13,-1.61,-8.179618347637605
CC(=O)Nc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3sccc3C(N)=O)s2)c1,C58670284_decoy,TRY1,Decoy,0,-10.6773,-5.8,-3.62,-6.945732084833809
CC(=O)Nc1cccc(Nc2nnc(S[C@H](C)C(=O)Nc3sccc3C(N)=O)s2)c1,C58670286_decoy,TRY1,Decoy,0,-9.93167,-8.67,-3.79,-8.334357972205215
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)N[C@@H](C)c2ccccc2)n1N,C59914564_decoy,TRY1,Decoy,0,-8.75282,-7.92,-4.0,-7.491079470687787
Nc1nc2nc(-c3ccc([N+](=O)[O-])cc3)nc(N)c2nc1-c1ccc(N(CCO)CCO)cc1,C01704185_decoy,TRY1,Decoy,0,-8.79894,-5.46,-3.08,-5.265747064493077
CCCc1n[nH]c2c1[C@H](c1ccc(OCC(N)=O)c(OCC)c1)C(C#N)=C(N)O2,C01111634_decoy,TRY1,Decoy,0,-7.05008,-4.71,-2.45,-4.456672557637879
CC(C)(C)NC(=O)[C@@H](c1ccc2ncccc2c1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06074614_decoy,TRY1,Decoy,0,-9.9734,-7.64,-3.04,-9.516302094003228
CCCCc1[nH]nc2c1[C@H](c1ccc(OCC(N)=O)c(OC)c1)C(C#N)=C(N)O2,C06264719_decoy,TRY1,Decoy,0,-7.24806,-4.88,-1.94,-5.043961735580038
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C06546842_decoy,TRY1,Decoy,0,-7.53813,-4.7,-1.2,-5.074622705838571
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C06546868_decoy,TRY1,Decoy,0,-8.58554,-4.64,-3.28,-5.400723641068668
CCOc1ccc([C@@H](C(=O)NC(C)(C)C)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)cc1,C06601252_decoy,TRY1,Decoy,0,-9.2612,-5.83,-2.63,-6.915005457993418
CC(C)[C@H](NC(N)=O)C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C07004088_decoy,TRY1,Decoy,0,-9.29894,-5.16,-2.22,-5.373403049402121
Nc1ncnc(NNC(=O)CNC(=O)COc2ccc(Cl)cc2)c1[N+](=O)[O-],C09391682_decoy,TRY1,Decoy,0,-6.88357,-8.09,-2.49,-7.667178224611562
O=C(NNC(=S)NCc1ccco1)C(=O)NNC(=S)NCc1ccco1,C09465524_decoy,TRY1,Decoy,0,-8.20606,-5.97,-4.2,-6.091466826785619
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1,C12474036_decoy,TRY1,Decoy,0,-8.89057,-6.9,-2.4,-7.4999273947546365
CCc1ccccc1Nc1nc(N)nc(Cn2c(NCCO)nc3ccccc32)n1,C05265149_decoy,TRY1,Decoy,0,-8.85545,-7.74,-1.59,-8.104382870479082
CCCCCCO[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14438556_decoy,TRY1,Decoy,0,-4.89493,-6.08,-3.07,-4.5690881057552
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)NNC(=O)C(F)(F)F,C20833667_decoy,TRY1,Decoy,0,-8.61326,-8.71,-2.25,-13.383223189720118
C/C(=N\Nc1nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]1)c1ccc(N)cc1,C20836864_decoy,TRY1,Decoy,0,-7.89342,-8.49,-1.88,-8.658393497515409
CCOC(=O)c1sc(NC(=O)CSc2nnc(NN)n2N)c(C#N)c1C,C21035958_decoy,TRY1,Decoy,0,-8.8281,-7.59,-2.22,-7.399461928560753
COc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3cccc(NC(C)=O)c3)n[nH]2)c1O,C21079907_decoy,TRY1,Decoy,0,-9.5064,-9.05,-4.72,-12.222798028930123
CCCCn1c(N)c(N(CC)CC2=C(C(=O)OCC)[C@@H](c3ccco3)NC(=O)N2)c(=O)[nH]c1=O,C24956056_decoy,TRY1,Decoy,0,-7.26112,-6.4,-3.4,-6.452427136272969
CCCCn1c(N)c(N(CCC)CC2=C(C(=O)OCC)[C@@H](c3ccccc3)NC(=O)N2)c(=O)[nH]c1=O,C25074285_decoy,TRY1,Decoy,0,-6.9423,-7.21,-3.1,-7.05786818867644
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C,C27202327_decoy,TRY1,Decoy,0,-8.1391,-6.75,-2.66,-7.254887433029385
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C,C27202333_decoy,TRY1,Decoy,0,-9.0363,-5.31,-2.05,-5.800819480841063
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C,C27202344_decoy,TRY1,Decoy,0,-8.10704,-5.97,-1.74,-5.807261068740143
CC(C)[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)NC(N)=O,C28947716_decoy,TRY1,Decoy,0,-9.15391,-6.8,-0.86,-9.572503866275431
CC(C)[C@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)NC(N)=O,C28947717_decoy,TRY1,Decoy,0,-9.1122,-5.79,-3.15,-6.490797373984682
NC(=O)c1cc(-c2csc(NC(=O)CCCNC(=O)c3ccsc3)n2)c[nH]1,C30982844_decoy,TRY1,Decoy,0,-9.53307,-8.24,-2.81,-8.460242649779241
CC(C)OP(=O)(OC(C)C)/C(=N/NC(N)=O)NNc1ccc([N+](=O)[O-])cc1,C22198785_decoy,TRY1,Decoy,0,-5.76821,-4.91,-4.01,-4.400523719155309
CCCCCCO[C@@H]1O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C35455015_decoy,TRY1,Decoy,0,-5.49014,-6.13,-2.79,-4.575006209911354
CCCCCCN(C(=O)CO)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36517760_decoy,TRY1,Decoy,0,-7.8172,-7.13,-3.8,-8.493930026209178
CCCCCCN(C(=O)CO)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36517768_decoy,TRY1,Decoy,0,-8.16629,-6.54,-3.3,-8.07656794875403
O=C(COc1ccc(Cl)cc1Cl)N/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C04763667_decoy,TRY1,Decoy,0,-9.44501,-5.77,-3.44,-5.955240053330585
O=C(COc1ccc(Cl)cc1Cl)N/N=C/[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C04763658_decoy,TRY1,Decoy,0,-8.18043,-5.69,-2.64,-6.0036524821516455
O=C(COc1ccc(Cl)cc1Cl)N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C04763662_decoy,TRY1,Decoy,0,-9.07463,-7.72,-4.42,-6.862409875086728
Cc1nc(SCC(=O)N[C@@H]2SC=C[C@H]2C(N)=O)[nH]c(=O)c1CCC(=O)O,C39667879_decoy,TRY1,Decoy,0,-9.0571,-5.45,-3.55,-5.5421905948699015
Cc1ccc(S(=O)(=O)NNc2ncnc(NCCC3=CCCCC3)c2N)cc1,C40756078_decoy,TRY1,Decoy,0,-9.27987,-8.67,-2.81,-7.542910239366763
CCOc1cc(C#N)cc(Br)c1OCC(=O)NC(C(N)=O)C(N)=O,C42039053_decoy,TRY1,Decoy,0,-7.52941,-6.01,-3.61,-7.709055618359413
CCCOc1ccc([C@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(C(C)(C)C)C(=O)[C@@H]23)cc1,C33874702_decoy,TRY1,Decoy,0,-7.38186,-7.7,-1.63,-8.444392218097923
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cc(Br)ccc1OC,C33880642_decoy,TRY1,Decoy,0,-8.83906,-4.9,-2.66,-5.493643531302207
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=S)NC1CCCC1,C43474170_decoy,TRY1,Decoy,0,-8.24215,-5.8,-2.88,-5.533701615073506
C/C=C/C#CC#C[C@@H](O)[C@@H](/C=C/CCCO)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C44460323_decoy,TRY1,Decoy,0,-8.39426,-6.08,-3.13,-5.837905985978146
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1C,C47871589_decoy,TRY1,Decoy,0,-8.72467,-7.06,-3.65,-6.560460295793739
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1C,C47871593_decoy,TRY1,Decoy,0,-7.63533,-6.47,-3.58,-6.152658686302488
C[C@H](O)C(O)(C(=O)OCc1cc(O)ccc1NC(=O)[C@@H]1CCC(=O)O1)[C@H](C)O,C49181847_decoy,TRY1,Decoy,0,-7.76317,-5.85,-2.59,-5.78240633064146
CC1=C(CC[C@@H](C)O[C@@H]2O[C@@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@H]2O)C(C)(C)CCC1,C49601491_decoy,TRY1,Decoy,0,-7.01211,-7.14,-2.77,-5.388890188957286
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)NC(N)=O,C58687633_decoy,TRY1,Decoy,0,-7.13751,-6.08,-3.79,-5.353487841134524
Cc1ccccc1[C@H](CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)NC(N)=O,C58687634_decoy,TRY1,Decoy,0,-7.08698,-7.02,-2.68,-5.69223423230186
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)NC(N)=O,C58687638_decoy,TRY1,Decoy,0,-6.56627,-7.45,-3.33,-6.06663761820868
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCC(=O)NCc1ccco1,C20292363_decoy,TRY1,Decoy,0,-8.91177,-8.04,-2.51,-9.865351916913871
CCNc1nc(NCC)n2c(SCC(=O)NNC(=O)NC(C)C)nnc2n1,C63265657_decoy,TRY1,Decoy,0,-8.12594,-6.24,-3.4,-5.707768148544803
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)NCC(C)C)cc1,C65182415_decoy,TRY1,Decoy,0,-7.45554,-6.96,-5.33,-6.343508470990809
CCOc1ccc(OCC)c(NC(=S)NNC(=O)[C@H](NC(N)=O)C(C)C)c1,C67193839_decoy,TRY1,Decoy,0,-8.19518,-6.52,-2.92,-6.890117891046503
Cc1c(N[C@H](CC(=O)c2c(O)c3ccccc3n(C)c2=O)c2c(O)ccc3ccccc23)c(=O)n(-c2ccccc2)n1C,C04267292_decoy,TRY1,Decoy,0,-8.88578,-9.07,-3.67,-8.540665855753943
CCCNC(=O)c1cc(NC(=O)Nc2ccccc2CC)ccc1N1CCN(c2ccccc2OC)CC1,C04211236_decoy,TRY1,Decoy,0,-8.44433,-5.6,-2.43,-5.51761221333499
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C(/NCc1ccccc1C(F)(F)F)Nc1ccccc1Cl,C08757716_decoy,TRY1,Decoy,0,-10.2327,-8.88,-1.14,-8.68734719473311
Cc1cc(C)cc(Nc2nc(Nc3cc(C)cc(C)c3)nc(N[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)n2)c1,C09933785_decoy,TRY1,Decoy,0,-8.98069,-8.16,-2.18,-6.800934674580471
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC(=S)NNC(=O)COc1ccc(Cl)cc1Cl,C12570029_decoy,TRY1,Decoy,0,-11.1299,-7.24,-3.6,-7.160783921409693
CCOc1ccc(C(=O)NC(=S)Nc2ccc(-c3nc4cc(C)cc(C)c4o3)c(O)c2)cc1[N+](=O)[O-],C14275048_decoy,TRY1,Decoy,0,-9.24046,-8.41,-3.98,-7.191701579617027
COc1cc(NC(=S)NC(=O)c2ccc(-c3ccc(Cl)cc3Cl)o2)ccc1NC(=O)C(C)C,C14276101_decoy,TRY1,Decoy,0,-10.3264,-8.0,-2.47,-7.292720338210571
Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)COc1ccc(Br)cc1C(C)(C)C,C14668175_decoy,TRY1,Decoy,0,-9.81414,-7.39,-3.8,-6.421900092811772
CCN(CC)c1ccc([C@]2(c3ccc(Nc4ccc(NC(C)=O)cc4)cc3)OC(=O)c3ccccc32)c(O)c1,C15772064_decoy,TRY1,Decoy,0,-8.71523,-7.17,-1.97,-6.62409498757405
CCCOc1c(OC)cc(Cl)cc1[C@H]1NC(=S)NC(C)=C1C(=O)Nc1ccccc1C(=O)OC,C16382678_decoy,TRY1,Decoy,0,-9.00864,-4.86,-3.29,-6.152413502631474
CC[C@@H](C)[C@H](NC(=O)Nc1ccc(C)c(Cl)c1)C(=O)Nc1nnc(-c2cccc(Cl)c2)s1,C16572704_decoy,TRY1,Decoy,0,-11.1188,-7.51,-1.56,-7.984192676520089
CC1=C(C(=O)OCC(C)C)[C@H](c2ccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)cc2)NC(=S)N1C,C16610140_decoy,TRY1,Decoy,0,-9.88564,-7.0,-4.08,-6.026573618901721
CSc1ccc(NC(=O)Nc2ccc([C@H]3NC(=S)N(C)C(C)=C3C(=O)OCC(C)C)cc2)cc1,C16610179_decoy,TRY1,Decoy,0,-10.6669,-6.94,-2.33,-7.26268352603959
CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(NC(=O)Nc3c(Cl)cccc3Cl)cc2)NC(=S)N1C,C16610204_decoy,TRY1,Decoy,0,-9.96317,-6.18,-2.13,-7.351690214548245
CC1=C(C(=O)OC(C)C)[C@H](c2ccc(NC(=O)Nc3ccccc3C(F)(F)F)cc2)NC(=S)N1C,C16610239_decoy,TRY1,Decoy,0,-8.94812,-6.61,-1.52,-5.790990614242772
CCN1C(=S)N[C@@H](c2ccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)cc2)C(C(=O)OCC(C)C)=C1C,C16610498_decoy,TRY1,Decoy,0,-9.5302,-5.71,-2.5,-6.020320849684892
CCN1C(=S)N[C@@H](c2ccc(NC(=O)Nc3ccc(C(C)C)cc3)cc2)C(C(=O)OCC(C)C)=C1C,C16610521_decoy,TRY1,Decoy,0,-8.91798,-5.95,-1.49,-5.872142180744832
Nc1c(C(=O)OCC(=O)N[C@H](c2ccccc2)c2cccs2)ccc2c1C(=O)c1ccccc1C2=O,C18170093_decoy,TRY1,Decoy,0,-8.49109,-8.29,-3.5,-6.175515488393467
O=C(N[C@@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl)c1cccc2ccccc12,C03051425_decoy,TRY1,Decoy,0,-7.7303,-6.41,-2.18,-5.548680698587669
Nc1nonc1-n1nnc(-c2ccccc2)c1C(=O)N/N=C/c1cccc(OCc2ccccc2Cl)c1,C19808501_decoy,TRY1,Decoy,0,-9.35375,-8.72,-2.22,-9.964964058603003
CCc1ccccc1NC(=O)CSC1=C(C#N)[C@@H](c2ccco2)C(C(=O)Nc2ccccc2C)=C(C)N1,C20347771_decoy,TRY1,Decoy,0,-7.56343,-7.46,-1.34,-6.15743807998269
O=C(CCSc1n[nH]c(N/N=C/c2cccc3ccccc23)n1)Nc1cccc(Br)c1,C20905432_decoy,TRY1,Decoy,0,-8.76912,-7.0,-2.0,-6.845797362700399
O=C(CCSc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1)Nc1ccc(Br)cc1,C21076913_decoy,TRY1,Decoy,0,-11.0558,-8.48,-4.26,-11.65554079613477
O=C(CCSc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1)Nc1ccccc1Br,C21076919_decoy,TRY1,Decoy,0,-10.2475,-8.34,-2.86,-7.3140739826735155
O=C(CCSc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1)Nc1c(Cl)cccc1Cl,C21076948_decoy,TRY1,Decoy,0,-10.8156,-8.19,-2.81,-7.552949022614513
O=C(CCSc1n[nH]c(N/N=C/c2cccc(Cl)c2Cl)n1)Nc1c(Cl)cccc1Cl,C21078528_decoy,TRY1,Decoy,0,-11.8531,-6.97,-2.08,-7.140169486003987
Cc1cc(NC(=S)NC(=O)c2ccc(-c3cccc(Cl)c3Cl)o2)ccc1NC(=O)c1ccco1,C01263742_decoy,TRY1,Decoy,0,-9.17152,-6.13,-3.55,-6.00818831730221
O=C(N[C@@H](NC(=S)Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl)c1cccc2ccccc12,C27469184_decoy,TRY1,Decoy,0,-7.03123,-5.01,-1.78,-4.934223197668582
CCN1C(=S)N[C@@H](c2ccc(NC(=O)Nc3ccc(C)c(Cl)c3)cc2)C(C(=O)OCC(C)C)=C1C,C34888126_decoy,TRY1,Decoy,0,-8.94411,-8.0,-1.85,-8.263136478363462
CC[C@@H](C)[C@H](NC(=O)Nc1cccc2ccccc12)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C35268137_decoy,TRY1,Decoy,0,-9.87356,-7.22,-2.0,-7.282407956988459
CCN1C(=O)N[C@H](c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)C(C(=O)OCC(C)C)=C1C,C35707505_decoy,TRY1,Decoy,0,-10.7042,-6.96,-2.86,-7.33775562305487
CCCN1C(=O)N[C@H](c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)C(C(=O)OC(C)C)=C1C,C35711755_decoy,TRY1,Decoy,0,-7.79002,-8.46,-3.49,-7.502963082946999
CC1=C(C(=O)OCC(C)C)[C@H](c2ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)cc2)NC(=S)N1C,C35729734_decoy,TRY1,Decoy,0,-7.59407,-4.97,-1.43,-4.826004743448661
CC(C)(C)NC(=O)[C@@H](C(c1ccccc1)c1ccccc1)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500490_decoy,TRY1,Decoy,0,-7.41922,-6.19,-1.87,-5.922806298403287
CCCCNC(=O)[C@H](c1c(Cl)cccc1Cl)N(Cc1ccc(C)o1)C(=O)c1cccc(O)c1O,C36597773_decoy,TRY1,Decoy,0,-8.13241,-5.05,-2.91,-5.730829237058769
COC(=O)C1=C(C)Nc2sc(C(=O)C34CC5CC(CC(C5)C3)C4)c(N)c2[C@@H]1c1ccc(C(=O)OC)cc1,C39327029_decoy,TRY1,Decoy,0,-8.27307,-5.81,-5.0,-6.4288751416497085
CCc1ccc(Nc2sc3c(-c4ccc(C)cc4)c(C#N)c(N)nc3c2C(=O)NCc2ccco2)cc1,C39895310_decoy,TRY1,Decoy,0,-10.1502,-8.17,-2.83,-8.355731255009983
CC[C@H](Oc1c(-c2ccc(Cl)cc2)oc2ccccc2c1=O)C(=O)Nc1sc(C)c(C)c1C(N)=O,C40168736_decoy,TRY1,Decoy,0,-9.57309,-7.77,-3.02,-6.876301992082697
CCCCCN1C(=O)c2[nH]nc(-c3c(C)cc(C)cc3O)c2[C@@H]1c1cc(Br)c(O)c(OC)c1,C38705379_decoy,TRY1,Decoy,0,-8.47192,-5.12,-3.18,-5.59716817475211
CC(=O)c1cccc(Nc2ncnc(Nc3cc(Cl)c([C@@H](C#N)c4ccc(Cl)cc4)cc3C)c2N)c1,C40688611_decoy,TRY1,Decoy,0,-8.50303,-9.48,-3.7,-9.57173070412193
CCCSc1nc2n(n1)[C@H](c1ccc(OCc3ccc(Br)cc3)cc1)C(C(N)=O)=C(C)N2,C40981719_decoy,TRY1,Decoy,0,-9.05998,-7.08,-2.3,-7.228957138747147
CCOc1cccc([C@H]2[C@@H](C(=O)Nc3ccccc3C)C(=O)C[C@@](C)(O)[C@@H]2C(=O)Nc2ccccc2C)c1,C41006533_decoy,TRY1,Decoy,0,-7.32479,-7.63,-2.63,-9.83855251617826
CCCOc1cccc([C@H]2[C@@H](C(=O)Nc3ccccc3C)C(=O)C[C@@](C)(O)[C@@H]2C(=O)Nc2ccccc2C)c1,C41006629_decoy,TRY1,Decoy,0,-7.36243,-6.42,-3.18,-5.822997347864636
CC(C)CCOc1ccc([C@@H]2[C@@H](C(=O)Nc3ccccc3)C(=O)C[C@@](C)(O)[C@@H]2C(=O)Nc2ccccc2)cc1,C41007046_decoy,TRY1,Decoy,0,-8.2674,-5.18,-2.39,-6.161309878215934
CCOc1ccc(-c2n[nH]c3c2[C@H](c2ccc(OCc4c(F)cccc4Cl)cc2)C(C#N)=C(N)O3)cc1,C08846379_decoy,TRY1,Decoy,0,-7.54159,-6.71,-1.8,-5.399059419593083
CCC(=O)Nc1nc2ccc(NC(=S)NC(=O)c3ccc(-c4ccc(C)c(Cl)c4)o3)cc2s1,C57316041_decoy,TRY1,Decoy,0,-10.8835,-9.15,-2.13,-8.41252091968987
CCCC(=O)Nc1nc2ccc(NC(=S)NC(=O)c3ccc(-c4ccc(C)c(Cl)c4)o3)cc2s1,C22837275_decoy,TRY1,Decoy,0,-10.9834,-8.17,-2.54,-6.441913438253758
C/C(=N\Nc1nc(SCC(=O)Nc2c(Cl)cccc2Cl)n[nH]1)C12CC3CC(CC(C3)C1)C2,C59310651_decoy,TRY1,Decoy,0,-9.30185,-5.61,-3.59,-6.06559492991019
CCOc1cc(/C=N/NC(=O)Cc2csc(N)n2)cc(Cl)c1OCc1ccc(Cl)c(Cl)c1,C59645610_decoy,TRY1,Decoy,0,-11.4266,-6.37,-5.26,-2.770638736525109
O=C(N[C@H](NC(=S)Nc1ccc(N=Nc2ccccc2)cc1)C(Cl)(Cl)Cl)c1ccco1,C13305829_decoy,TRY1,Decoy,0,-8.36448,-6.94,-2.33,-6.784934653583776
COCCOc1cc(NC2CCCC2)cc2c(-c3ccnc(NC4CCCC4)n3)c(-c3ccc(F)cc3)nn12,C03991253_decoy,TRY1,Decoy,0,-9.50597,-6.27,-3.14,-7.306274259193448
O=C(N/N=C/c1ccc(-c2ccc(Cl)cc2)o1)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccccc1,C03143657_decoy,TRY1,Decoy,0,-9.68357,-8.52,-1.39,-7.969412721873397
CCCOc1ccc([C@H]2Nc3ccccc3NC3=C2C(=O)C[C@H](c2cc(OC)c(OC)c(OC)c2)C3)cc1,C08846805_decoy,TRY1,Decoy,0,-7.93607,-4.86,-3.47,-5.292582882671815
Cc1cc([N+](=O)[O-])c(Cl)cc1NC(=S)NC(=O)/C=C/c1ccc(-c2ccc(Cl)cc2Cl)o1,C08895140_decoy,TRY1,Decoy,0,-9.05421,-7.33,-2.86,-6.527925001907946
CC(C)CCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(C(C)C)cc3)[C@H]3C=C[C@@]2(O3)[C@H]1C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C,C09777251_decoy,TRY1,Decoy,0,-11.4441,-7.51,-2.06,-7.665409250922801
Cc1ccc(-c2ccc(/C=N/NC(=O)[C@@H](NC(=O)c3ccc(Cl)c(Cl)c3)C(C)C)o2)c([N+](=O)[O-])c1,C10040065_decoy,TRY1,Decoy,0,-10.356,-6.02,-2.72,-6.977392550705424
Cc1ccc(-c2ccc(/C=N/NC(=O)[C@@H](NC(=O)c3ccc(Cl)cc3Cl)C(C)C)o2)c([N+](=O)[O-])c1,C10042178_decoy,TRY1,Decoy,0,-10.0314,-9.4,-2.96,-9.707887176885691
CC(C)OC(=O)c1ccc(-c2ccc(/C=N\NC(=O)[C@H](NC(=O)c3ccccc3Cl)C(C)C)o2)cc1,C10041095_decoy,TRY1,Decoy,0,-8.98542,-6.47,-1.31,-6.765343553478898
Cc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)s2)c1C,C02655359_decoy,TRY1,Decoy,0,-9.68018,-8.52,-2.53,-9.587916054647511
C[C@H](NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)C(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl,C16322270_decoy,TRY1,Decoy,0,-8.5068,-5.83,-2.79,-6.385799885272733
COCCN(CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1C)C(=O)Nc1ccc(OC)cc1OC,C16436672_decoy,TRY1,Decoy,0,-7.41884,-7.58,-1.83,-6.545601791652279
COc1ccc([C@H]2CC(=O)C3=C(C2)NC(C)=C(C(=O)OC(C)C)[C@@H]3c2cc(Cl)c(O)c(OC)c2)cc1,C19880963_decoy,TRY1,Decoy,0,-7.16983,-5.16,-1.8,-5.048467148783705
COc1cc(OC)c([C@H]2Nc3ccccc3NC3=C2C(=O)C[C@H](c2ccc(OCC(C)C)cc2)C3)cc1OC,C21230175_decoy,TRY1,Decoy,0,-8.71682,-8.19,-3.67,-6.302943623955641
COc1ccc([C@H]2Nc3ccccc3NC3=C2C(=O)C[C@@H](c2ccc(OCC(C)C)cc2)C3)c(OC)c1OC,C21243162_decoy,TRY1,Decoy,0,-10.853,-8.0,-2.41,-8.595521117376107
CCOc1cc([C@H]2Nc3ccccc3NC3=C2C(=O)C[C@H](c2cc(OC)ccc2OC)C3)ccc1OC(C)C,C21244752_decoy,TRY1,Decoy,0,-10.66,-8.22,-3.04,-8.132526871505272
CCCCOc1ccccc1[C@H]1Nc2ccccc2NC2=C1C(=O)C[C@@H](c1cc(OC)c(OC)c(OC)c1)C2,C21257428_decoy,TRY1,Decoy,0,-9.45571,-7.02,-2.03,-5.908395772046693
CC(C)(C)c1ccc(C(=O)N/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1,C27522231_decoy,TRY1,Decoy,0,-9.23969,-8.45,-1.34,-7.358041607669894
CCOc1ccc(Oc2cc(NC(=O)c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](c3cccs3)N4)cc([N+](=O)[O-])c2)cc1,C01838691_decoy,TRY1,Decoy,0,-9.73364,-8.45,-4.31,-7.2877133173184925
COc1ccccc1NN(Nc1ccccc1C)c1nc(-n2nc(C)cc2C)nc2sc3c(c12)CCC3,C34786906_decoy,TRY1,Decoy,0,-9.3424,-7.22,-3.77,-8.288863439878227
Cc1ccc(C)c([C@@H]2C(C(=O)OC(C)C)=C(C(F)(F)F)N=C3SC=C(/C=C(\[O-])NCC[NH+](C)C)N32)c1,C35705418_decoy,TRY1,Decoy,0,-7.46812,-4.7,-3.8,-5.228255371624895
CCOC(=O)C1=C(CN2CCN(C(=O)NC(C)C)[C@H](C)C2)N(CC)C(=O)N[C@@H]1c1ccc(C(C)(C)C)cc1,C36006726_decoy,TRY1,Decoy,0,-7.60236,-7.33,-4.36,-6.453064920188782
COCCN(CC(=O)Nc1nc(-c2ccc(Cl)cc2)cn1-c1ccc(C)c(C)c1)C(=O)NC(C)(C)C,C36045109_decoy,TRY1,Decoy,0,-9.14252,-7.63,-2.97,-8.720982019671816
CCOc1cc([C@H]2C(C(=O)O[C@H](C)CC)=C(C)NC3=C2C(=O)C[C@H](c2ccc(OC)c(OC)c2)C3)ccc1O,C00976960_decoy,TRY1,Decoy,0,-7.22656,-5.81,-3.2,-6.274722070170136
CC(C)(C)NC(=O)[C@H](c1cc([N+](=O)[O-])ccc1Cl)N(C(=O)c1ccc(O)cc1)c1ccccc1Cl,C36545031_decoy,TRY1,Decoy,0,-7.17571,-4.66,-4.84,-5.031153877661775
CCOc1c(Cl)cc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2OC)cc1Cl,C38650047_decoy,TRY1,Decoy,0,-8.62842,-6.9,-1.91,-5.933569559184217
C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C(C)(C)C)cc4)ccc32)cc1,C38658193_decoy,TRY1,Decoy,0,-7.77073,-6.79,-1.25,-5.480842414751333
C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H](C)Oc4ccc(C(C)C)cc4)ccc32)cc1,C38658251_decoy,TRY1,Decoy,0,-9.22086,-6.85,-3.48,-6.321154946925255
CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccc(C(C)C)cc4)ccc32)cc1OC,C38659659_decoy,TRY1,Decoy,0,-8.56725,-6.68,-2.56,-6.65446476103099
COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C/c4ccc(C(C)(C)C)cc4)ccc32)c1,C38659788_decoy,TRY1,Decoy,0,-8.15688,-6.57,-3.37,-5.394297233360957
CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc([N+](=O)[O-])cc4)ccc32)cc1OC,C38660108_decoy,TRY1,Decoy,0,-8.12154,-7.12,-2.47,-5.6008494840771
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccc(C(C)C)cc4)ccc32)cc1,C38683667_decoy,TRY1,Decoy,0,-9.38027,-8.53,-1.5,-6.812837979883366
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccc(C(C)C)cc4)ccc32)cc1,C38683676_decoy,TRY1,Decoy,0,-7.90759,-6.6,-2.67,-6.06528066316235
CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(Cl)cc4C)ccc32)c1,C38684476_decoy,TRY1,Decoy,0,-8.6691,-8.04,-2.26,-6.415772390518381
CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(Cl)cc4)ccc32)cc1,C38685298_decoy,TRY1,Decoy,0,-9.13238,-8.01,-2.88,-8.437722634104368
C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)C4CCC(CCCC)CC4)ccc32)cc1OC,C38700623_decoy,TRY1,Decoy,0,-8.60014,10.94,-3.58,0.891213899497704
CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3oc4cc(C)cc(C)c4c3C)ccc21,C38700654_decoy,TRY1,Decoy,0,-7.95886,-7.05,-2.77,-5.579729762796288
CCCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4oc5cc(C)ccc5c4C)ccc32)c1,C38701256_decoy,TRY1,Decoy,0,-8.34642,-6.07,-1.59,-5.750822499940181
C=CCOc1ccc([C@H]2c3c(-c4cc(Cl)c(C)cc4O)n[nH]c3C(=O)N2Cc2ccc(OC)cc2)cc1,C39914876_decoy,TRY1,Decoy,0,-7.73121,-6.4,-2.12,-6.036876023482832
Cc1cc(O)c(-c2n[nH]c3c2[C@H](c2cccc(OCCC(C)C)c2)N(CCCOC(C)C)C3=O)cc1Cl,C39914968_decoy,TRY1,Decoy,0,-8.24747,-5.63,-2.59,-6.699507333267042
C=CCOc1ccc([C@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2Cc2ccc(C)cc2)cc1OCC,C38705860_decoy,TRY1,Decoy,0,-7.27872,-5.92,-2.15,-5.380639336408221
COc1ccccc1NC(=O)C1=C(C)Nc2nc(SCc3ccccc3Cl)nn2[C@@H]1c1ccccc1,C40902538_decoy,TRY1,Decoy,0,-7.68804,-7.59,-2.51,-7.5460002061119855
CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccccc2OCc2ccc(C(C)(C)C)cc2)n2nnnc2N1,C40923589_decoy,TRY1,Decoy,0,-7.55245,-8.83,-2.44,-6.422869409778779
CCCCOc1ccc([C@@H]2C(C(=O)Nc3ccc(C)cc3C)=C(C)Nc3nc(SCCC)nn32)cc1,C40981785_decoy,TRY1,Decoy,0,-9.8074,-5.89,-1.5,-9.163726193125385
CCCCCOc1ccc([C@H]2C(C(=O)Nc3ccc(C)cc3C)=C(C)Nc3nc(SCCC)nn32)cc1,C40981834_decoy,TRY1,Decoy,0,-9.74673,-4.68,-2.55,-6.413074559567825
COc1ccc([C@@H]2CC(=O)C3=C(C2)NC(C)=C(C(=O)OC(C)C)[C@H]3c2cc(Br)c(O)c(OC)c2)cc1OC,C00649683_decoy,TRY1,Decoy,0,-8.77254,-5.88,-2.86,-6.933849588306574
C=CCNC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2)n(-c2ccc(Cl)c(Cl)c2)c2nc3ccccc3nc12,C01845327_decoy,TRY1,Decoy,0,-10.1338,-6.53,-2.19,-8.545186838670777
CCOc1cc([C@H]2c3c(C)nn(-c4ccccc4)c3N=C3C(Nc4ccccc4OCC)=Nc4ccccc4N32)ccc1O,C01874645_decoy,TRY1,Decoy,0,-7.00466,-7.3,-1.61,-6.201335570183792
COc1ccc(/C=N\NC(=O)c2cc[nH]n2)cc1COc1c(Br)cc(Br)cc1Br,C01878714_decoy,TRY1,Decoy,0,-8.11977,-7.88,-1.97,-8.316444797646868
CCCCOc1ccc(Br)cc1[C@H]1C(C(=O)Nc2cccc(C)c2C)=C(C)Nc2nnnn21,C54616970_decoy,TRY1,Decoy,0,-8.46442,-5.53,-1.32,-5.705951102996944
COc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccc(OC(C)C)cc2)N3)c(OC)c1,C58849324_decoy,TRY1,Decoy,0,-9.54512,-7.8,-4.35,-7.25771677749938
O[C@H](C[NH2+]Cc1ccco1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccco2)cc1,C04200641_decoy,TRY1,Decoy,0,-8.19225,-5.95,-3.65,-5.967431021462363
O[C@H](C[NH2+]Cc1ccco1)COc1ccc(OC[C@H](O)C[NH2+]Cc2ccco2)cc1,C04200642_decoy,TRY1,Decoy,0,-8.88697,-6.27,-2.28,-6.918669930418074
O[C@@H](C[NH2+]Cc1ccco1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccco2)cc1,C04200643_decoy,TRY1,Decoy,0,-8.31651,-6.45,-1.81,-7.088052790676533
COCCNC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C04213712_decoy,TRY1,Decoy,0,-7.9752,-7.14,-1.27,-7.490347259125973
COc1cc(/C=N/NC(=O)CCCCCNc2n[nH]c(=O)[nH]c2=O)cc(Br)c1O,C01747743_decoy,TRY1,Decoy,0,-8.81361,-5.95,-2.31,-6.187083890725717
NC(=O)COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2COc2ccc(F)cc2)cc1,C02383267_decoy,TRY1,Decoy,0,-10.0054,-6.18,-1.78,-6.929761405317438
[NH3+]Cc1nnn(Cc2ccccc2)c1/N=C/Nc1c(C[NH3+])nnn1Cc1ccccc1,C05395581_decoy,TRY1,Decoy,0,-8.88095,-7.18,-1.77,-9.01503015369584
CC[NH+](CC)Cc1cc(Nc2cc(C)nc(Nc3ccc(O)c(C[NH+](CC)CC)c3)n2)ccc1O,C01607984_decoy,TRY1,Decoy,0,-10.2261,-6.09,-3.35,-8.123819691549592
CC(C)CCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06076911_decoy,TRY1,Decoy,0,-9.05999,-6.15,-2.5,-7.019782172775563
CC(C)C[C@H](C(=O)NC(C)(C)C)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06190442_decoy,TRY1,Decoy,0,-8.50043,-6.2,-2.02,-7.570211101419869
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1OC,C06462269_decoy,TRY1,Decoy,0,-7.33477,-5.33,-2.62,-5.7021927095813005
CCOC(=O)CNC(=O)[C@H](C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06546877_decoy,TRY1,Decoy,0,-7.83381,-7.53,-3.37,-10.168011201662535
CC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06631845_decoy,TRY1,Decoy,0,-7.81475,-5.74,-2.03,-6.012721704516628
COCCNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06905091_decoy,TRY1,Decoy,0,-7.54191,-5.57,-3.6,-5.555599650877586
COc1cc(C[NH2+]CCSc2nc(C)n[nH]2)ccc1OC[C@@H](O)C[NH+](C)C(C)C,C12200618_decoy,TRY1,Decoy,0,-7.75724,-6.32,-2.22,-6.704175135655962
COc1cc(C[NH2+]CCSc2nc(C)n[nH]2)ccc1OC[C@H](O)C[NH+](C)C(C)C,C12200624_decoy,TRY1,Decoy,0,-9.11217,-5.19,-2.35,-5.608640821858835
COc1cc(C[NH2+]CCSc2ncn[nH]2)ccc1OC[C@H](O)C[NH+]1CCSCC1,C12457537_decoy,TRY1,Decoy,0,-8.67646,-5.81,-2.88,-7.011813109320717
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C12467434_decoy,TRY1,Decoy,0,-8.11196,-5.82,-1.89,-6.3634509315672805
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(Cl)cc2)o1,C12480040_decoy,TRY1,Decoy,0,-8.59403,-5.19,-2.51,-5.684067089579738
COC(=O)C1CC[NH+](C[C@@H](O)COc2ccc(C[NH2+]CCc3cn[nH]c3)cc2)CC1,C12585429_decoy,TRY1,Decoy,0,-9.3047,-6.64,-4.19,-7.330102322670211
COC(=O)C1CC[NH+](C[C@H](O)COc2ccc(C[NH2+]CCc3cn[nH]c3)cc2)CC1,C12585434_decoy,TRY1,Decoy,0,-9.04989,-6.25,-2.99,-6.5275105936210975
CCOC(=O)CNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(CC)cc1,C06822222_decoy,TRY1,Decoy,0,-7.90217,-7.17,-3.58,-7.791691455187343
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccncc2)cc1,C06089847_decoy,TRY1,Decoy,0,-7.60494,-6.48,-2.71,-8.22361805943833
O[C@H](C[NH2+]Cc1ccco1)COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccco2)cc1,C13581902_decoy,TRY1,Decoy,0,-7.93748,-6.47,-1.34,-6.5088293451854655
Cc1cc(C)nc(N/C(=N\C(=S)Nc2ccc(Nc3ccccc3)cc2)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1,C14157998_decoy,TRY1,Decoy,0,-10.4701,-6.42,-3.54,-6.722776845927652
CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSc1nc(N)c2nc[nH]c2n1,C03169293_decoy,TRY1,Decoy,0,-8.92213,-7.09,-1.6,-9.187152495452551
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CCCn2cccn2)c1,C14951802_decoy,TRY1,Decoy,0,-8.59896,-6.2,-2.21,-6.107856534558182
Nc1ncnc2[nH]c(NCCSSCCNc3nc4c(N)ncnc4[nH]3)nc12,C17044035_decoy,TRY1,Decoy,0,-10.2872,-7.59,-1.57,-7.048964592247788
Cc1n[nH]c(SCC[NH2+]Cc2ccc(OC[C@@H](O)CN3CC[NH+](C)CC3)cc2)n1,C19228331_decoy,TRY1,Decoy,0,-9.18517,-6.21,-1.45,-6.989559142469935
OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(/C=N/Nc1ccccc1)=N\Nc1ccccc1,C19879576_decoy,TRY1,Decoy,0,-7.3307,-6.05,-3.2,-6.24512983399657
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2ccccc2O)n1N,C20527317_decoy,TRY1,Decoy,0,-7.84629,-7.31,-1.68,-6.272000061722745
C=C[C@@](C)(O)CC/C=C(\C)CC[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C35466047_decoy,TRY1,Decoy,0,-7.65951,-7.25,-3.54,-7.358306560272322
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl,C25386912_decoy,TRY1,Decoy,0,-8.09447,-6.73,-2.43,-5.937487398985437
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)c1c(O)cccc1O,C36570981_decoy,TRY1,Decoy,0,-7.57367,-5.1,-3.1,-6.357640613668978
O[C@H](C[NH2+]C[C@@H]1CCCO1)COc1ccc(OC[C@@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C12139828_decoy,TRY1,Decoy,0,-8.72919,-5.79,-3.1,-5.9555347002492525
C=C[C@@](C)(O)CC/C(C)=C/CC[C@@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31157165_decoy,TRY1,Decoy,0,-8.78101,-6.4,-3.6,-6.579515712091912
CCC[C@H](C(=O)NC(C)(C)C)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04161171_decoy,TRY1,Decoy,0,-8.76508,-6.51,-0.33,-13.314672188182625
O[C@H](C[NH2+]C[C@@H]1CCCO1)COc1ccc(OC[C@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C04200645_decoy,TRY1,Decoy,0,-9.09075,-6.71,-2.99,-8.7328945042351
O[C@H](C[NH2+]C[C@H]1CCCO1)COc1ccc(OC[C@@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C13151613_decoy,TRY1,Decoy,0,-8.86369,-5.52,-3.1,-5.760044627292847
O=C(CCCCCC(=O)N/N=C/c1ccc(O)cc1O)N/N=C/c1ccc(O)cc1O,C02343681_decoy,TRY1,Decoy,0,-10.5522,-8.03,-3.91,-8.222054799480805
C[C@H](O)C/C=C\CCCCc1cc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)cc(O)c2c(=O)o1,C39560027_decoy,TRY1,Decoy,0,-8.224,-7.17,-4.08,-6.502695687553819
CCOC(=O)CSc1nnc(N)n1[C@@H](C)C(=O)Nc1sc(C)c(C)c1C(N)=O,C40174538_decoy,TRY1,Decoy,0,-6.88397,-5.33,-2.18,-5.142831501000977
CCOC(=O)CSc1nnc(N)n1[C@H](CC)C(=O)Nc1sc(C)c(C)c1C(N)=O,C40174572_decoy,TRY1,Decoy,0,-8.46793,-5.7,-3.69,-6.277039299792282
Cc1ccc(S(=O)(=O)NNc2ncnc(NCCCN3CCOCC3)c2N)cc1,C40756686_decoy,TRY1,Decoy,0,-9.06937,-7.14,-4.66,-6.668092202862384
COCCCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCCC3)n1,C41026355_decoy,TRY1,Decoy,0,-8.88805,-6.62,-2.85,-7.858061606296675
COC(CNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1)OC,C41301995_decoy,TRY1,Decoy,0,-7.92133,-7.02,-2.79,-8.14237039245472
Cc1n[nH]c2cnc(-c3cncc(OC[C@@H]([NH3+])Cc4cccc(OCC[NH3+])c4)c3)cc12,C45289396_decoy,TRY1,Decoy,0,-9.51023,-7.19,-2.58,-7.210695665524135
CC[NH+](CC)CCC[C@H](C)Nc1cc(N)[nH+]c2nc(-c3ccc([N+](=O)[O-])cc3)cnc12,C06382149_decoy,TRY1,Decoy,0,-7.93024,-7.15,-1.46,-7.725666238039863
COc1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)cc1O,C59879279_decoy,TRY1,Decoy,0,-8.99026,-6.21,-2.48,-5.694167628751878
NC(=O)Cc1ccc(OCC2=[NH+][C@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)ON2)cc1,C63818502_decoy,TRY1,Decoy,0,-8.52143,-7.92,-1.72,-6.320697732238229
CC(C)(C)NC(=O)[C@H](c1ccco1)N(CCCO)C(=O)c1snc(C(N)=O)c1N,C06075032_decoy,TRY1,Decoy,0,-8.75843,-6.35,-3.13,-11.20333182986658
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06546871_decoy,TRY1,Decoy,0,-7.50837,-4.7,-1.96,-5.3666259224742126
CCCCn1c(N)c(N(CCOC)C(=O)COC(=O)c2c(C)nsc2N)c(=O)[nH]c1=O,C09244417_decoy,TRY1,Decoy,0,-8.57641,-6.18,-2.64,-6.408891626507146
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C[C@@H]2CCCO2)C(=O)c2snc(C(N)=O)c2N)o1,C12716085_decoy,TRY1,Decoy,0,-9.73231,-6.99,-1.28,-9.850940587820684
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NCCCCCc1n[nH]c(N)c1C#N,C12547435_decoy,TRY1,Decoy,0,-8.63023,-7.9,-3.9,-6.48037288090158
CNC(=S)/N=C(\NCCc1ccc(S(N)(=O)=O)cc1)Nc1nc(C)cc(C)n1,C14157935_decoy,TRY1,Decoy,0,-8.2466,-5.44,-2.38,-5.13708036316
C=C(N)N(C)CC[C@@H]([NH3+])CC(=O)N[C@H]1C=C[C@H](n2ccc(N)nc2=O)O[C@@H]1C(=O)[O-],C14806384_decoy,TRY1,Decoy,0,-7.63861,-6.1,-3.94,-6.632742798907144
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(F)(F)F)n[nH]2)c1O,C20832701_decoy,TRY1,Decoy,0,-8.77647,-7.81,-4.35,-9.832495514634928
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@H]1O[C@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]1O,C22066106_decoy,TRY1,Decoy,0,-5.73348,-7.34,-2.09,-6.585439794060411
O=C(C[C@H]([NH2+]CCO)C(=O)[O-])Nc1ccc(S(=O)(=O)/N=c2\[nH]ccs2)cc1,C16778902_decoy,TRY1,Decoy,0,-5.94221,-6.3,-2.53,-5.141678132251705
C[C@@H](NC(=O)CSc1ncnc2nc[nH]c12)C(=O)N[C@@H](CCC(=O)[O-])C(N)=O,C25578751_decoy,TRY1,Decoy,0,-8.22875,-6.91,-2.67,-7.038672292732905
C[C@H](NC(=O)CSc1ncnc2nc[nH]c12)C(=O)N[C@@H](CCC(=O)[O-])C(N)=O,C25578758_decoy,TRY1,Decoy,0,-7.2748,-5.93,-4.91,-5.896479714654832
C[C@@H](NC(=O)CSc1ncnc2nc[nH]c12)C(=O)N[C@H](CCC(=O)[O-])C(N)=O,C25578764_decoy,TRY1,Decoy,0,-7.95772,-6.3,-1.57,-7.460647099930198
C[C@H](NC(=O)CSc1ncnc2nc[nH]c12)C(=O)N[C@H](CCC(=O)[O-])C(N)=O,C25578770_decoy,TRY1,Decoy,0,-8.71618,-5.65,-1.92,-6.911912401568602
O=C([O-])C[C@H](NC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccc(F)cc1,C29565655_decoy,TRY1,Decoy,0,-8.58528,-6.89,-3.91,-7.644608514102125
C=C(C(=O)OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O)[C@@H](O)CO,C31156385_decoy,TRY1,Decoy,0,-7.4222,-8.18,-1.4,-6.498238394586118
C[C@@](O)(CC(=O)[O-])CC(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,C31167898_decoy,TRY1,Decoy,0,-6.7713,-5.1,-3.21,-5.70783480709492
CC(=O)O[C@H]([C@@H](CO)OC(C)=O)[C@@H](CNc1nc(N)[nH]c(=O)c1[N+](=O)[O-])OC(C)=O,C17175125_decoy,TRY1,Decoy,0,-6.25802,-6.11,-2.9,-8.781853517763906
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)CO,C36600366_decoy,TRY1,Decoy,0,-7.04253,-4.73,-3.77,-5.408985068586083
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)CO,C36600367_decoy,TRY1,Decoy,0,-7.87981,-5.69,-4.88,-6.461170725982444
CC(=O)NCCCCCNC(=O)C[C@](O)(CC(=O)NCCCCCN(O)C(C)=O)C(=O)[O-],C37538708_decoy,TRY1,Decoy,0,-7.00292,-6.52,-4.06,-5.953884676758339
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C06135966_decoy,TRY1,Decoy,0,-8.00403,-8.16,-2.85,-9.34109551485742
COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35456718_decoy,TRY1,Decoy,0,-8.84578,-5.96,-4.18,-5.804908853646136
CCCCN(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)c1c(N)n(CCC)c(=O)[nH]c1=O,C12848212_decoy,TRY1,Decoy,0,-8.54609,-6.97,-2.48,-6.155395517402995
CCC[C@@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04161172_decoy,TRY1,Decoy,0,-8.10547,-7.23,-3.44,-8.802462007367879
NC(=O)N[C@@H](CC(=O)OCC(=O)NC(=O)NCc1ccco1)c1ccc(Cl)cc1,C04195418_decoy,TRY1,Decoy,0,-8.5867,-7.26,-2.77,-8.49199392246456
Nc1nnc(SCC(=O)NCCNC(=O)CSc2nnc(N)s2)s1,C13023240_decoy,TRY1,Decoy,0,-9.81618,-6.66,-3.29,-9.391858967038134
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(/C=N\Nc1ccccc1)=N\Nc1ccccc1,C17950824_decoy,TRY1,Decoy,0,-8.5025,-5.92,-1.3,-7.074057368139068
C[C@@H](O)C/C=C\CCCCc1cc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)cc(O)c2c(=O)o1,C39560028_decoy,TRY1,Decoy,0,-8.04948,-7.36,-3.45,-6.60291225172715
NC1=N[C@@H](SCCCCC(=O)NCC(=O)NCC(=O)NCC(=O)[O-])C2=NC=NC2=N1,C39943673_decoy,TRY1,Decoy,0,-6.80754,-6.94,-2.29,-6.1233008181757125
CCOC(=O)CSc1nnc(N)n1[C@H](C)C(=O)Nc1sc(C)c(C)c1C(N)=O,C40174540_decoy,TRY1,Decoy,0,-7.79591,-6.15,-3.43,-7.245004220191052
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NNC(C)(C)C)c2N)cc1,C40759517_decoy,TRY1,Decoy,0,-7.3289,-5.35,-2.61,-4.710704026450014
NC(=O)c1c(Nc2nc(NCCOCCO)nc3c2cnn3-c2ccccc2)sc2c1CCCC2,C41026002_decoy,TRY1,Decoy,0,-11.2388,-6.93,-2.65,-8.396900147024592
CCCCN1C(=O)[C@H]2[C@@H](c3cc(Br)ccc3OC)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33880643_decoy,TRY1,Decoy,0,-8.35937,-7.68,-2.88,-8.003146098665054
[NH3+]CCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21,C44075487_decoy,TRY1,Decoy,0,-9.58389,-5.74,-3.5,-7.800100062569746
CC(=O)C[C@@H]1[C@H](O)[C@H](O)[C@@H](CO)O[C@H]1NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C44075500_decoy,TRY1,Decoy,0,-7.32422,-6.08,-2.19,-5.450755363507934
COc1cc([C@H](O)[C@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C49181382_decoy,TRY1,Decoy,0,-7.79403,-6.61,-3.46,-5.368393838754843
COc1cc([C@H](O)[C@@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C49181388_decoy,TRY1,Decoy,0,-7.59295,-6.89,-3.48,-5.373569635306378
CO[C@H](C[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c1c(O)ccc(C(C)=O)c1O)C(=O)[O-],C49601558_decoy,TRY1,Decoy,0,-6.33754,-5.19,-2.73,-4.793692326974238
CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59883951_decoy,TRY1,Decoy,0,-8.68148,-8.5,-3.18,-10.303366977571034
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59883954_decoy,TRY1,Decoy,0,-9.43365,-8.06,-2.93,-7.894604168571375
CCCCn1c(N)c(N(CCOC)C(=O)COC(=O)c2cc(N)ccc2Cl)c(=O)[nH]c1=O,C60380698_decoy,TRY1,Decoy,0,-7.67609,-6.8,-2.46,-7.569301672017876
CC1=Nc2nc(N)nn2[C@H](C)[C@@H]1CCC(=O)NCCCCCc1[nH]nc(N)c1C#N,C39932293_decoy,TRY1,Decoy,0,-8.22088,-7.94,-2.39,-6.8877228839076805
[NH3+]CCCCCC(=O)N[C@@H](Cc1ccc(O)c(/N=N/c2ccc(NC(=O)C(=O)[O-])cc2)c1)C(=O)[O-],C27534297_decoy,TRY1,Decoy,0,-10.8747,-6.83,-4.22,-7.517339338437064
CC(C)(C)OC(=O)[C@@H](NC(=O)C[NH2+][C@H](CC(N)=O)C(=O)[O-])OC(=O)[C@@H](N)CS,C64219595_decoy,TRY1,Decoy,0,-9.27722,-5.47,-1.62,-6.899378447545418
[H]/N=C(\NCCC[C@H]([NH3+])C(=O)[O-])NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2,C36208741_decoy,TRY1,Decoy,0,-6.81998,-5.92,-2.61,-5.341414107459888
COc1c(O)c(C)c(CCCCCCCCCCO)c(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c1OC,C65742898_decoy,TRY1,Decoy,0,-7.1947,-6.17,-3.32,-6.680079821945756
COc1c(O)c(C)c(CCCCCCCCCCO)c(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c1OC,C65742900_decoy,TRY1,Decoy,0,-6.96759,-6.56,-4.43,-5.970798076534585
COc1c(O)c(CCCCCCCCCCO)c(C)c(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c1OC,C65742904_decoy,TRY1,Decoy,0,-8.09548,-5.41,-4.02,-6.233910054327946
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C65748518_decoy,TRY1,Decoy,0,-5.97198,-7.45,-1.79,-7.465363769107544
CC(C)[NH2+]CCCNc1nc(NCCC[NH2+]C(C)C)c2nc(-c3ccccc3)c(-c3ccccc3)nc2n1,C05743137_decoy,TRY1,Decoy,0,-9.93331,-7.77,-1.98,-9.419066742174206
CC(C)CCNC(=O)[C@@H](c1ccco1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06134274_decoy,TRY1,Decoy,0,-8.64189,-7.38,-1.31,-9.140015315194065
CC(C)CCNC(=O)[C@@H](c1cccs1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06134314_decoy,TRY1,Decoy,0,-8.531,-6.23,-1.12,-6.776279543980989
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)CC)c2ccc(F)cc2)cc1,C06462023_decoy,TRY1,Decoy,0,-8.35647,-6.99,-1.74,-8.138943731710048
CCOC(=O)CNC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C06546494_decoy,TRY1,Decoy,0,-7.92499,-7.71,-3.22,-8.256451329806465
CCOC(=O)CNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1,C06546742_decoy,TRY1,Decoy,0,-7.40202,-6.04,-1.7,-5.724675390096272
CCOC(=O)CNC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1C,C06547199_decoy,TRY1,Decoy,0,-7.85436,-6.78,-3.6,-7.908973829260988
CC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)c(Cl)c1,C06631831_decoy,TRY1,Decoy,0,-7.41215,-7.39,-3.92,-9.087066451576195
COc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C07059758_decoy,TRY1,Decoy,0,-7.78046,-7.7,-0.68,-8.928686450054085
C[NH+](Cc1n[nH]c(=O)[nH]1)Cc1ccccc1OC[C@H](O)C[NH+]1CCc2ccccc2C1,C11814881_decoy,TRY1,Decoy,0,-7.94446,-7.49,-2.95,-8.609219233521426
COc1cc(C[NH2+]CCN2CCNC2=O)ccc1OC[C@@H](O)C[NH+]1CCSCC1,C12193847_decoy,TRY1,Decoy,0,-7.22779,-6.08,-4.11,-6.48353061499325
COc1cc(C[NH2+]CCN2CCNC2=O)ccc1OC[C@H](O)C[NH+]1CCSCC1,C12193855_decoy,TRY1,Decoy,0,-8.02093,-5.63,-1.35,-5.079841279146627
COC(=O)C1CC[NH+](C[C@H](O)COc2ccc(C[NH2+]Cc3n[nH]c4c3CCC4)cc2)CC1,C12299657_decoy,TRY1,Decoy,0,-9.80106,-6.8,-2.99,-6.181131610758984
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(Cl)cc2)o1,C12480050_decoy,TRY1,Decoy,0,-7.7225,-7.35,-2.79,-7.484347728734603
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2cc(C(C)C)no2)c1,C12702086_decoy,TRY1,Decoy,0,-9.11952,-5.65,-3.29,-6.307658963710944
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]Cc2cc(C(C)C)no2)c1,C12702090_decoy,TRY1,Decoy,0,-9.40231,-6.74,-2.09,-7.562247181608653
COc1cc(C[NH2+]CCOc2cccnc2)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C12306591_decoy,TRY1,Decoy,0,-8.41554,-6.66,-2.23,-5.713660345407867
Cc1cc[nH+]c(NCCCCC(=O)NNC(=O)N[C@@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)c1,C13472612_decoy,TRY1,Decoy,0,-8.98618,-5.92,-1.75,-6.351230108360885
COc1cc(C[NH2+]CCc2nc(C)cc(C)n2)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C11661608_decoy,TRY1,Decoy,0,-9.34391,-6.89,-2.91,-6.826215955689637
COCCNC(=O)[C@@H](c1ccc2ncccc2c1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06136202_decoy,TRY1,Decoy,0,-7.92938,-6.13,-2.55,-7.126592751155268
CNC(=S)NCCN(CCN(CCNC(=S)NC)C(=S)NC)C(=S)NC,C16189335_decoy,TRY1,Decoy,0,-10.9936,-4.89,-3.12,-9.186398918648871
O[C@@H](C[NH2+]C[C@@H]1CCCO1)COc1ccc(OC[C@@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C12139827_decoy,TRY1,Decoy,0,-9.6573,-4.68,-2.53,-6.017400234258335
Cc1n[nH]c(SCC[NH2+]Cc2ccc(OC[C@H](O)CN3CC[NH+](C)CC3)cc2)n1,C19228329_decoy,TRY1,Decoy,0,-8.86233,-6.27,-3.02,-5.849153713372798
CCCC1=CC(=O)N[C@@](NCCN[C@@]2(SC)NC(=O)C=C(CCC)N2)(SC)N1,C19372377_decoy,TRY1,Decoy,0,-9.08738,-5.6,-3.67,-6.018595249736368
CC[NH+]1CCN(C[C@@H](O)COc2ccc(C[NH2+]CCc3c(C)n[nH]c3C)cc2OC)CC1,C20515087_decoy,TRY1,Decoy,0,-9.64486,-6.58,-2.38,-6.522146970853846
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)c1O,C20832699_decoy,TRY1,Decoy,0,-9.03325,-7.28,-1.49,-6.425591920068632
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(NN=C3CCCC3)n2)s1,C20836751_decoy,TRY1,Decoy,0,-10.018,-7.87,-1.77,-13.2908066784767
COCC(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2c(O)ccc3ccccc23)n1,C20907738_decoy,TRY1,Decoy,0,-8.4404,-7.05,-3.22,-6.60878693390724
CCC(=O)NNC(=O)CSc1nnc(N/N=C/c2c(C)nn(C(C)C)c2C)n1N,C20912059_decoy,TRY1,Decoy,0,-8.57973,-6.43,-3.51,-5.810198712036767
CC(C)n1cc(/C=N/Nc2nnc(SCC(=O)NNC(=O)C(C)(C)C)n2N)cn1,C20921739_decoy,TRY1,Decoy,0,-8.31355,-5.85,-4.31,-5.706442267567194
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)c1,C21078148_decoy,TRY1,Decoy,0,-8.83457,-9.68,-2.71,-9.869430004794111
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]1O,C21981337_decoy,TRY1,Decoy,0,-5.78521,-7.57,-1.66,-7.000669693421224
CCCCn1c(N)c(N(CC)CC(=O)N(CCC(N)=O)c2ccccc2)c(=O)[nH]c1=O,C24956278_decoy,TRY1,Decoy,0,-7.45381,-6.65,-1.17,-7.560867583228777
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O,C35653053_decoy,TRY1,Decoy,0,-6.13753,-6.9,-1.67,-6.688821568806547
CCCCCCN(C(=O)CO)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36517763_decoy,TRY1,Decoy,0,-7.49269,-6.51,-2.2,-6.454237452337942
CCCCCCN(C(=O)CO)[C@@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36517764_decoy,TRY1,Decoy,0,-7.4434,-7.08,-3.36,-8.971495062898827
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C06135866_decoy,TRY1,Decoy,0,-9.71211,-7.09,-4.24,-8.638168364846294
O[C@H](C[NH2+]C[C@H]1CCCO1)COc1ccc(OC[C@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C04262952_decoy,TRY1,Decoy,0,-9.45069,-5.96,-1.73,-7.004071380112174
COc1cc([C@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)ccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31159883_decoy,TRY1,Decoy,0,-8.29449,-6.46,-2.71,-5.610681906254204
CCC[C@H](C(=O)NC(C)(C)C)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04161173_decoy,TRY1,Decoy,0,-8.72191,-5.9,-3.8,-6.742682782870077
O[C@@H](C[NH2+]C[C@H]1CCCO1)COc1ccc(OC[C@@H](O)C[NH2+]C[C@@H]2CCCO2)cc1,C13151612_decoy,TRY1,Decoy,0,-9.34241,-6.48,-3.28,-7.448400659547359
CC[C@@H](C(=O)Nc1sc(C)c(C)c1C(N)=O)n1c(N)nnc1SCC(=O)OC,C40174028_decoy,TRY1,Decoy,0,-6.62464,-6.1,-1.9,-5.385109658563192
COc1cc(NC(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2[NH+](C)CC[NH+](C)C)cc(OC)c1,C20464980_decoy,TRY1,Decoy,0,-7.33541,-5.12,-2.96,-5.184671700861419
O[C@H](C[NH2+]C[C@@H]1CCCO1)COc1ccc(OC[C@@H](O)C[NH2+]C[C@H]2CCCO2)cc1,C04262953_decoy,TRY1,Decoy,0,-9.20569,-6.06,-3.31,-6.230363636091839
CC[NH+](CC)CCC[C@@H](C)Nc1cc(N)[nH+]c2nc(-c3ccc([N+](=O)[O-])cc3)cnc12,C01719593_decoy,TRY1,Decoy,0,-8.07408,-5.49,-1.55,-5.2565436538122885
Cc1ccc(NC(=O)NCCCn2cc[nH+]c2)cc1NC(=O)NCCCn1cc[nH+]c1,C22892814_decoy,TRY1,Decoy,0,-8.05948,-7.71,-4.2,-6.618116650538249
CCC/C(C)=N/Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1,C59890465_decoy,TRY1,Decoy,0,-10.8894,-7.27,-2.57,-9.369555104865444
CCOc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1nnc(SCC(N)=O)s1)[NH+]=2,C63302006_decoy,TRY1,Decoy,0,-8.76034,-6.39,-1.98,-5.714115220095848
C=CCOC(=O)[C@@](N)(C[C@H]([NH3+])C(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21,C64219197_decoy,TRY1,Decoy,0,-7.66608,-6.64,-2.37,-5.85773496116577
Nc1ccc(NC(=O)C[C@H]([NH2+]CCNc2ccccc2[N+](=O)[O-])C(=O)[O-])cc1[N+](=O)[O-],C65090388_decoy,TRY1,Decoy,0,-4.64028,-7.0,-4.4,-4.88441580755021
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]3CC(=O)NCC[NH+](C)C)cc1,C04222265_decoy,TRY1,Decoy,0,-10.8978,-7.64,-2.41,-8.469657426004453
O=C(NCC[NH+]1CCOCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(Cl)cc3)S[C@@H]21,C08643793_decoy,TRY1,Decoy,0,-9.93079,-6.16,-1.36,-6.338124056693534
CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](CC(N)=O)[NH2+][C@@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@@H]3C2=O)cc1,C08789393_decoy,TRY1,Decoy,0,-9.15986,-5.41,-2.04,-5.5256422388122175
NC(=O)C[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(C[C@@H]3CCCO3)C(=O)[C@H]12,C08972074_decoy,TRY1,Decoy,0,-9.65327,-7.55,-0.96,-9.165855887312135
CCCCn1c(N)c(N(C(=O)C[NH+]2CCN(c3ccc(O)cc3)CC2)C2CCCC2)c(=O)[nH]c1=O,C09726304_decoy,TRY1,Decoy,0,-8.69976,-5.48,-2.28,-7.645267850263895
CC(=O)Nc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C(=O)Nc3ccccc3O)CC2)cc1,C12795329_decoy,TRY1,Decoy,0,-8.94449,-6.9,-3.15,-5.860564614833316
Cc1cc(Cl)c2c(c1)[C@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2,C12883470_decoy,TRY1,Decoy,0,-8.02431,-7.96,-1.7,-5.24317885177719
O=C(NC(=O)N(C(=O)NC1=[NH+][C@@H]2CCCC[C@@H]2N1)c1ccc(Cl)cc1)Nc1ccc(Cl)cc1,C02196920_decoy,TRY1,Decoy,0,-8.2868,-7.46,-2.73,-6.582380439022146
CCOc1ccc(-n2c(O)nc(O)c([C@H]3[NH2+]CCc4c3[nH]c3ccc(OC)cc43)c2=O)cc1,C09011906_decoy,TRY1,Decoy,0,-7.70961,-6.59,-2.54,-5.244552645576224
CC(C)n1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cn1,C20911233_decoy,TRY1,Decoy,0,-9.82179,-5.53,-2.07,-6.354428814594145
[NH3+]C(CO)(CO)CCc1ccc(Sc2cccc(Oc3ccccc3)c2)cc1Cl,C27646965_decoy,TRY1,Decoy,0,-9.30313,-6.08,-4.26,-5.747331466232925
C[C@]12CC[C@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1C[C@](CO)(CCCC[NH2+]CCc1ccccn1)[C@@H]2O,C36748732_decoy,TRY1,Decoy,0,-10.7063,-9.29,-0.98,-8.507787695279118
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1ccccc1C3=O,C03830922_decoy,TRY1,Decoy,0,-5.8449,-7.98,-3.95,-4.732607580977903
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@@H]1NN[C@H](SCc2ccc(Cl)cc2Cl)O1,C38966434_decoy,TRY1,Decoy,0,-7.6243,-5.73,-1.96,-5.473709017981203
Cc1csc(NC(=O)CS[C@@H]2NN[C@H](c3cc(Br)ccc3O)[NH+]2C)n1,C39035092_decoy,TRY1,Decoy,0,-9.16226,-5.49,-4.26,-5.133448701677756
C[C@@H]1CN(C[C@H]2N[NH2+]NN2CC(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)C[C@H](C)O1,C39442655_decoy,TRY1,Decoy,0,-7.80279,-7.75,-1.34,-6.271345438225153
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@H]3C[C@@H]2CO1,C39467095_decoy,TRY1,Decoy,0,-8.39784,-6.14,-1.13,-4.922572438806182
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@H]3C[C@H]2CO1,C39467099_decoy,TRY1,Decoy,0,-8.27269,-5.61,-2.78,-4.140304776122142
Oc1ccccc1-c1ccc([C@@H](CNBr)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533971_decoy,TRY1,Decoy,0,-8.61221,-6.57,-1.94,-6.211378542402454
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@H](c2cc(C)on2)ON1,C39597837_decoy,TRY1,Decoy,0,-9.04433,-8.09,-3.29,-7.106800583078559
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c(F)c1F,C39661803_decoy,TRY1,Decoy,0,-10.1704,-8.5,-1.16,-7.12860258032776
CC(C)CNc1cc(-c2nc(SC[C@H](O)CO)[nH]c2-c2ccc(F)cc2)cc[nH+]1,C40392968_decoy,TRY1,Decoy,0,-10.07,-8.17,-0.97,-9.455576953927698
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)cc1,C40744455_decoy,TRY1,Decoy,0,-8.7279,-7.99,-2.54,-7.412688132911258
Cc1ccccc1COc1ccc(Cl)cc1C[NH2+]CCNC(=O)c1nonc1N,C40744543_decoy,TRY1,Decoy,0,-8.5265,-7.59,-1.64,-7.652418921742715
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cccc2cccnc12,C40758285_decoy,TRY1,Decoy,0,-7.48639,-6.1,-1.72,-5.681475397706162
Cc1ccc2cccc(Nc3[nH+]cnc(NN(c4ccccc4)c4ccccc4)c3N)c2n1,C40758570_decoy,TRY1,Decoy,0,-7.86249,-6.36,-4.12,-5.206240874673505
CC1(C)CC(Nc2ncnc(Nc3ccc(Cl)c(C(F)(F)F)c3)c2N)CC(C)(C)[NH2+]1,C40760864_decoy,TRY1,Decoy,0,-8.83613,-5.93,-3.2,-5.161525097013268
Cc1ccc2c(Nc3ncnc(Nc4ccccc4Br)c3N)cccc2[nH+]1,C40781496_decoy,TRY1,Decoy,0,-8.73883,-7.81,-1.51,-5.763527979751198
Cc1ccc2c(Nc3ncnc(Nc4ccc(Br)cc4)c3N)cccc2[nH+]1,C40782339_decoy,TRY1,Decoy,0,-8.97467,-7.46,-1.78,-6.883391660599451
Cc1ccc2c(Nc3ncnc(Nc4nc5c(C)cccc5s4)c3N)cccc2[nH+]1,C40783549_decoy,TRY1,Decoy,0,-9.08733,-8.55,-2.14,-12.618783349244294
Cc1ccc2nc(Nc3ncnc(Nc4cccc5[nH+]c(C)ccc45)c3N)sc2c1,C40783643_decoy,TRY1,Decoy,0,-7.99969,-8.13,-2.05,-6.966853844589495
Cc1ccc2c(Nc3ncnc(Nc4cccc(Br)c4)c3N)cccc2[nH+]1,C40797414_decoy,TRY1,Decoy,0,-9.21148,-7.85,-1.31,-7.145190655108856
Cc1ccc2c(Nc3ncnc(Nc4ccc(OC(F)(F)F)cc4)c3N)cccc2[nH+]1,C40799867_decoy,TRY1,Decoy,0,-7.59082,-6.34,-1.86,-5.492609071163948
CC(=O)[C@@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44019202_decoy,TRY1,Decoy,0,-9.41352,-8.14,-1.88,-6.625594767729945
C[C@H](O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44960180_decoy,TRY1,Decoy,0,-7.61997,-8.15,-1.08,-5.718152800129294
CCOc1ccc(Nc2c(CC)c(NC3CCC([NH3+])CC3)c(C#N)c3ccnn23)cc1,C45245265_decoy,TRY1,Decoy,0,-8.8959,-7.7,-1.75,-6.378777283567537
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)c1sc2[nH+]c(C)cc(C)c2c1N,C46585972_decoy,TRY1,Decoy,0,-8.45866,-5.73,-2.58,-5.948118513113362
NC(=O)c1sc2[nH+]c3c(c(-c4ccc(C(F)(F)F)o4)c2c1N)CCCCCC3,C49070922_decoy,TRY1,Decoy,0,-7.25524,-7.8,-0.17,-8.552804366462853
CSCC[C@@H](NC(N)=O)C(=O)NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C41399606_decoy,TRY1,Decoy,0,-8.79726,-6.14,-1.49,-6.104358696493718
C[C@@H](NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1ccc(S(N)(=O)=O)cc1,C39933367_decoy,TRY1,Decoy,0,-9.21884,-7.67,-2.33,-5.9900823337152005
Cc1ccc(N2C(N3CCCC3)=[NH+]N[C@H]2SCC(=O)N[C@@H]2O[C@@H](C)C3=C2C(=O)NN[C@H]3C)cc1,C39935186_decoy,TRY1,Decoy,0,-8.28437,-6.61,-0.75,-5.5732760103719645
Nc1nc(SCC(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2ccc(Cl)cc2Cl)n[nH]1,C63234347_decoy,TRY1,Decoy,0,-9.15449,-8.2,-0.87,-7.791528227910875
NC(=O)C1=C2CCC[C@@H]2S[C@H]1NC(=O)C(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63272278_decoy,TRY1,Decoy,0,-7.91663,-7.47,-3.52,-6.752663036076761
Cc1cccc(N2C(C3=c4ccccc4=[NH+]C3)=NN[C@@H]2S[C@@H](C(=O)NC(N)=O)C(C)C)c1,C64055487_decoy,TRY1,Decoy,0,-8.13914,-8.86,-1.61,-9.384007387755371
O[C@H](CNc1cccc[nH+]1)COc1ccc(OC[C@H](O)CNc2cccc[nH+]2)cc1,C03169686_decoy,TRY1,Decoy,0,-9.52876,-6.55,-2.8,-7.366228407713838
O=c1nc2n(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c3ccc(Cl)cc3nc-2c(=O)[nH]1,C04430761_decoy,TRY1,Decoy,0,-8.5419,-7.15,-1.14,-8.767209805887852
O=C(/C=C/c1ccc(O)cc1)c1ccc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C04557382_decoy,TRY1,Decoy,0,-8.31746,-8.29,-2.23,-7.776319343219254
O[C@@H](CNc1cccc[nH+]1)COc1ccc(OC[C@@H](O)CNc2cccc[nH+]2)cc1,C00848888_decoy,TRY1,Decoy,0,-9.62081,-6.76,-2.26,-7.468430053453392
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C10004241_decoy,TRY1,Decoy,0,-7.87811,-8.18,-0.96,-7.948959348219665
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]CC2(O)CCCCC2)c1,C15066573_decoy,TRY1,Decoy,0,-8.77621,-5.74,-2.48,-7.782967413891088
O=c1[nH]c(NC[C@H](O)[C@H](O)[C@H](O)CO)c(CCCCC[P@@](=O)([O-])O)c(=O)[nH]1,C24496223_decoy,TRY1,Decoy,0,-7.07778,-5.91,-1.17,-7.210603898764768
Nc1nc(N[C@@H](O)C(Cl)(Cl)Cl)nc(N[C@@H](O)C(Cl)(Cl)Cl)n1,C25666830_decoy,TRY1,Decoy,0,-8.71294,-6.34,-1.35,-7.883953157243105
Nc1nc(N[C@H](O)C(Cl)(Cl)Cl)nc(N[C@H](O)C(Cl)(Cl)Cl)n1,C25666846_decoy,TRY1,Decoy,0,-9.29245,-5.01,-0.55,-5.737290643385556
O=C(c1ccc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O)[C@H](O)Cc1ccc(O)cc1,C31156807_decoy,TRY1,Decoy,0,-7.34657,-7.72,-0.94,-5.828869150189885
COc1cc(CCc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)ccc1O,C31157245_decoy,TRY1,Decoy,0,-7.41415,-7.86,-3.94,-5.553840098884849
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O,C31168201_decoy,TRY1,Decoy,0,-8.07991,-6.6,-2.99,-5.366474547216092
O=c1[nH]c(NC[C@H](O)[C@@H](O)[C@H](O)CO)c(CCCCC[P@@](=O)([O-])O)c(=O)[nH]1,C31260606_decoy,TRY1,Decoy,0,-6.7855,-6.19,-2.69,-6.695602898235755
O=C(/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)c1ccc(O)cc1O,C33832004_decoy,TRY1,Decoy,0,-7.81503,-7.06,-1.47,-5.38333777540266
Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35024748_decoy,TRY1,Decoy,0,-7.45007,-8.28,-1.64,-9.142285308038792
Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35024750_decoy,TRY1,Decoy,0,-5.80158,-6.96,-1.69,-6.495023837613463
Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C35024752_decoy,TRY1,Decoy,0,-7.18281,-8.6,-1.43,-12.9213645297586
Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C35024755_decoy,TRY1,Decoy,0,-6.56315,-7.43,-2.5,-7.58940469062619
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@H]2O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)c2ccccc12,C35644614_decoy,TRY1,Decoy,0,-7.88621,-7.18,-4.04,-5.265855150601783
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645772_decoy,TRY1,Decoy,0,-4.32647,-8.08,-2.02,-5.697096206484066
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C08740487_decoy,TRY1,Decoy,0,-8.16071,-7.89,-0.48,-8.48177647676722
C/C(=C/Cc1c(O)ccc2cc(O)c(=O)oc12)CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C36378684_decoy,TRY1,Decoy,0,-7.60183,-6.87,-1.83,-5.651653160614139
N#C[C@@H](O[C@@H]1O[C@@H](CO[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O)c1ccccc1,C34934406_decoy,TRY1,Decoy,0,-4.85714,-5.92,-4.1,-4.031460394240618
Nc1nc2c(ncn2[C@@H]2O[C@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@@H](O)[C@H]2O)c(=O)[nH]1,C13549417_decoy,TRY1,Decoy,0,-6.64748,-8.67,-2.07,-8.323944067095733
NC1=NC(=O)[C@@H]2N=CN([C@H]3O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@H](O)[C@@H]3O)[C@H]2N1,C38337246_decoy,TRY1,Decoy,0,-6.70396,-8.54,-1.59,-8.295775263285798
NC1=NC(=O)[C@H]2N=CN([C@H]3O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@H](O)[C@@H]3O)[C@H]2N1,C38337247_decoy,TRY1,Decoy,0,-7.99299,-9.03,-2.3,-10.750440039452602
NC1=NC(=O)[C@@H]2N=CN([C@H]3O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@H](O)[C@@H]3O)[C@@H]2N1,C38337248_decoy,TRY1,Decoy,0,-6.52546,-5.87,-4.39,-5.391268925400794
NC1=NC(=O)[C@H]2N=CN([C@H]3O[C@@H](CO[P@@](=O)([O-])OP(O)(O)=S)[C@H](O)[C@@H]3O)[C@@H]2N1,C38337249_decoy,TRY1,Decoy,0,-7.69632,-8.53,-1.5,-9.87576726248376
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO[P@@](=O)([O-])OP(O)O)[C@@H](O)[C@H]1O,C38655487_decoy,TRY1,Decoy,0,-6.74507,-8.01,-2.1,-8.860334019228063
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO[P@@](=O)([O-])OP(O)O)[C@@H](O)[C@H]1O,C38655490_decoy,TRY1,Decoy,0,-7.16216,-8.5,-0.72,-8.44196820215957
Nc1ncnc2c1ncn2[C@H]1O[C@@H](CO[P@@](=O)([O-])OP(O)O)[C@@H](O)[C@@H]1O,C38655493_decoy,TRY1,Decoy,0,-6.73141,-6.34,-1.58,-8.387157959681259
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO[P@@](=O)([O-])OP(O)O)[C@@H](O)[C@@H]1O,C38655495_decoy,TRY1,Decoy,0,-6.62656,-7.86,-2.53,-8.202476374539389
O=c1[nH]c(NC[C@@H](O)[C@H](O)[C@H](O)CO)c(CCCCC[P@@](=O)([O-])O)c(=O)[nH]1,C38665488_decoy,TRY1,Decoy,0,-7.08633,-6.92,-2.19,-7.567952282006626
O=c1[nH]c(NC[C@@H](O)[C@@H](O)[C@H](O)CO)c(CCCCC[P@@](=O)([O-])O)c(=O)[nH]1,C38665490_decoy,TRY1,Decoy,0,-7.75962,-6.83,-3.61,-7.058926775052498
COc1cccc(/C=N/N[C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1O,C39774496_decoy,TRY1,Decoy,0,-8.06813,-9.06,-0.47,-13.1364319868328
CCCCCC(=O)[C@@](C)(c1nn2c(N)nnc2nc1[O-])[C@H]1Nn2c(N)nnc2NC1=O,C39944237_decoy,TRY1,Decoy,0,-7.70316,-7.98,-3.23,-8.964310595725387
CCCCCC(=O)[C@](C)(c1nn2c(N)nnc2nc1[O-])[C@H]1Nn2c(N)nnc2NC1=O,C39944238_decoy,TRY1,Decoy,0,-7.28722,-7.61,-2.53,-7.739207450467333
CCCCCC(=O)[C@@](C)(c1nn2c(N)nnc2nc1[O-])[C@@H]1Nn2c(N)nnc2NC1=O,C39944239_decoy,TRY1,Decoy,0,-7.48199,-8.3,-3.01,-9.86057243101556
CCCCCC(=O)[C@](C)(c1nn2c(N)nnc2nc1[O-])[C@@H]1Nn2c(N)nnc2NC1=O,C39944240_decoy,TRY1,Decoy,0,-8.19345,-8.49,-3.76,-9.949012696281306
COc1ccc(N/N=C(\[C@@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)cc1,C40151191_decoy,TRY1,Decoy,0,-9.21157,-7.21,-1.05,-7.381325093859982
O=C(N/N=C(\[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccccc1Cl,C40151219_decoy,TRY1,Decoy,0,-8.47079,-6.71,-3.46,-5.862253278636357
O=C(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)c1ccccc1Cl,C40151223_decoy,TRY1,Decoy,0,-8.24144,-5.93,-1.47,-6.244881557023271
NC(=O)c1c(Nc2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026365_decoy,TRY1,Decoy,0,-8.31009,-7.35,-2.2,-9.392576231394775
NC(=O)c1c(Nc2nc(NC[C@@H]3CCCO3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301772_decoy,TRY1,Decoy,0,-8.55533,-7.39,-1.24,-9.192516934559448
O=C(/C=C/c1ccc(O)cc1)c1ccc(O)cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C43759582_decoy,TRY1,Decoy,0,-7.32748,-8.41,-2.31,-7.206845520560448
C=CCOC(=O)N[C@H]1[C@@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C44699062_decoy,TRY1,Decoy,0,-6.12572,-6.5,-1.74,-5.178211690121074
CC1(C)CC(NC(=O)C(=O)NCCNC(=O)[C@@H]2C=c3ccccc3=[NH+]2)CC(C)(C)[NH2+]1,C63366946_decoy,TRY1,Decoy,0,-7.31521,-6.5,-2.58,-5.0673254820813005
C[C@@H]1CN(C[C@@H]2N[NH2+]NN2CC(=O)NCCC2=c3ccccc3=[NH+][C@@H]2C)C[C@H](C)O1,C64083733_decoy,TRY1,Decoy,0,-9.78107,-7.12,-3.78,-7.361270872462031
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](CO)O[C@H]1O,C65734153_decoy,TRY1,Decoy,0,-6.51124,-6.57,-2.93,-5.727559142171651
CCOC=C(C(=O)OC1CC(C)(C)[NH2+]C(C)(C)C1)C(=O)OC1CC(C)(C)[NH2+]C(C)(C)C1,C02532330_decoy,TRY1,Decoy,0,-9.22398,-6.62,-4.12,-7.640706490635663
CC[NH+](CC)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCCC[NH+](C)C,C06193004_decoy,TRY1,Decoy,0,-9.1215,-6.18,-2.59,-7.400790507459532
CC[NH+](CC)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C06193070_decoy,TRY1,Decoy,0,-9.66999,-5.06,-2.65,-6.2522345636192895
CC[NH+](CC)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C06193071_decoy,TRY1,Decoy,0,-8.44265,-4.91,-2.56,-5.8468707960417
CC[NH+](CC)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2cc(OC)ccc2[nH]c1=O,C06193074_decoy,TRY1,Decoy,0,-7.57845,-6.6,-2.63,-8.584925004612613
CC[NH+](CC)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C06193076_decoy,TRY1,Decoy,0,-9.2687,-6.79,-2.64,-7.4771018090696035
CC[NH+](CC)CCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCCC[NH+](C)C,C06193394_decoy,TRY1,Decoy,0,-9.36897,-6.25,-2.49,-7.328215630693312
Fc1ccc(N2CC[NH+](C[C@H]3C[NH+]4CC[C@H]3C[C@@H]4CNC(=S)NCc3ccco3)CC2)cc1,C08635652_decoy,TRY1,Decoy,0,-9.44799,-7.05,-2.7,-5.913927452762431
CC[NH+](CC)C[C@@H](O)COc1ccc(C[NH2+]CCSc2nnc(C)s2)cc1OC,C12052339_decoy,TRY1,Decoy,0,-7.57232,-5.81,-3.86,-6.5422917811596
CC[NH+](CC)C[C@H](O)COc1ccc(C[NH2+]CCSc2nnc(C)s2)cc1OC,C12052342_decoy,TRY1,Decoy,0,-8.87408,-5.78,-3.52,-5.806897084130823
COc1cc(C[NH2+]CCCn2ccnc2C)ccc1OC[C@H](O)C[NH+](C)C1CCCCC1,C12315856_decoy,TRY1,Decoy,0,-9.31527,-6.53,-4.61,-6.21381609195956
COc1ccc(C[NH2+]Cc2cc(C)n(C)n2)c(OC[C@H](O)C[NH+]2CCCCCCC2)c1,C12586991_decoy,TRY1,Decoy,0,-8.00063,-6.83,-3.15,-7.083881119359059
CC[NH+](CC)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2cc(C)c(C)cc2[nH]c1=O,C06193072_decoy,TRY1,Decoy,0,-7.32095,-5.07,-3.44,-6.301079624395044
CC[NH+](Cc1ccncc1)Cc1cc(OC)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1,C12320859_decoy,TRY1,Decoy,0,-8.32772,-7.42,-4.69,-7.457723722086178
CC[NH+](CC)CCC[C@@H](C)n1cnc2c(Nc3ccc(O)c(C[NH+](CC)CC)c3)ncnc21,C17421845_decoy,TRY1,Decoy,0,-9.28275,-5.4,-3.23,-6.670913421974877
C=C(C)C[NH+]1CCN(C[C@H](O)COc2ccc(OC[C@@H](O)CN3CC[NH+](CC(=C)C)CC3)cc2)CC1,C19314417_decoy,TRY1,Decoy,0,-9.93922,-6.4,-1.74,-7.345925634797948
COc1ccc(C[NH2+]Cc2cc(F)ccc2C)c(OC[C@H](O)CN2CC[NH+](C)CC2)c1,C19740140_decoy,TRY1,Decoy,0,-8.44855,-6.45,-1.77,-7.638584545456228
C=CCC(O)(CC=C)C[NH2+]Cc1ccc(OC)c(OC[C@H](O)CN2CC[NH+](C)CC2)c1,C20166933_decoy,TRY1,Decoy,0,-8.01762,-6.11,-4.02,-6.86762144230339
C[NH+]1CCN([C@@H]2[C@H](O)[C@H](CO)O[C@@H]2C[NH+](Cc2ccc(F)cc2)Cc2ccc(F)cc2)CC1,C20464692_decoy,TRY1,Decoy,0,-8.35467,-7.35,-1.15,-8.004580570304869
COCCNC(=S)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2CN1CCN(c2cccc[nH+]2)CC1,C20503910_decoy,TRY1,Decoy,0,-9.23229,-5.14,-1.65,-5.430251230551375
CC[NH+]1CCC[C@@H]1CN(Cc1cccc(OC)c1OC)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21264259_decoy,TRY1,Decoy,0,-8.85601,-4.88,-1.12,-5.726497851000021
COc1cc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NCCCn2cc[nH+]c2C)cc(OC)c1,C23337876_decoy,TRY1,Decoy,0,-7.73411,-7.2,-2.55,-6.9374399132098326
COc1cc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NCCCn2cc[nH+]c2C)cc(OC)c1,C23337878_decoy,TRY1,Decoy,0,-8.29414,-6.33,-1.98,-6.023489286931203
CCC[NH+](CC(=O)Nc1ccccc1C)Cc1cc(O)oc2cc(=[NH+]C(=O)OCC)ccc1-2,C31002711_decoy,TRY1,Decoy,0,-7.93564,-6.6,-2.46,-6.882211853458212
CCCC[NH+](C)CCNC(=S)Nc1ccc2nc(N3CC[NH+](CC)CC3)cc(C)c2c1,C12474034_decoy,TRY1,Decoy,0,-8.01002,-5.77,-1.62,-5.151266448718763
O=C(CCCCC(=O)N/N=C/C1=c2ccccc2=[NH+]C1)N/N=C/C1=c2ccccc2=[NH+]C1,C38626891_decoy,TRY1,Decoy,0,-9.29961,-8.89,-1.71,-10.124980114327228
COc1cc(C[NH2+]C[C@@H]2N=NC3=C2CCC3)ccc1OC[C@H](O)C[NH+]1CCSCC1,C39518974_decoy,TRY1,Decoy,0,-9.91259,-6.52,-2.56,-6.122725848307891
COc1ccc(C[NH2+]Cc2cc(F)ccc2F)cc1OC[C@@H](O)CN1CC[NH+](C)CC1,C23373581_decoy,TRY1,Decoy,0,-9.68135,-7.71,-3.59,-7.19182785600738
COc1ccc(C[NH2+]Cc2cc(F)ccc2F)cc1OC[C@H](O)CN1CC[NH+](C)CC1,C23373583_decoy,TRY1,Decoy,0,-8.96089,-7.56,-3.03,-7.368032511498705
CC[C@@H](C)CC(=O)N1C[C@H](C(=O)NC[C@@H](c2cccnc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39595119_decoy,TRY1,Decoy,0,-9.57288,-7.87,-3.24,-8.769468201518153
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)NCCC[NH+](C)C)C4(CC[NH2+]CC4)C3)cccc12,C39627651_decoy,TRY1,Decoy,0,-8.21567,-7.57,-3.38,-6.1854321347617445
COc1cc(C(=O)N2C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39630738_decoy,TRY1,Decoy,0,-8.48033,-7.1,-3.52,-5.995981423148583
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)C(C)C,C39634871_decoy,TRY1,Decoy,0,-9.5418,-5.26,-1.9,-5.672972543742308
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)C2(CC[NH2+]CC2)C1,C39674812_decoy,TRY1,Decoy,0,-9.2356,-7.57,-2.6,-8.170193306107263
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678978_decoy,TRY1,Decoy,0,-7.98505,-6.72,-2.54,-8.62897379590145
C[NH+](C)CCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39679076_decoy,TRY1,Decoy,0,-9.52447,-5.63,-3.8,-5.985985860272328
COCCNC(=S)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,C43527192_decoy,TRY1,Decoy,0,-8.6292,-5.36,-2.64,-5.500562000098001
CCC(CC)[C@@H](CNc1ccc(S(=O)(=O)NCC[NH+](C)C)cc1[N+](=O)[O-])[NH+]1CCCC1,C59384788_decoy,TRY1,Decoy,0,-7.31688,-5.06,-2.87,-4.941429571084446
CCC(CC)[C@H](CNc1ccc(S(=O)(=O)NCC[NH+](C)C)cc1[N+](=O)[O-])[NH+]1CCCC1,C59384790_decoy,TRY1,Decoy,0,-7.59886,-5.37,-3.86,-5.557666612224311
CCCC[NH+](CC)CCCNC(=S)Nc1ccc2nc(N3CC[NH+](CC)CC3)cc(C)c2c1,C15961445_decoy,TRY1,Decoy,0,-9.45829,-6.65,-2.35,-6.294878249255066
COc1cccc([C@@H](C[NH2+]C[C@H](O)COc2ccccc2F)C2=c3ccccc3=[NH+]C2)c1OC,C63234357_decoy,TRY1,Decoy,0,-7.6317,-8.29,-2.52,-7.739093268038301
CCOC(=O)[C@@H]1N=NN(c2nonc2N)[C@@H]1CS[C@H]1[NH+]=c2ccc(OCC)cc2=[NH+]1,C63427051_decoy,TRY1,Decoy,0,-7.59212,-7.25,-1.97,-6.247212038268501
CCOC(=O)[C@@H]1N=NN(c2nonc2N)[C@H]1CS[C@H]1[NH+]=c2ccc(OCC)cc2=[NH+]1,C63427053_decoy,TRY1,Decoy,0,-8.82721,-7.16,-2.83,-8.270026796855728
CCOC(=O)[C@@H]1N=NN(c2nonc2N)[C@H]1CS[C@@H]1[NH+]=c2ccc(OCC)cc2=[NH+]1,C63427054_decoy,TRY1,Decoy,0,-8.40873,-7.76,-4.5,-7.307758191473758
O=C(CC[C@H]1Nc2ccc[nH+]c2N1Cc1cccs1)NCCC1=c2ccccc2=[NH+]C1,C63490350_decoy,TRY1,Decoy,0,-8.85296,-8.54,-2.19,-7.8772188679840704
C=C(C)CC[C@H](C)Nc1c[nH+]c2c(c1)[C@@H](NC(=O)CCOC)[C@@H](C(=O)OC)N2CCC1=c2ccccc2=[NH+]C1,C63980452_decoy,TRY1,Decoy,0,-8.57717,-6.81,-3.5,-8.286977232459321
CC[C@@H](C)CNc1c[nH+]c2c(c1)[C@@H](NC(=O)COC)[C@@H](C(=O)OC)N2CCC1=c2ccccc2=[NH+]C1,C63985768_decoy,TRY1,Decoy,0,-8.21727,-6.89,-3.46,-7.168635052498724
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(NC3CCOCC3)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63994207_decoy,TRY1,Decoy,0,-9.04821,-7.58,-2.21,-8.886653512861654
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(NC(C)C)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C64002133_decoy,TRY1,Decoy,0,-7.93036,-7.0,-2.25,-9.549501648589828
CCOc1ccc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NCCC2=c3ccccc3=[NH+]C2)cc1,C64640319_decoy,TRY1,Decoy,0,-8.82382,-8.31,-2.49,-7.372882196214362
CC(C)[NH+]1CCc2c(sc(NC(=O)c3ccc(Cl)cc3Cl)c2C(N)=O)C1,C04087076_decoy,TRY1,Decoy,0,-8.99957,-6.16,-1.23,-5.884034408634393
Oc1cccc([C@@H](Nc2cccc[nH+]2)c2ccc3cccnc3c2O)c1Cl,C02502843_decoy,TRY1,Decoy,0,-8.85469,-7.53,-1.2,-7.272517046314704
CCSc1ccccc1C(=O)Nc1sc2c(c1C(N)=O)CC[NH+](C)C2,C05240772_decoy,TRY1,Decoy,0,-8.72323,-5.06,-1.0,-5.276520997554452
COc1cc([C@H]2[NH2+][C@@H](c3ccc(O)c(OC)c3)[C@H](C)C(=O)[C@H]2C)ccc1O,C05723504_decoy,TRY1,Decoy,0,-8.8916,-5.0,-2.34,-5.188879672426037
Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1,C09052383_decoy,TRY1,Decoy,0,-7.4607,-7.63,-1.12,-6.954201534931993
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1,C09052385_decoy,TRY1,Decoy,0,-6.27481,-8.09,-1.37,-5.469794453683786
CCOc1ccc(C[NH2+]CCc2ccc(S(N)(=O)=O)cc2)cc1Cl,C10475137_decoy,TRY1,Decoy,0,-7.88342,-6.97,-3.66,-5.51772133151476
c1ccc(-c2ccc(-c3n[nH]cc3C[NH2+]Cc3n[nH]c4c3CCC4)cc2)cc1,C11933955_decoy,TRY1,Decoy,0,-8.39365,-5.91,-1.7,-5.339632778930177
C[C@H](O)C[NH2+]Cc1cc(Br)ccc1OCC(=O)NC(C)(C)C,C20873190_decoy,TRY1,Decoy,0,-8.23971,-5.83,-3.23,-8.530228918368396
NS(=O)(=O)c1ccc(C[NH2+]Cc2cc(Br)ccc2F)cc1,C21019986_decoy,TRY1,Decoy,0,-9.60667,-6.23,-2.04,-6.188768505153584
[NH3+]Cc1cc(=O)[nH]c(-c2ccccc2CN2CCC[C@@H](c3ccccc3)C2)n1,C23250351_decoy,TRY1,Decoy,0,-8.38664,-8.52,-1.49,-9.52410994994991
CC(C)NC(=O)c1ccccc1NC(=O)C[NH2+][C@@H](c1cccs1)C(C)C,C25928142_decoy,TRY1,Decoy,0,-6.99569,-6.28,-1.26,-6.679573521075481
[NH3+]C1(CNS(=O)(=O)c2ccc(F)cc2Br)CCCCCC1,C37574226_decoy,TRY1,Decoy,0,-7.9111,-5.84,-1.66,-5.07822628923111
COc1c(Br)cc(C[NH2+]CCCC(N)=O)cc1Br,C37659483_decoy,TRY1,Decoy,0,-8.68526,-4.38,-1.92,-4.967569094690464
NC(=O)[C@H]([NH2+]Cc1cccs1)c1cc(Br)c2c(c1)OCO2,C37946610_decoy,TRY1,Decoy,0,-8.36059,-5.32,-0.76,-5.2350055349416
N[C@H]1NN=C(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2c2ccccc2)S1,C39067832_decoy,TRY1,Decoy,0,-9.66979,-7.81,-1.27,-8.596615957725469
CCc1ccc([C@@H](CNc2ccccc2O)[NH+]2CCN[C@H](SC)C2)cc1,C39532181_decoy,TRY1,Decoy,0,-7.14467,-6.64,-3.89,-6.21686621776882
CCCc1ccc([C@H](CNc2ccccc2O)[NH+]2CCN[C@H](OC)C2)cc1,C39532700_decoy,TRY1,Decoy,0,-7.92935,-6.45,-2.4,-7.414809846852136
CC(C)Cc1ccc([C@H](C[NH2+]Cc2ccccc2)N2CC[NH2+][C@H]([O-])C2)cc1,C39533405_decoy,TRY1,Decoy,0,-6.467,-5.29,-0.93,-4.843111939707159
CCOc1c(Br)cc(Cl)cc1NC(=O)[C@@H]([NH3+])CCSC,C40462940_decoy,TRY1,Decoy,0,-9.29884,-4.94,-1.59,-5.714872234945823
C[NH+](CC(=O)Nc1cc(F)ccc1N)Cc1cc(Br)cs1,C42398130_decoy,TRY1,Decoy,0,-8.55426,-6.49,-0.92,-7.164180689239766
COC(=O)[C@@H]([NH3+])Cc1c(C)c(Br)c(C)c(Br)c1O,C44335440_decoy,TRY1,Decoy,0,-9.46308,-4.73,-0.76,-4.703130974299159
C[C@@H]([NH3+])[C@H](Sc1ncnc2nc[nH]c12)c1ccc(Br)s1,C51036255_decoy,TRY1,Decoy,0,-8.63697,-5.89,-1.87,-7.146952249866814
Cc1ccccc1C(=O)NNC(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C,C54045799_decoy,TRY1,Decoy,0,-6.5713,-6.28,-1.97,-5.389835848883137
Cc1cc(O[C@@H](C)C(=O)N/N=C2\[NH+]=C(N)c3ccccc32)cc(C)c1Cl,C16269391_decoy,TRY1,Decoy,0,-9.04215,-7.28,-1.99,-6.556921835236272
O=C(CNC(=O)NCC[NH+]1CCc2sccc2C1)Nc1ccc(F)cc1,C58209008_decoy,TRY1,Decoy,0,-9.88516,-7.44,-3.93,-6.886901101480441
C[C@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)[NH+]1CCC[C@H](O)C1,C58226496_decoy,TRY1,Decoy,0,-7.96253,-6.99,-1.49,-6.163776497048777
CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cc1,C58878861_decoy,TRY1,Decoy,0,-8.07399,-5.88,-4.37,-5.720824856321648
CC[C@@H]([NH3+])[C@@H](Sc1n[nH]c(=O)n1CC)c1cc(Br)cs1,C61594299_decoy,TRY1,Decoy,0,-9.92642,-4.02,-0.6,-5.880408238570212
C[C@H]([NH3+])[C@@H](Sc1n[nH]c(=O)n1C1CC1)c1ccc(Br)cc1,C61594646_decoy,TRY1,Decoy,0,-8.08143,-5.67,-1.11,-4.648922103584391
CCCn1c(S[C@H](c2cc(Br)cs2)[C@@H](C)[NH3+])n[nH]c1=O,C61594832_decoy,TRY1,Decoy,0,-7.39941,-5.5,-1.13,-8.478540871676758
CCCn1c(S[C@@H](c2cccc(Br)c2)[C@@H](C)[NH3+])n[nH]c1=O,C61594903_decoy,TRY1,Decoy,0,-8.56026,-4.25,-3.96,-4.96581511344516
CCCn1c(S[C@H](c2ccccc2Br)[C@H](C)[NH3+])n[nH]c1=O,C61594920_decoy,TRY1,Decoy,0,-7.27515,-4.92,-1.14,-6.35063775310343
CC(C)(C[NH3+])NS(=O)(=O)c1cc(Br)ccc1Br,C63020562_decoy,TRY1,Decoy,0,-6.91052,-5.06,-1.02,-4.701931109143031
Cc1cc(S(N)(=O)=O)sc1C(=O)NCCC[NH+]1C[C@H](C)C[C@H](C)C1,C63863324_decoy,TRY1,Decoy,0,-10.2898,-5.6,-3.03,-6.59325424718494
O=C(NC[C@H]1CCCC[C@H]1O)C1(Oc2cccc3ncccc23)CC[NH2+]CC1,C65373552_decoy,TRY1,Decoy,0,-7.38852,-6.02,-0.78,-5.418420766482321
CCc1[nH]c(C)c([C@@H]2[C@H](c3ccccc3)NCN2[C@H](CO)c2ccccc2)[nH+]1,C65381204_decoy,TRY1,Decoy,0,-6.74085,-5.46,-1.76,-4.804519198443866
O[C@@H](C[NH2+]C[C@H](O)[C@H]1CCc2ccccc2O1)[C@@H]1CCc2ccccc2O1,C06117244_decoy,TRY1,Decoy,0,-6.6272,-7.99,-2.64,-7.449019714511871
NC(=O)CC[C@H]1CCC[NH+](Cn2nc(-c3ccc(Cl)cc3)[nH]c2=S)C1,C66080543_decoy,TRY1,Decoy,0,-8.8501,-5.6,-2.81,-5.647390387863888
[NH2+]=C(NCC1(c2ccc(Br)cc2)CCOCC1)NC1CCCC1,C66246679_decoy,TRY1,Decoy,0,-8.85468,-6.2,-1.59,-5.439641522347597
CCNC(=O)NC(=O)[C@H](C)[NH2+]CC1(c2cccc(Cl)c2)CCOCC1,C66389404_decoy,TRY1,Decoy,0,-10.3319,-6.57,-1.5,-8.9971848958856
CC(=O)Nc1cc(NC(=O)NCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(F)cc1F,C66981458_decoy,TRY1,Decoy,0,-8.93572,-6.52,-4.05,-5.81703352601541
O[C@H](C[NH2+]Cc1cc[nH]n1)COc1ccc(I)cc1,C66992919_decoy,TRY1,Decoy,0,-7.12637,-6.86,-0.82,-8.864960288053762
Cc1ccsc1C(=O)NNC(=O)NC[C@H](C)[NH+]1CCc2ccccc2C1,C67042000_decoy,TRY1,Decoy,0,-7.94408,-7.5,-0.95,-6.214620589222879
CC(C)C[NH+]1CCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C49969226_decoy,TRY1,Decoy,0,-10.3755,-6.2,-4.26,-7.045964821426761
CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67400633_decoy,TRY1,Decoy,0,-7.85619,-6.3,-1.74,-5.831243232208666
CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67400635_decoy,TRY1,Decoy,0,-8.6487,-6.41,-2.32,-6.313368301098238
C=CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67401175_decoy,TRY1,Decoy,0,-8.3392,-7.27,-3.39,-5.949192327632569
Nc1nc(C[NH+]2CCC([C@H](O)c3ccc(Cl)cc3)CC2)nc2ccccc12,C67401203_decoy,TRY1,Decoy,0,-8.96199,-8.55,-1.49,-9.462985411628791
Cc1ccsc1C(=O)NNC(=O)NC[C@@H]1CCC[NH+]1CC1CCCCC1,C67479368_decoy,TRY1,Decoy,0,-9.05787,-7.41,-1.18,-7.090796312485887
CC[NH+](CC)CCC[C@@H](C)Nc1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O,C05460270_decoy,TRY1,Decoy,0,-8.76427,-5.95,-2.18,-5.597473533694903
O=[N+]([O-])c1ccc([C@H](Nc2[nH+]cccc2O)c2ccc3cccnc3c2O)cc1,C05813806_decoy,TRY1,Decoy,0,-7.71234,-7.93,-0.76,-7.801687684270212
C[C@H]([NH2+][C@H](C)c1ccccc1Cl)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C08213975_decoy,TRY1,Decoy,0,-10.2169,-8.59,-2.55,-6.772654428934884
CC1(C)CC(NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CC(C)(C)[NH2+]1,C11422822_decoy,TRY1,Decoy,0,-8.65824,-8.12,-0.7,-7.48212340110826
CC1(C)CC(NC[C@@H](O)COC(c2ccccc2)c2ccccc2)CC(C)(C)[NH2+]1,C25329366_decoy,TRY1,Decoy,0,-8.1484,-7.45,-2.01,-7.617000357464313
CCCc1ccc([C@H]([NH2+]CC(=O)NN2C(=O)N[C@@](C)(CC)C2=O)C(C)C)cc1,C28731452_decoy,TRY1,Decoy,0,-7.44766,-6.79,-1.14,-5.992855455996386
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+](C)CCOc1ccccc1F,C28790591_decoy,TRY1,Decoy,0,-6.86241,-7.5,-3.7,-7.0098569798603005
CC(C)c1ccc(-c2nc(NCC[NH+]3CCCCC3)nc3nn(C)c(N)c23)cc1,C37376664_decoy,TRY1,Decoy,0,-9.49383,-7.12,-2.15,-7.897523009382185
CCC[C@](C)([NH3+])C(=O)Nc1cc(Cl)cc(Br)c1OC(F)F,C37622092_decoy,TRY1,Decoy,0,-7.65826,-4.74,-1.67,-5.120943900898694
C[C@H]([NH2+][C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc(Br)s1,C38002544_decoy,TRY1,Decoy,0,-9.34587,-5.28,-1.43,-5.724269975529116
C[C@@H]([NH2+][C@H](C)c1ccc(Br)s1)c1ccc(S(N)(=O)=O)cc1,C38002546_decoy,TRY1,Decoy,0,-9.872,-5.15,-2.44,-5.9207725669940325
Cc1ccc(N2N=C(CS[C@H]3N[NH2+]NN3c3ccccc3)CC2=O)cc1C,C39232117_decoy,TRY1,Decoy,0,-8.51455,-5.59,-1.37,-6.422458261909855
Oc1ccccc1[C@@H]1CN([C@@H](CNF)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531031_decoy,TRY1,Decoy,0,-8.34888,-7.55,-2.33,-5.693907569526907
CCc1ccc([C@@H](CNI)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39532122_decoy,TRY1,Decoy,0,-7.94825,-4.96,-2.22,-5.085041055342035
CCCc1ccc([C@H](CNBr)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39532663_decoy,TRY1,Decoy,0,-8.00664,-5.2,-1.72,-4.776621719766709
CSNC[C@@H](c1ccc(-c2ccccc2O)cc1)[NH+]1CCN[C@H](SC)C1,C39534013_decoy,TRY1,Decoy,0,-8.61275,-5.82,-1.82,-5.504064060496653
CCc1ccccc1Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1[N+](=O)[O-],C40587058_decoy,TRY1,Decoy,0,-7.97727,-7.08,-0.93,-7.257714811660419
CC1(C)CC(Nc2ncnc(NCCc3ccccc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40610226_decoy,TRY1,Decoy,0,-7.42419,-5.52,-3.02,-4.983880975965179
C[C@H](Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1[N+](=O)[O-])c1ccccc1,C40629080_decoy,TRY1,Decoy,0,-6.5903,-6.14,-5.03,-4.730534406050717
CC1(C)CC(Nc2ncnc(Nc3cccc(Cl)c3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645188_decoy,TRY1,Decoy,0,-8.08385,-5.6,-1.45,-5.637098720826512
CC1(C)CC(Nc2ncnc(Nc3ccc(F)cc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645195_decoy,TRY1,Decoy,0,-7.10722,-5.28,-0.15,-5.231000262009946
Cc1ccc(CNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2[N+](=O)[O-])cc1,C40645208_decoy,TRY1,Decoy,0,-7.23868,-7.54,-1.63,-7.101255625195571
CCN(c1cccc(C)c1)c1nc[nH+]c(Nc2cccc3ccc(C)nc23)c1N,C40661783_decoy,TRY1,Decoy,0,-7.72711,-6.77,-2.0,-5.249433958565412
CCN(c1cccc(C)c1)c1nc[nH+]c(Nc2cc(Cl)c(OC)cc2OC)c1N,C40661942_decoy,TRY1,Decoy,0,-9.29362,-4.92,-3.32,-6.047129866434351
CCN(c1ccccc1)c1nc[nH+]c(Nc2ccc(Br)cc2)c1N,C40679640_decoy,TRY1,Decoy,0,-8.78931,-5.36,-1.32,-5.240504050621927
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1ccc2c(c1)OCO2,C40685072_decoy,TRY1,Decoy,0,-8.38166,-6.35,-1.88,-6.152537067021892
Nc1c(N2CCc3ccccc32)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40687353_decoy,TRY1,Decoy,0,-7.9578,-6.88,-3.34,-6.795653565208334
CCN(c1[nH+]cnc(Nc2nc(C)c(C)s2)c1N)c1cccc2ccccc12,C40702020_decoy,TRY1,Decoy,0,-7.77251,-6.91,-1.55,-5.628388502144978
Cc1cccc(Nc2[nH+]cnc(N(Cc3ccccc3)c3ccccn3)c2N)c1C,C40755222_decoy,TRY1,Decoy,0,-8.21958,-7.35,-1.72,-8.032200567970152
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1ccccc1F,C40759292_decoy,TRY1,Decoy,0,-7.76762,-6.8,-1.59,-6.125419406114943
COC(=O)c1ccccc1N(C)c1nc[nH+]c(Nc2cc(F)ccc2F)c1N,C40800134_decoy,TRY1,Decoy,0,-7.86161,-5.7,-1.51,-7.18606316708502
COC(=O)c1ccccc1N(C)c1[nH+]cnc(Nc2cccnc2Cl)c1N,C40800854_decoy,TRY1,Decoy,0,-7.93418,-6.83,-2.14,-7.330364274749415
c1ccc2c(CCNc3nc(NC[C@@H]4CCCO4)c4ccccc4[nH+]3)c[nH]c2c1,C41151940_decoy,TRY1,Decoy,0,-8.8895,-6.97,-2.5,-8.224080105568698
C[NH+](CC(=O)Nc1cc(Cl)ccc1N)Cc1cc(Br)cs1,C42397978_decoy,TRY1,Decoy,0,-9.21592,-5.19,-1.68,-5.55713825579841
C#CCNC(=O)[C@@H]1CSC[C@@H](c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)[NH2+]1,C44169113_decoy,TRY1,Decoy,0,-8.55012,-5.3,-2.25,-5.81810452196167
CC(C)(C)c1cc([C@@H]2CSC[C@@H](C(=O)N[C@H]3CCCc4ccccc43)[NH2+]2)cc(C(C)(C)C)c1O,C44170002_decoy,TRY1,Decoy,0,-9.13417,-5.37,-2.5,-4.877428710537827
CC[C@@H]([NH3+])Cc1c(/C=C/c2cccc(OC)c2)oc2c1cc(O)c1ccccc12,C44402649_decoy,TRY1,Decoy,0,-9.19985,-6.2,-1.26,-6.280886764802005
Cn1c(Oc2cc(Cl)c(Cl)cc2Cl)c(C[C@H]([NH3+])CO)c2ccccc21,C44465181_decoy,TRY1,Decoy,0,-7.97551,-5.52,-1.88,-4.814948251464849
CC[NH+]1CCC[C@@H]1CNC(=S)NNc1c(Cl)cc(Cl)cc1Cl,C45521911_decoy,TRY1,Decoy,0,-9.04503,-5.48,-2.33,-5.383596173638448
CCCNC(=O)C[NH+](CCC)CC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C53366508_decoy,TRY1,Decoy,0,-9.33482,-6.26,-0.98,-6.157743552787767
FC(F)Oc1ccc(NC(=S)NNc2cc[nH+]c3cc(Cl)ccc23)cc1,C03320406_decoy,TRY1,Decoy,0,-8.70205,-5.73,-1.72,-6.010572189277789
CCC(=O)Nc1ccc(C)c(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)c1,C54412265_decoy,TRY1,Decoy,0,-7.61371,-6.45,-4.27,-5.617878876804475
CCCCNC(=O)NC(=O)[C@@H](C)Nc1ccc(N2CC[NH+](CC)CC2)cc1C,C56170428_decoy,TRY1,Decoy,0,-8.97027,-7.6,-3.78,-8.077522996177148
CCN(CC)c1ccc(NC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c[nH+]1,C48172688_decoy,TRY1,Decoy,0,-8.67439,-6.27,-3.37,-6.116573629154914
CCNc1nc(Nc2ccc(NS(=O)(=O)c3ccc(C)c(C)c3)cc2)cc(C)[nH+]1,C64801713_decoy,TRY1,Decoy,0,-7.53583,-7.6,-2.71,-5.416534633218039
NS(=O)(=O)c1cc(NC2CC[NH+](CC3CCCCC3)CC2)cc([N+](=O)[O-])c1,C65946389_decoy,TRY1,Decoy,0,-8.07776,-5.77,-3.7,-4.645555312106455
CCCNC(=O)C[NH+]1CCC(NC(=O)N(CCC)Cc2ccccc2O)CC1,C66699806_decoy,TRY1,Decoy,0,-7.43281,-6.92,-2.42,-7.281531623530927
CCCC(=O)Nc1cccc(NC(=O)NCC(C)(C)[NH+]2CCC[C@@H](C)C2)c1C,C67585302_decoy,TRY1,Decoy,0,-7.66327,-6.81,-1.47,-5.280570476914381
CCCC(=O)Nc1cccc(NC(=O)N[C@@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)c1C,C67585330_decoy,TRY1,Decoy,0,-8.07516,-7.03,-3.11,-6.335762048072497
CCCC(=O)Nc1cccc(NC(=O)N[C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)c1C,C67585333_decoy,TRY1,Decoy,0,-8.05741,-6.2,-2.64,-5.37433042021077
[NH3+]CCCNc1cc(-c2ccccc2)nc2cc(-c3cccc(F)c3)nn12,C04980553_decoy,TRY1,Decoy,0,-9.63103,-7.59,-0.43,-8.281186518035982
C[C@H](NC(=O)C[NH+]1CCC(C(N)=O)CC1)c1ccc(Cl)cc1Cl,C07435429_decoy,TRY1,Decoy,0,-9.0543,-5.91,-1.33,-5.797133554687075
CC(C)[C@@H]([NH2+]CC(=O)NC(=O)Nc1ccccc1F)c1ccc(F)cc1,C08003998_decoy,TRY1,Decoy,0,-7.52467,-7.68,-2.63,-6.70371035661335
C[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)C(=O)NC(=O)NC(C)(C)C,C08531739_decoy,TRY1,Decoy,0,-7.79336,-6.77,-1.52,-5.682942417533894
C[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)cc1)c1ccccc1Br,C21798129_decoy,TRY1,Decoy,0,-7.24115,-6.71,-4.27,-4.819516235414144
C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)NC(=O)NCc1cccs1,C25242351_decoy,TRY1,Decoy,0,-8.94795,-7.66,-2.61,-6.252552863059988
C[C@@H](NC(=O)/C=C/c1ccccc1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C32753473_decoy,TRY1,Decoy,0,-7.4318,-6.96,-1.75,-6.706091817732766
CCOc1c(Br)cc(Cl)cc1NC(=O)[C@@](C)([NH3+])C1CC1,C37615096_decoy,TRY1,Decoy,0,-7.63244,-5.2,-2.05,-5.328827553695413
CCC[C@@](C)([NH3+])C(=O)Nc1cc(Cl)cc(Br)c1OCC,C37622089_decoy,TRY1,Decoy,0,-8.7176,-5.22,-2.6,-5.777533264532832
CCC[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(Br)cc1CC[NH3+],C37720888_decoy,TRY1,Decoy,0,-9.47407,-6.11,-3.16,-6.5062678831197305
CC[C@H]([NH3+])Cc1cc(Br)ccc1OCC(=O)NCC(C)C,C37725420_decoy,TRY1,Decoy,0,-8.40448,-4.66,-3.58,-5.430782781433235
CC(C)(Cc1c[nH]c2ccccc12)[NH2+]C[C@@H](O)COc1ccccc1C#N,C01842330_decoy,TRY1,Decoy,0,-7.0855,-5.63,-1.66,-4.933289744039572
CC[C@@H](C)NC(=O)CC[NH2+][C@H](CC)c1cc(Br)ccc1O,C38013759_decoy,TRY1,Decoy,0,-8.26256,-6.18,-2.31,-5.538337240504983
[NH3+][C@@H](Cc1c[nH]c2ccccc12)[C@@H]1N=N[C@@H](SCc2cccc(F)c2)O1,C38661436_decoy,TRY1,Decoy,0,-9.21464,-6.75,-2.17,-6.16049012133754
CC(C)Cc1ccc([C@@H](CNBr)N2CC[NH2+][C@H](O)C2)cc1,C39533418_decoy,TRY1,Decoy,0,-8.48018,-5.76,-1.06,-6.330932558113206
CCN(c1[nH+]cnc(NC[C@H]2CCCO2)c1N)c1cccc2ccccc12,C40686830_decoy,TRY1,Decoy,0,-7.54328,-5.75,-1.64,-4.878118935532822
CC(C)C[NH+](CCOc1ccc(Br)cc1)CC/C(N)=N/O,C43418886_decoy,TRY1,Decoy,0,-7.841,-4.18,-3.55,-5.044943593361027
COc1cccc(/C=C/c2oc3c(cc(O)c4ccccc43)c2CC[NH3+])c1,C44397277_decoy,TRY1,Decoy,0,-8.49733,-5.91,-1.81,-6.567106170287389
NC(=O)Cc1ccccc1NC(=O)N1CC[NH+](C/C=C/c2ccccc2)CC1,C45725663_decoy,TRY1,Decoy,0,-7.12361,-6.13,-2.62,-6.004522500962806
CC[C@@H](CO)NC(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C47600600_decoy,TRY1,Decoy,0,-8.47693,-6.26,-1.64,-6.260366839647779
CC[C@H](CO)NC(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C47600602_decoy,TRY1,Decoy,0,-8.38199,-5.54,-3.56,-6.0088306153630295
CC[C@H](CO)NC(=O)NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C47600606_decoy,TRY1,Decoy,0,-8.52951,-6.2,-4.02,-6.102368129718435
CCC[C@@H](C)NC(=O)[C@H](C)Oc1c(Br)cccc1CC[NH3+],C48797939_decoy,TRY1,Decoy,0,-7.9443,-5.9,-1.6,-7.684896573533441
CCCCNC(=O)[C@@H](C)Oc1c(Br)cccc1C[C@H](C)[NH3+],C48798117_decoy,TRY1,Decoy,0,-8.94772,-5.24,-4.09,-7.281271787897443
CNC(=O)c1cc(NC(=O)NCC(C)(C)[NH+]2CCC[C@H](C)C2)ccc1F,C50084317_decoy,TRY1,Decoy,0,-8.51452,-5.08,-2.03,-5.48208274184099
CCCCNC(=O)[C@H]1CCC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)C1,C50901699_decoy,TRY1,Decoy,0,-7.7538,-6.37,-3.99,-5.785393378829117
O=C(NC[C@@H](O)c1ccc(F)c(F)c1)Nc1cccc(-c2c[nH+]co2)c1,C52470586_decoy,TRY1,Decoy,0,-8.75482,-6.34,-2.07,-5.925325415390403
Cc1ccc(OC[C@H](O)C[NH2+]C2(CO)CCCC2)c(Br)c1,C53069380_decoy,TRY1,Decoy,0,-7.59973,-5.67,-2.22,-6.76819276863108
COc1cc(C[NH2+][C@]2(CO)CCC[C@H](C)C2)cc(Br)c1O,C53115876_decoy,TRY1,Decoy,0,-9.30755,-5.18,-2.29,-5.487173500825274
COc1cc(C[NH2+][C@@]2(CO)CCC[C@H](C)C2)cc(Br)c1O,C53115884_decoy,TRY1,Decoy,0,-7.84822,-4.97,-2.65,-5.250773622918309
NC(=O)[C@H]1CCCN(c2ccc(C[NH2+]Cc3ccc(F)c(F)c3)cc2)C1,C54179063_decoy,TRY1,Decoy,0,-7.7979,-7.02,-0.84,-5.314041475403947
CNC(=O)c1ccc(NC(=O)NCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl,C56694017_decoy,TRY1,Decoy,0,-8.43665,-6.28,-3.06,-5.745827111614513
CC(=O)Nc1ccc(NC(=O)C[NH2+][C@H](c2ccc(F)cc2)C(C)C)cc1,C08003759_decoy,TRY1,Decoy,0,-7.39971,-6.79,-2.98,-6.375686150014368
CC(C)[NH+](CCNC(=O)c1cc(N)c(F)cc1Br)C(C)C,C61079530_decoy,TRY1,Decoy,0,-8.01874,-5.25,-1.65,-6.375032954097205
CCCCNC(=O)[C@@H](C)Oc1ccc(C[C@@H](C)[NH3+])cc1Br,C62704377_decoy,TRY1,Decoy,0,-9.39998,-5.92,-3.25,-12.244128952821516
C=CCNC(=S)NNC1=NC(=O)[C@@H]2C(=[NH+]1)c1ccccc1CC21CCCC1,C63393992_decoy,TRY1,Decoy,0,-8.69033,-7.36,-1.71,-6.815014784510225
CCOc1ccc2c(c1)S[C@@H](NC(=O)NC[C@H]1C=c3ccccc3=[NH+]1)N2,C63956395_decoy,TRY1,Decoy,0,-8.5181,-7.68,-1.08,-6.3501206203849945
C[C@@H](Nc1nc(CC[NH3+])nc2ccccc12)c1ccccc1C(F)(F)F,C65408498_decoy,TRY1,Decoy,0,-8.44851,-7.13,-3.75,-10.424136752828415
Cc1ccc(NC2(C(=O)N[C@@H]3C[C@@H](CO)[NH+](C)C3)CCCCC2)cc1C,C65494044_decoy,TRY1,Decoy,0,-8.81685,-6.52,-2.42,-6.257970039435301
CC[C@H](C)[NH+](C)CCNC(=O)NNc1ccc(F)cc1Br,C66195666_decoy,TRY1,Decoy,0,-8.02759,-4.48,-2.44,-4.703358746098101
Cc1sc(CN/C(N)=[NH+]/Cc2ccco2)nc1-c1ccc(Cl)cc1,C66244824_decoy,TRY1,Decoy,0,-8.43321,-6.77,-1.8,-5.878596442330637
NC(=O)C[NH+]1CCC[C@@H](NC(=O)c2ccc(SC(F)(F)F)cc2)C1,C66451166_decoy,TRY1,Decoy,0,-7.04873,-6.22,-2.71,-5.98016885088405
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)NNC(=O)Cc2ccccc2F)C1,C66925400_decoy,TRY1,Decoy,0,-7.40658,-6.94,-4.03,-5.709915132879805
NC(=O)[C@@H]([NH2+]Cc1ccccc1OCC(F)(F)F)c1ccc(F)cc1,C66939983_decoy,TRY1,Decoy,0,-6.97038,-6.68,-2.25,-8.03036204245118
CCC[NH+]1Cc2cccc(N[C@@H](C)C(=O)NC(=O)NC3CCCC3)c2C1,C66968471_decoy,TRY1,Decoy,0,-10.1045,-5.74,-1.53,-6.36529846874431
O[C@@H](C[NH2+]Cc1c[nH]nc1-c1ccc(F)cc1)COc1ccc(F)cc1,C67252392_decoy,TRY1,Decoy,0,-7.17532,-6.17,-1.38,-6.314131896779117
Cc1ccsc1C(=O)NNC(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C67382900_decoy,TRY1,Decoy,0,-8.66403,-4.69,-1.72,-6.67955215600814
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@H](C)c2ccc(Cl)s2)CC1,C67619875_decoy,TRY1,Decoy,0,-10.2334,-5.23,-0.64,-6.276023148693379
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@H](C)c2ccc(Cl)s2)CC1,C67619879_decoy,TRY1,Decoy,0,-10.2795,-5.53,-1.51,-6.727166030215695
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@H]2CCc3cc(Cl)ccc32)CC1,C67633703_decoy,TRY1,Decoy,0,-10.0212,-7.29,-0.97,-6.79066324800467
COc1ccc(C)cc1Nc1nc(N)nc(C[NH+]2CCN(c3ccc(F)cc3)CC2)n1,C03765394_decoy,TRY1,Decoy,0,-9.12388,-6.76,-1.5,-6.015778712915576
CCOC(=O)C1=C(C[NH2+]Cc2ccc(C)cc2)NC(=O)N[C@@H]1c1ccc2c(c1)OCO2,C08306782_decoy,TRY1,Decoy,0,-8.22814,-7.78,-3.31,-6.122410329539358
COc1ccccc1[C@@H]1[NH+]=C(NCCc2c[nH]c3ccccc23)Nc2nc(C)cc(=O)n21,C08991481_decoy,TRY1,Decoy,0,-7.95297,-6.03,-1.4,-5.019902167765275
COc1ccc(NC(=O)[C@@H]2C[C@H](CCSC)[NH2+][C@@]23C(=O)Nc2ccc(C)cc23)cc1,C08995772_decoy,TRY1,Decoy,0,-8.72165,-4.28,-1.1,-5.711896540575386
COc1ccc(NC(=O)[C@@H]2C[C@H](CCSC)[NH2+][C@]23C(=O)Nc2ccc(C)cc23)cc1,C08995773_decoy,TRY1,Decoy,0,-8.18667,-6.85,-2.29,-9.03183615742704
COc1ccc(NC(=O)[C@H]2C[C@H](CCSC)[NH2+][C@]23C(=O)Nc2ccc(C)cc23)cc1,C09129762_decoy,TRY1,Decoy,0,-6.88783,-5.01,-0.79,-4.843712898387968
O=C(C[NH2+][C@H](c1ccc(F)cc1)c1cccs1)NN1C(=O)NC2(CCCCC2)C1=O,C09364460_decoy,TRY1,Decoy,0,-10.0358,-7.67,-1.32,-6.462716560054992
Cc1c(Cl)cccc1Nc1nc(N)nc(CSC(=S)N2CC[NH+](C)CC2)n1,C09731188_decoy,TRY1,Decoy,0,-9.47551,-7.34,-1.38,-7.187469837805651
Cc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)n1,C09971233_decoy,TRY1,Decoy,0,-8.40908,-6.83,-1.39,-5.77811261808622
CCc1oc2ccccc2c1C[NH+](C)[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C10109397_decoy,TRY1,Decoy,0,-8.07547,-7.59,-2.31,-6.988530276624764
Cc1nc(NC2CC[NH+](CC(=O)Nc3ccccc3C(F)(F)F)CC2)[nH]c(=O)c1C,C12113674_decoy,TRY1,Decoy,0,-7.40651,-7.46,-2.55,-7.054344711023137
COc1ccc(NC(=O)[C@H]2C[C@H](CCSC)[NH2+][C@@]23C(=O)Nc2ccc(C)cc23)cc1,C15971862_decoy,TRY1,Decoy,0,-7.4545,-6.68,-1.43,-6.041306091065832
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)CC(=O)Nc2cccc(C)c2C)c(C)c1,C16636912_decoy,TRY1,Decoy,0,-6.55286,-7.36,-1.97,-5.869054792174853
CCOc1ccccc1Nc1nc(N)nc(CN2CC[NH+](/C=C/c3ccccc3)CC2)n1,C20028226_decoy,TRY1,Decoy,0,-7.59673,-7.74,-0.41,-6.266120569827398
CCc1cccc(CC)c1NC(=O)c1cc(C(=O)c2cc(Cl)ccc2O)coc1=[NH2+],C09443492_decoy,TRY1,Decoy,0,-8.17087,-6.84,-3.49,-5.71835977179972
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4ccc(Cl)cc4)CC3)n2)cc1,C23297202_decoy,TRY1,Decoy,0,-7.74072,-5.95,-2.22,-4.847860328759646
O=C(CNC(=O)CNC(=O)c1ccc(Cl)cc1Cl)NC[C@H](c1cccs1)[NH+]1CCCC1,C27607501_decoy,TRY1,Decoy,0,-8.30117,-7.42,-1.6,-6.8226639710392485
CC[NH+](CC)CCNC(=O)c1cc(NC(=O)Nc2cccc(C)c2C)ccc1N(C)C,C35210324_decoy,TRY1,Decoy,0,-8.70842,-7.17,-3.9,-7.125188963261439
Nc1c2c(-c3cccc(F)c3F)nc(NCc3ccccn3)nc2[nH+]n1Cc1ccccc1,C35578351_decoy,TRY1,Decoy,0,-8.40252,-6.44,-0.24,-6.004413644158513
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3-c3ccco3)cc12,C35969548_decoy,TRY1,Decoy,0,-9.16159,-7.81,-0.83,-8.694934542070872
CC[NH+](CC(=O)NC(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)CC(=O)Nc1c(F)cccc1F,C36390332_decoy,TRY1,Decoy,0,-8.28843,-6.27,-2.32,-6.048189576261965
NC(=O)c1c(NC(=O)CN2CC[NH+](C/C=C/c3ccccc3)CC2)sc2c1CCCC2,C21548697_decoy,TRY1,Decoy,0,-10.7356,-7.57,-3.28,-7.569792173149998
Nc1c2c(-c3cccc(F)c3F)nc(NCC[NH+]3CCCC3)nc2nn1-c1ccc(F)cc1,C37361451_decoy,TRY1,Decoy,0,-8.42655,-6.79,-0.18,-5.712497178390238
C[NH+](C)CCNC(=O)CCNC(=O)c1csc(Nc2cccc(Cl)c2Cl)n1,C37437211_decoy,TRY1,Decoy,0,-9.78165,-6.31,-2.72,-6.342024113876377
CC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655904_decoy,TRY1,Decoy,0,-8.45623,-6.58,-1.86,-5.765742101460071
CC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655911_decoy,TRY1,Decoy,0,-7.74082,-7.0,0.09,-6.019200247360245
CCC(CC)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676432_decoy,TRY1,Decoy,0,-9.26743,-7.22,-1.27,-7.058351832631416
CN1CCC([NH2+][C@H]2CC(C)(C)[C@@H]3C[C@@](C)(O)CC[C@]23CCC(=O)NCc2ccco2)CC1,C20464660_decoy,TRY1,Decoy,0,-8.07515,-7.07,-3.01,-6.220231966589879
Cc1c(C(N)=O)cc(-c2ccc3c(c2)C(C)(C)CCC3(C)C)n1[C@@H](C)C(=O)NCC[NH+]1CCCC1,C43225817_decoy,TRY1,Decoy,0,-8.75656,-6.81,-4.03,-6.702088916262043
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C44714441_decoy,TRY1,Decoy,0,-10.0196,-7.98,-2.26,-7.211528564722677
CC(C)[NH2+][C@H](COc1c(Br)cc([N+](=O)[O-])cc1Br)C(N)=O,C50441524_decoy,TRY1,Decoy,0,-7.42796,-4.75,-3.03,-4.813398997496772
NC(=O)[C@H](COc1c(Br)cc([N+](=O)[O-])cc1Br)[NH2+]C1CC1,C50441549_decoy,TRY1,Decoy,0,-7.93031,-4.69,-2.51,-5.650628187273853
COc1ccc2[nH]cc(CCNC(=O)C3CCN(c4[nH]c5cc(C)ccc5[nH+]4)CC3)c2c1,C33070782_decoy,TRY1,Decoy,0,-7.69133,-7.82,-1.28,-6.187439222525095
COc1ccc(Oc2c(C(F)(F)F)oc3c(C[NH2+]CCO)c(O)ccc3c2=O)cc1,C57312269_decoy,TRY1,Decoy,0,-8.03661,-6.92,-4.8,-7.181240360466383
CSc1ccccc1NC(=O)C[NH+](C)Cc1nc(N)c2c3c(sc2n1)CCCC3,C31039202_decoy,TRY1,Decoy,0,-8.50034,-7.88,-1.64,-6.470601537963837
CCCCN(C(=O)C[NH+](C)[C@H](C)c1ccc(C)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C59038228_decoy,TRY1,Decoy,0,-7.60872,-7.13,-3.09,-8.08511473382919
C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258620_decoy,TRY1,Decoy,0,-7.68476,-6.34,-1.02,-5.464223125755856
C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258622_decoy,TRY1,Decoy,0,-8.27058,-7.39,-1.9,-6.668620293687635
C[C@@H]1C[C@H]1c1ccc(C[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C2CC2)o1,C59403277_decoy,TRY1,Decoy,0,-10.9969,-7.56,-0.72,-8.938641045764268
CC(C)(CO)[NH2+]CC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br,C59416879_decoy,TRY1,Decoy,0,-7.20329,-5.53,-0.42,-5.58736014014723
Cc1cc(C)nc(N/C(NCc2ccco2)=[NH+]/C(=O)NC23CC4CC(CC(C4)C2)C3)n1,C14157379_decoy,TRY1,Decoy,0,-8.6168,-5.53,-2.06,-5.8845039831189645
CCOc1ccc(-c2nc(CC(=O)Nc3ccccc3C[NH+]3CCC[C@H](C(N)=O)C3)cs2)cc1,C60331544_decoy,TRY1,Decoy,0,-8.88059,-6.36,-0.63,-7.151214654176079
CC[NH2+][C@H](CCOc1c(Br)cc([N+](=O)[O-])cc1Br)C(N)=O,C62595571_decoy,TRY1,Decoy,0,-7.4864,-4.48,-3.96,-4.883514706314137
Cc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3NN[C@H](C(C)(C)C)S3)CC1=O)C[NH+]=2,C63941163_decoy,TRY1,Decoy,0,-9.0715,-6.15,-2.48,-6.563630494461189
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)NNC(=O)CC1=c2ccccc2=[NH+]C1,C64042835_decoy,TRY1,Decoy,0,-8.36008,-8.37,-2.0,-6.523749621626159
O=C(N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccccc1O)c1ccccc1Cl,C64046741_decoy,TRY1,Decoy,0,-9.14977,-6.95,-1.3,-7.359524266386296
Cc1ccc2c(c1)=C(CCNC(=O)c1cccc(NC(=O)[C@H]3NSc4ccccc43)c1)C[NH+]=2,C64540097_decoy,TRY1,Decoy,0,-7.66264,-6.66,-2.56,-5.345920903570874
Cc1ccc2c(c1)=C(CCNC(=O)c1cccc(NC(=O)[C@@H]3NSc4ccccc43)c1)C[NH+]=2,C64540098_decoy,TRY1,Decoy,0,-9.01783,-8.76,-1.61,-6.284363442871706
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)c1cccc(NC(=O)[C@@H]2NSc3ccccc32)c1,C64540100_decoy,TRY1,Decoy,0,-10.7989,-8.56,-3.1,-7.105276546446088
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)c1cccc(NC(=O)[C@H]2NSc3ccccc32)c1,C64540102_decoy,TRY1,Decoy,0,-8.83666,-7.17,-1.22,-5.705277118591249
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C04349189_decoy,TRY1,Decoy,0,-6.87954,-7.97,-2.42,-5.404435410256034
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C04349204_decoy,TRY1,Decoy,0,-7.05298,-9.44,-2.31,-7.285890234400316
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@H](O)[C@H]4O)cc3o2)cc1,C04349207_decoy,TRY1,Decoy,0,-7.65842,-7.36,-2.38,-6.055600928925467
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1,C04349211_decoy,TRY1,Decoy,0,-7.01949,-9.39,-3.72,-7.236695793220532
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1,C04349214_decoy,TRY1,Decoy,0,-7.18173,-7.99,-2.08,-5.863722088055054
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCC(C)C)c1ccco1,C04383613_decoy,TRY1,Decoy,0,-8.64397,-4.35,-2.96,-5.6099246134754095
O=[N+]([O-])c1cc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)ccc1Cl,C05221359_decoy,TRY1,Decoy,0,-6.06494,-5.99,-2.4,-4.565374224819504
O=[N+]([O-])c1cc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)ccc1Cl,C05221379_decoy,TRY1,Decoy,0,-5.68055,-6.68,-3.74,-5.180734374000882
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCOC)c2ccc(O)cc2)cc1,C06600977_decoy,TRY1,Decoy,0,-8.00133,-5.33,-2.46,-5.75143653241464
CNS(=O)(=O)c1cc2c(c([N+](=O)[O-])c1)-c1c(cc(S(=O)(=O)NC)cc1[N+](=O)[O-])C2=NNC(N)=O,C06878877_decoy,TRY1,Decoy,0,-7.28384,-4.95,-1.55,-4.72207436702095
COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C08143560_decoy,TRY1,Decoy,0,-7.63036,-9.77,-3.3,-7.35943806082307
COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O,C08143568_decoy,TRY1,Decoy,0,-6.62126,-7.76,-3.07,-5.209328460012428
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)nnn1-c1nonc1N,C01899021_decoy,TRY1,Decoy,0,-8.20033,-9.11,-2.05,-8.117062329886442
Cc1oc2c(C)c3oc(=O)c(CC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c(C)c3cc2c1C,C08764211_decoy,TRY1,Decoy,0,-8.62067,-8.14,-3.65,-7.360710673235546
CC(=O)N[C@H]1[C@@H](OC[C@H](O)[C@H]2O[C@H]3OC(C)(C)O[C@@H]3[C@H]2OCc2ccccc2)O[C@@H](CO)[C@@H](O)[C@H]1O,C09974830_decoy,TRY1,Decoy,0,-6.24244,-8.62,-1.71,-6.518412077624491
Nc1ncnc2c1nc(N/N=C/c1ccc(-c3ccc([N+](=O)[O-])cc3)cc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975201_decoy,TRY1,Decoy,0,-8.26518,-8.31,-2.06,-7.537802386546213
CS(=O)(=O)Oc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C09975279_decoy,TRY1,Decoy,0,-8.27842,-8.66,-1.73,-11.116228829071416
O=[N+]([O-])c1cc(N[C@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)ccc1Cl,C13424884_decoy,TRY1,Decoy,0,-6.24768,-6.03,-2.74,-4.67035414702628
O=[N+]([O-])c1cc(N[C@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)ccc1Cl,C13424886_decoy,TRY1,Decoy,0,-5.92129,-7.19,-3.03,-1.962607854411321
COc1cc(/C=N/NC(=O)c2c(CN3CCOCC3)nnn2-c2nonc2N)ccc1OCC(N)=O,C19925935_decoy,TRY1,Decoy,0,-8.99098,-7.63,-4.15,-7.244310431917696
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3ccccc3O)n2N)sc2c1CCCC2,C20527346_decoy,TRY1,Decoy,0,-9.93895,-9.94,-2.97,-8.725125257530806
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3ccc(O)cc3)n2N)sc2c1CCCC2,C21315721_decoy,TRY1,Decoy,0,-9.74673,-10.58,-1.79,-9.7935307342936
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C22064703_decoy,TRY1,Decoy,0,-5.17372,-6.2,-3.98,-5.29756041063179
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O[C@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O,C22064713_decoy,TRY1,Decoy,0,-5.50885,-6.32,-2.98,-3.9230919981269294
COc1ccc([C@@H]2Oc3c(OC)cc(CCCO)cc3[C@@H]2CO)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C31156093_decoy,TRY1,Decoy,0,-8.0212,-6.11,-3.57,-5.960064824449518
COc1cc(O)cc(C)c1C(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](OC2[C@@H](O)[C@H](O)C(O)[C@H](O)[C@@H]2O)O[C@@H]1CO,C31165239_decoy,TRY1,Decoy,0,-8.83565,-6.51,-2.16,-6.01812566400935
COC1=C(N)C(=O)c2nc(-c3nc(CO)c(C)c(-c4ccc(OC)c(OC)c4OC)c3N)ccc2C1=O,C04633051_decoy,TRY1,Decoy,0,-8.13085,-6.88,-2.34,-5.91509512397374
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)N1CCN(CCNC(=O)/C(C#N)=C/c2ccc(O)c(O)c2)CC1,C17259458_decoy,TRY1,Decoy,0,-9.60258,-7.82,-4.13,-7.322334470506942
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(Cl)c1,C35395241_decoy,TRY1,Decoy,0,-5.54476,-7.06,-4.04,-4.940510947170144
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(Cl)c1,C35395244_decoy,TRY1,Decoy,0,-5.82757,-6.98,-2.95,-4.543888071757606
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)c(Cl)c1,C35395247_decoy,TRY1,Decoy,0,-6.87048,-5.96,-4.08,-4.902074708017425
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)c(Cl)c1,C35395250_decoy,TRY1,Decoy,0,-6.20591,-5.52,-1.53,-4.322726521150839
CC1=C(C(=O)O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@H]2O)C(C)(C)CC=C1,C35465921_decoy,TRY1,Decoy,0,-6.28016,-6.11,-1.99,-4.841492408718048
Cc1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1[N+](=O)[O-],C35474380_decoy,TRY1,Decoy,0,-3.44463,-6.12,-1.81,-3.594140983290159
Cc1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1[N+](=O)[O-],C35474384_decoy,TRY1,Decoy,0,-5.42826,-6.92,-1.89,-5.289486409566398
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)c(C)c2)o1,C12714955_decoy,TRY1,Decoy,0,-7.17621,-7.27,-0.6,-8.27975986739358
O=C(O[C@@H]1C=C(CO)[C@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@]12O)c1ccc(O)cc1,C35455248_decoy,TRY1,Decoy,0,-7.56626,-7.38,-1.72,-6.956965205246423
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])Cc2ccc(O)cc2)[C@H](O)[C@@H]1O,C38665102_decoy,TRY1,Decoy,0,-7.59773,-10.15,-2.51,-7.982440803862933
COc1cc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1O,C39948797_decoy,TRY1,Decoy,0,-8.40586,-8.1,-3.22,-6.178986593143087
COc1cc(O)cc(C)c1C(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](OC2[C@@H](O)[C@@H](O)C(O)[C@@H](O)[C@H]2O)O[C@H]1CO,C35459072_decoy,TRY1,Decoy,0,-7.84847,-6.28,-3.24,-5.257154086948356
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]2O)c(Cl)c1,C43193663_decoy,TRY1,Decoy,0,-6.70772,-5.52,-2.27,-5.10141277617218
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)c(Cl)c1,C43193666_decoy,TRY1,Decoy,0,-5.50285,-5.62,-3.42,-4.143867281418813
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)c(Cl)c1,C43193670_decoy,TRY1,Decoy,0,-5.06555,-5.31,-2.57,-3.787965614870591
CC(=O)N[C@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C43193679_decoy,TRY1,Decoy,0,-5.82101,-5.41,-3.34,-4.620993056994523
C[C@]12CC[C@@H]3[C@@](COC(=O)c4ccccc4)(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O1)O[C@]3(O)C2,C43722122_decoy,TRY1,Decoy,0,-5.79956,-7.03,-2.77,-5.215029745924953
COc1cc(O)cc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3O2)c1,C49538626_decoy,TRY1,Decoy,0,-7.99053,-7.72,-4.09,-6.373342466349999
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\NN1C(=O)c2cccc3c(NC(CO)(CO)CO)ccc(c23)C1=O,C16693826_decoy,TRY1,Decoy,0,-7.473,-7.97,-3.83,-5.636860689240407
N#Cc1c(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3O)n2)sc2c1CCCC2,C58994279_decoy,TRY1,Decoy,0,-10.419,-10.7,-2.42,-9.38883752726688
C/C(=N\Nc1nnc(SCC(=O)Nc2sc3c(c2C#N)CCCC3)n1N)c1ccccc1O,C59829746_decoy,TRY1,Decoy,0,-10.1912,-9.52,-2.7,-8.517996157243875
CC(C)C(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59879549_decoy,TRY1,Decoy,0,-9.97851,-7.13,-3.08,-9.28041570717327
CCNc1nc(NCC)nc(NNS(=O)(=O)c2cc(Br)ccc2Br)n1,C03361177_decoy,TRY1,Decoy,0,-9.36224,-5.73,-2.64,-6.986774468105829
COc1cc2nc(N3CCN(c4nc(N)c5cc(OC)c(OC)cc5n4)CC3)nc(N)c2cc1OC,C00721858_decoy,TRY1,Decoy,0,-8.95472,-6.83,-3.03,-7.326842255796463
CCc1cccc(CC)c1Nc1nnc(SCC(=O)c2c(N)n(CCOC)c(=O)[nH]c2=O)s1,C11278109_decoy,TRY1,Decoy,0,-8.50702,-7.79,-4.18,-7.221375492931314
COc1cc(C(c2c(C)nn(-c3ccccc3)c2N)c2c(C)nn(-c3ccccc3)c2N)cc(OC)c1OC,C15906212_decoy,TRY1,Decoy,0,-8.40085,-5.7,-1.29,-5.83857214949455
COC(=O)C1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C16754143_decoy,TRY1,Decoy,0,-6.00474,-5.48,-2.46,-4.557750940280157
COC(=O)C1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@]12C(=O)N(CC(N)=O)c1ccccc12,C16754146_decoy,TRY1,Decoy,0,-5.6969,-6.51,-0.87,-4.716033828644558
[H]/N=C1\C(C(=O)Nc2ccc(OC)c(OC)c2)=C(Nc2ccc(F)cc2)S[C@@H]1C(=O)Nc1cccc(C#N)c1,C06304371_decoy,TRY1,Decoy,0,-9.6115,-7.67,-1.81,-6.263051424682924
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SC(C)C)s3)n[nH]2)c1O,C20832709_decoy,TRY1,Decoy,0,-10.2973,-6.19,-4.31,-6.337377255622991
CCOc1ccc2nc(NC(=O)CSc3n[nH]c(N/N=C/c4ccc(OC)c(O)c4)n3)sc2c1,C20833905_decoy,TRY1,Decoy,0,-10.779,-8.63,-3.32,-9.247478411855784
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3c(O)ccc4ccccc34)n2)s1,C20907313_decoy,TRY1,Decoy,0,-10.3166,-5.89,-2.79,-6.887765878418713
CC[C@H](C)c1ccc(NC(=O)CCSc2nnc(N/N=C/c3c(C)nn(C(C)C)c3C)n2N)cc1,C20912080_decoy,TRY1,Decoy,0,-9.28801,-5.96,-2.17,-5.734498036308717
O=C(CSc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1)NNC(=O)c1ccc(Cl)cc1,C20923348_decoy,TRY1,Decoy,0,-10.4995,-7.7,-1.83,-7.605381538108355
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NNC(=O)c1ccc(Cl)cc1,C20923430_decoy,TRY1,Decoy,0,-10.2454,-8.1,-4.32,-8.040757960890367
CC(=O)Nc1cccc(NC(=O)CCSc2n[nH]c(N/N=C/c3cccc(Cl)c3Cl)n2)c1,C21078501_decoy,TRY1,Decoy,0,-10.2647,-8.97,-2.92,-7.566900319094382
COc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C21080096_decoy,TRY1,Decoy,0,-9.0795,-8.14,-2.33,-6.806479264298319
COc1cnccc1[C@@H]1CCO[P@](=O)(OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@](C)(O)[C@@H]2O)O1,C28710256_decoy,TRY1,Decoy,0,-7.71529,-7.77,-1.23,-7.581759333918037
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(COc2ccc(C(C)(C)C)cc2)n(C(C)C)c1=S,C32594320_decoy,TRY1,Decoy,0,-8.26699,-5.12,-3.1,-5.366311241337276
CC[C@@H](C)n1c(COc2ccccc2Cl)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594340_decoy,TRY1,Decoy,0,-7.76238,-7.17,-2.66,-7.547794127386594
COc1ccc(-c2cnc(NC(=O)NC(=O)C(F)(F)F)nc2NC(=O)NC(=O)C(F)(F)F)cc1,C32620068_decoy,TRY1,Decoy,0,-7.77531,-5.32,-2.08,-6.589223675255933
CC(=O)O[C@@H]1[C@H](O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@@H](C)[C@@H]1OC(C)=O,C34374845_decoy,TRY1,Decoy,0,-8.33796,-8.29,-1.99,-9.294186586520446
COc1cc([C@H]2[NH2+][C@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@@H]23)ccc1O,C34795219_decoy,TRY1,Decoy,0,-7.77433,-7.44,-1.99,-6.300899837659975
O=C(NC1CCCCC1)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499659_decoy,TRY1,Decoy,0,-8.06864,-6.28,-2.24,-7.786205763901448
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499661_decoy,TRY1,Decoy,0,-6.70089,-5.4,-2.87,-5.382660285759047
COc1ccc(CCC(=O)N(Cc2ccco2)[C@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)cc1,C36501115_decoy,TRY1,Decoy,0,-7.93108,-6.49,-3.19,-6.353929664379173
CCCN(C(=O)C=C(C)C)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36573578_decoy,TRY1,Decoy,0,-8.51676,-7.92,-4.03,-8.316034013135923
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596618_decoy,TRY1,Decoy,0,-6.73795,-5.17,-3.96,-5.1519810922192
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)Cc1ccc2c(c1)OCO2,C36598865_decoy,TRY1,Decoy,0,-9.03525,-5.83,-2.95,-6.391041882526826
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1cccc([N+](=O)[O-])c1,C36601343_decoy,TRY1,Decoy,0,-7.92442,-5.96,-3.45,-6.531025890613963
CCCCN1C(=O)N=C([O-])[C@H](N(CC(C)C)C(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)[C@H]1[NH3+],C38800701_decoy,TRY1,Decoy,0,-8.73931,-7.52,-3.02,-7.446836581826858
O=C(CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(Cl)cc1)Nc1cccc(F)c1,C39363074_decoy,TRY1,Decoy,0,-8.48279,-8.21,-0.67,-8.113728901357428
COc1ccccc1NC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(Cl)cc1,C39363083_decoy,TRY1,Decoy,0,-7.89844,-8.15,-1.76,-7.18529156196528
COCCC[NH+]1[C@@H](SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)NN[C@H]1c1ccc(Cl)cc1,C39722394_decoy,TRY1,Decoy,0,-8.51904,-6.82,-2.98,-6.664013424329186
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)NCc2ccc3c(c2)OCO3)[C@]1(C)CO,C43553870_decoy,TRY1,Decoy,0,-10.5276,-6.25,-2.15,-6.870568549773151
CCCCN(C(=O)CSc1nnc(NC2CCCCC2)s1)c1c(N)n(CCC)c(=O)[nH]c1=O,C21681880_decoy,TRY1,Decoy,0,-10.8541,-7.14,-3.6,-8.541592340964826
CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C20611407_decoy,TRY1,Decoy,0,-9.25585,-5.68,-1.19,-5.628792177601195
C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@@H]1CC[C@@]2(O)C(=O)COC(=O)CCC(=O)NCCc1ccc(O)cc1,C01816268_decoy,TRY1,Decoy,0,-10.2804,-9.4,-2.36,-8.940666089379437
O=C1C[C@@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)c2c(nc(Nc3ccc(Cl)cc3)[nH]c2=O)N1,C54202256_decoy,TRY1,Decoy,0,-8.97965,-6.14,-3.01,-5.715452103086562
CCOc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cc(OC)ccc4OC)c32)cc(Br)c1O,C00987186_decoy,TRY1,Decoy,0,-7.61402,-5.64,-1.54,-5.405057984098447
CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cc(OC)ccc4OC)c32)cc(Br)c1O,C00987185_decoy,TRY1,Decoy,0,-7.37407,-6.46,-2.98,-5.623900633961412
C[C@H]1CCc2c(sc(NC(=S)NC(=O)c3cc([N+](=O)[O-])ccc3N3CCOCC3)c2C(N)=O)C1,C22827288_decoy,TRY1,Decoy,0,-9.00509,-7.06,-3.13,-6.359304104946582
COc1cc(/C=N/NC(=O)CCCSc2nnc(-c3ccc(Br)cc3)n2N)ccc1O,C58987463_decoy,TRY1,Decoy,0,-10.8268,-7.23,-2.16,-6.952570855226254
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc([N+](=O)[O-])ccc3O)n2)s1,C58997573_decoy,TRY1,Decoy,0,-9.86424,-7.88,-1.87,-7.607892585924213
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCCC(=O)Nc2sc3c(c2C#N)CCCC3)n[nH]1,C59888208_decoy,TRY1,Decoy,0,-10.9872,-9.28,-1.37,-8.458564737043668
C/C(CC(C)C)=N\Nc1nnc(SCC(=O)Nc2nnc(SCc3ccccc3)s2)n1N,C59915933_decoy,TRY1,Decoy,0,-9.871,-8.33,-3.05,-7.38585206276098
CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](CC(N)=O)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1,C15958632_decoy,TRY1,Decoy,0,-9.17038,-7.66,-2.06,-6.523412468181802
COc1ccc2c(c1)=C(CC[N-]/C(=N\C(=O)CS[C@H]1NN[C@H](C)S1)Nc1nc(C)cc(C)n1)C[NH+]=2,C63493861_decoy,TRY1,Decoy,0,-8.67945,-8.05,-2.46,-7.149869974787892
Cc1cc(C)nc(N/C(=N/C(=O)CS[C@@H]2NN[C@@H](C)S2)[N-]CCC2=c3cc(Cl)ccc3=[NH+]C2)n1,C63867166_decoy,TRY1,Decoy,0,-9.13374,-8.53,-2.77,-7.146093330881426
CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]3O)=C[C@@H]21,C65748796_decoy,TRY1,Decoy,0,-7.46274,-8.07,-2.12,-6.350730797712416
CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)O[C@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)=C[C@@H]21,C65748800_decoy,TRY1,Decoy,0,-7.62398,-8.01,-0.71,-7.540919488571299
CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)O[C@@H]3O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)=C[C@@H]21,C65748802_decoy,TRY1,Decoy,0,-8.40871,-6.45,-1.33,-6.928103905001006
Nc1nc2c(nc(I)n2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1,C04159866_decoy,TRY1,Decoy,0,-6.69616,-7.54,-1.86,-7.687760947175178
O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc(O)c21,C04348951_decoy,TRY1,Decoy,0,-8.58295,-8.52,-1.92,-7.867553885084829
Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c1C2=O,C05412535_decoy,TRY1,Decoy,0,-7.19129,-6.95,-2.87,-5.0450748984100375
O=C1C=C(S[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)c2c(O)ccc(O)c21,C05568395_decoy,TRY1,Decoy,0,-6.84195,-6.14,-3.42,-4.41735509047845
Nc1nc(N)c(-c2c(-c3ccc(Cl)cc3)[nH]c3nc(N)[nH]c(=O)c23)c(=O)[nH]1,C06667843_decoy,TRY1,Decoy,0,-7.82518,-5.87,-1.07,-5.027470927609077
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@@H]12,C08836062_decoy,TRY1,Decoy,0,-9.4591,-6.13,-2.25,-4.697763210113978
Cc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)o1,C09975253_decoy,TRY1,Decoy,0,-6.47202,-7.52,-1.72,-6.841743586837998
Nc1ncnc2c1nc(N/N=C/c1ccncc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004239_decoy,TRY1,Decoy,0,-7.54912,-8.25,-1.57,-7.887063273684767
C[C@@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@H]([NH+](C)C)[C@H]3[C@H](O)[C@H]21,C11592655_decoy,TRY1,Decoy,0,-8.40382,-6.7,-1.87,-5.33230792170178
O=c1c(-c2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)coc2cc(O)cc(O)c12,C12139867_decoy,TRY1,Decoy,0,-7.97515,-6.69,-1.83,-4.741335669321446
C[NH+]1CCN(Nc2nc3c(O)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C12655706_decoy,TRY1,Decoy,0,-6.85139,-7.03,-1.98,-5.539689534696101
C[NH+]1CCN(Nc2nc3c(O)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C12655712_decoy,TRY1,Decoy,0,-7.06902,-5.19,-2.21,-5.132573452922878
C[NH+]1CCN(Nc2nc3c(O)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)CC1,C12655715_decoy,TRY1,Decoy,0,-6.81145,-5.7,-2.49,-5.194325814958765
C[NH+]1CCN(Nc2nc3c(O)ncnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)CC1,C12655719_decoy,TRY1,Decoy,0,-7.33989,-5.13,-3.76,-4.885139726999703
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12660345_decoy,TRY1,Decoy,0,-6.78533,-8.21,-1.38,-8.878219427581783
OC[C@H]1O[C@@H](Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C12888720_decoy,TRY1,Decoy,0,-8.23387,-8.06,-1.54,-6.560969617711771
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]12,C08034263_decoy,TRY1,Decoy,0,-9.27448,-7.8,-2.34,-5.591248373228403
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740539_decoy,TRY1,Decoy,0,-6.616,-7.63,-1.15,-7.284886250704285
O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)cc(O)c12,C13424747_decoy,TRY1,Decoy,0,-7.01533,-7.48,-0.92,-7.201654385889955
O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)ccc12,C13513727_decoy,TRY1,Decoy,0,-7.85869,-8.95,-3.58,-8.525725816428986
O=c1c2cc(O)c(O)cc2oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c(O)c12,C13783868_decoy,TRY1,Decoy,0,-7.24339,-6.85,-3.59,-4.910979915145599
O=c1c2cc(O)c(O)cc2oc2cc(O)c([C@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(O)c12,C15449243_decoy,TRY1,Decoy,0,-6.2205,-7.52,-2.74,-4.614997483867173
COc1nc(O)c(Br)c(N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)n1,C16952392_decoy,TRY1,Decoy,0,-6.83784,-4.57,-2.96,-4.718270674485285
N#Cc1c(N)nc2sc(C(N)=O)c(N)c2c1-c1ccc(Br)cc1,C19337694_decoy,TRY1,Decoy,0,-7.57839,-7.57,-0.82,-6.556684438403273
CN1Cc2c(N3CCOCC3)[nH+]c3sc(C(=O)NN)c(N)c3c2CC1(C)C,C20264237_decoy,TRY1,Decoy,0,-8.97741,-6.71,-1.26,-10.369569616793088
O=C1c2c(O)cccc2[C@H]([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c2cc(CO)cc(O)c21,C14417217_decoy,TRY1,Decoy,0,-7.74051,-8.94,-1.72,-8.577093415149257
Nc1ncnc2c1nc(N/N=C/c1ccncc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740484_decoy,TRY1,Decoy,0,-6.9371,-8.21,-1.42,-7.811818908036319
Cc1c2c(c(O)c3c(O)cccc13)C(=O)[C@]1(O)C([O-])=C(C(N)=O)C(=O)[C@H]([NH+](C)C)[C@@H]1C2,C35799639_decoy2,TRY1,Decoy,0,-7.54321,-7.34,,-6.04306189878963
O=c1c2cc(O)c(O)cc2oc2cc(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C36227900_decoy,TRY1,Decoy,0,-7.71728,-7.78,-1.94,-6.132772123040835
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740536_decoy,TRY1,Decoy,0,-6.49576,-7.78,-1.36,-8.610460849421893
Nc1ncnc2c1nc(N/N=C/c1ccccc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740541_decoy,TRY1,Decoy,0,-7.16566,-8.14,-1.13,-7.909297364836159
O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c12,C04404502_decoy,TRY1,Decoy,0,-8.2564,-8.2,-2.32,-6.694407081844963
O=c1c2cc(O)c(O)cc2oc2cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(O)c12,C05409528_decoy,TRY1,Decoy,0,-7.32575,-6.25,-2.49,-4.503800161077375
C[C@H]1c2cccc(O)c2C(=O)[C@H]2[C@H]1[C@H](O)[C@@H]1[C@H]([NH+](C)C)C([O-])=C(C(N)=O)C(=O)[C@@]1(O)[C@@H]2O,C35406257_decoy,TRY1,Decoy,0,-8.8143,-8.0,-3.58,-5.156348951341284
C[C@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]21,C21984014_decoy,TRY1,Decoy,0,-7.23466,-5.34,-3.17,-4.073681102324024
Nc1[nH]c(=O)[nH]c(=O)c1[C@@H]1C(c2ccc(C(F)(F)F)cc2)=N[C@@H]2NC(=O)NC(=O)[C@H]21,C39224157_decoy,TRY1,Decoy,0,-7.43701,-6.9,-1.21,-5.171290182766095
C/C(=N\N[C@H]1Nc2c(N)ncnc2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O)[C@@H]1C=CC=N1,C39939236_decoy,TRY1,Decoy,0,-7.36595,-7.31,-2.9,-7.119992979633746
Cc1ccc2c(Nc3ncnc(NCC[NH+]4CCCCC4)c3N)cccc2[nH+]1,C40756512_decoy,TRY1,Decoy,0,-8.97148,-7.7,-1.71,-7.493347159409968
O=c1c(-c2ccc(O)cc2)coc2c([C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)c(O)ccc12,C43465490_decoy,TRY1,Decoy,0,-7.74962,-7.36,-2.08,-6.950031888314321
C[C@@H]1c2cccc(O)c2C(=O)C2=C([O-])[C@]3(O)C([O-])=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@@H]21,C43769468_decoy,TRY1,Decoy,0,-7.68822,-7.46,-2.55,-5.302414890192845
CC1=C2C[C@@](O)(C(C)(C)O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@H](C)[C@@H]2CC1=O,C49181196_decoy,TRY1,Decoy,0,-7.399,-6.35,-4.31,-5.167327730955676
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@H]3[C@H](O)[C@H]12,C35883787_decoy,TRY1,Decoy,0,-8.14307,-6.11,-3.28,-4.552886223700003
C[C@@H]1c2cccc(O)c2C(=O)C2=C(O)[C@@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]21,C35024602_decoy,TRY1,Decoy,0,-8.14289,-6.18,-1.44,-4.598856954075891
C[C@@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]21,C35024607_decoy,TRY1,Decoy,0,-6.85264,-6.48,-1.88,-4.55439210667609
C[C@H]1c2cccc(O)c2CC2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]21,C49946776_decoy,TRY1,Decoy,0,-7.41223,-7.89,-2.52,-5.631606846683483
C[C@@H]1c2cccc(O)c2C(=O)C2=C(O)[C@@H]3C(=O)C(C(N)=O)=C([O-])[C@@H]([NH+](C)C)[C@@H]3[C@H](O)[C@H]21,C40934988_decoy,TRY1,Decoy,0,-6.6612,-7.7,-1.62,-5.503167902866518
NC(=O)C1=C(N)Oc2[nH]c(=O)[nH]c(=O)c2[C@H]1c1ccc(Br)s1,C58950397_decoy,TRY1,Decoy,0,-7.97371,-5.1,-1.71,-4.826940098234887
CC1=C(C(=O)N/N=C/c2ccc(O)cc2O)[C@H](c2ccc(O)cc2)NC(=O)N1,C59385788_decoy,TRY1,Decoy,0,-8.48366,-9.38,-1.27,-8.011144799948381
C[NH+](C)[C@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(N)c4C[C@H]3C[C@@H]12,C65740197_decoy,TRY1,Decoy,0,-7.26205,-6.92,-1.95,-5.094366537306213
C[NH+](C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)ccc(N)c4C[C@H]3C[C@@H]12,C22057128_decoy,TRY1,Decoy,0,-7.15414,-6.13,-3.58,-6.027315514947258
CCCCN(C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)NC)CC[NH+](C(C)C)C3)cc1,C02725208_decoy,TRY1,Decoy,0,-9.65017,-5.44,-2.08,-5.9367739984765935
COCCn1nnnc1[C@@H](c1cc2cc(OC)c(OC)cc2[nH]c1=O)[NH+]1CCN(c2ccc(O)cc2)CC1,C06136238_decoy,TRY1,Decoy,0,-9.27629,-7.75,-2.35,-6.824761023455599
Cc1ncc([N+](=O)[O-])n1CCOC(=O)N[C@H]([NH2+]C[C@@H]1COc2ccccc2O1)C(Cl)(Cl)Cl,C08836932_decoy,TRY1,Decoy,0,-8.68665,-7.5,-2.08,-6.92892023911498
CCOc1ccc(-c2cc3nc(C4CC[NH2+]CC4)c(C(=O)Nc4cc(OC)c(OC)c(OC)c4)cn3n2)cc1,C09639983_decoy,TRY1,Decoy,0,-8.09555,-7.87,-4.44,-10.31038582892185
COc1ccccc1CCNC(=O)C(=O)NC[C@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1,C09828884_decoy,TRY1,Decoy,0,-7.5422,-7.92,-3.6,-5.809429076139162
COc1ccccc1CCNC(=O)C(=O)NC[C@@H](c1ccco1)[NH+]1CCN(c2ccccc2F)CC1,C09828923_decoy,TRY1,Decoy,0,-9.56114,-7.51,-1.78,-6.8433387472900575
COc1ccc(CCNC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCN(c3ccccc3F)CC2)cc1,C09828937_decoy,TRY1,Decoy,0,-9.36279,-8.97,-3.43,-7.284111898409721
C[C@H](Sc1nnc(C[NH+]2CCCCC2)n1-c1ccc(OC(F)F)cc1)C(=O)NC(=O)NC1CC1,C12344188_decoy,TRY1,Decoy,0,-9.41415,-8.04,-2.39,-9.445232695621096
COC(=O)c1ccccc1NC(=S)N(CC[NH+](C)C)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C12468773_decoy,TRY1,Decoy,0,-7.766,-5.2,-2.83,-5.402780210574665
C[NH2+][C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2ccc(NCc3cccc(OC)c3OC)c(=O)cc21,C12657954_decoy,TRY1,Decoy,0,-8.73946,-6.05,-1.62,-6.077125855201641
CC[NH+]1CCC[C@@H]1CN(Cc1cc2cc(OC)c(OC)cc2[nH]c1=O)C(=O)Nc1ccccc1OC,C12709806_decoy,TRY1,Decoy,0,-7.67175,-7.42,-4.04,-7.554828174560911
COc1cc(C(=O)N[C@H](C)C(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)cc(OC)c1OC,C12770672_decoy,TRY1,Decoy,0,-9.25819,-6.96,-3.59,-7.050238484034396
COc1cc2cc(CN(CC[NH+]3CCOCC3)C(=S)NC[C@H]3CCCO3)c(=O)[nH]c2cc1OC,C06239398_decoy,TRY1,Decoy,0,-9.6665,-6.95,-1.45,-7.198240755887418
CC(C)[C@H](c1nnnn1C1CCCCC1)[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13498804_decoy,TRY1,Decoy,0,-8.49655,-8.16,-1.97,-6.844412048508043
CC(C)[C@@H](c1nnnn1C[C@@H]1CCCO1)[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13498807_decoy,TRY1,Decoy,0,-8.9003,-7.11,-2.24,-7.05099064756309
CC(C)[C@H](c1nnnn1Cc1ccco1)[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13498808_decoy,TRY1,Decoy,0,-8.768,-7.63,-4.55,-8.585500220167138
CC[NH+](CC)CCN1C(=O)C(=O)/C(=C(/O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1cccc([N+](=O)[O-])c1,C09339574_decoy,TRY1,Decoy,0,-7.47509,-5.93,-2.25,-6.005117912394601
Cc1cccc(C)c1NC(=O)C[NH+](C)CC(=O)NCCN1C(=O)S/C(=C\c2ccccc2F)C1=O,C16624323_decoy,TRY1,Decoy,0,-9.02782,-7.16,-1.75,-6.633089793899783
CC[C@@H](c1nnnn1CCCN1CCOCC1)[NH+](CCCO)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13510422_decoy,TRY1,Decoy,0,-8.42615,-6.34,-3.04,-6.106235697977554
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CC[NH+](CC(=O)Nc3ccccc3C(F)(F)F)CC2)c1C,C20795540_decoy,TRY1,Decoy,0,-6.60377,-8.31,-1.54,-6.672123757874664
CC[NH+]1CCN(CCCNC(=O)c2cc3n(n2)C[C@](C)(C(=O)NCc2ccc(F)cc2)N(C)C3=O)CC1,C21876770_decoy,TRY1,Decoy,0,-8.73265,-6.61,-2.58,-6.78305970277723
CCOc1ccc(OCC)c(NC(=O)C[NH+]2CCNC(=O)[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c1,C24779640_decoy,TRY1,Decoy,0,-7.99763,-7.99,-2.28,-7.289774089159699
CCOC(=O)c1c(NC(=O)CN2CC[NH+](CC(=O)N3CCCCC3)CC2)sc(C(=O)NC)c1C,C27376593_decoy,TRY1,Decoy,0,-10.5746,-7.46,-1.02,-7.75152805141048
CC(C)N(CN1C(=O)N/C(=C\c2cccc(/C=C3\NC(=O)N(C[NH+](C(C)C)C(C)C)C3=O)c2)C1=O)C(C)C,C16958419_decoy,TRY1,Decoy,0,-8.0948,-7.44,-1.78,-7.648231483878086
CCN(CC)S(=O)(=O)c1ccc2[nH]c(=O)cc(C(=O)NC[C@H](c3cccc(F)c3)[NH+](C)C)c2c1,C14072502_decoy,TRY1,Decoy,0,-7.87441,-5.57,-1.25,-4.959187340911514
COCCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@H](O)CN1CCOCC1,C35747107_decoy,TRY1,Decoy,0,-9.84641,-5.0,-2.02,-6.48997418969324
C[NH+](C)CCNC(=O)[C@H]1[C@@H](c2ccc(NC(=O)c3cccs3)cc2)OC(=O)N1Cc1cccc(F)c1,C35757410_decoy,TRY1,Decoy,0,-8.5765,-5.2,-4.0,-6.075183632513542
Cc1ccc(-c2csc3nc(C[NH+](CCN4CCOCC4)C[C@@H](O)COC(C)C)[nH]c(=O)c23)c(C)c1,C36206436_decoy,TRY1,Decoy,0,-9.84244,-7.13,-2.18,-7.610079746478197
Cc1ccccc1-c1csc2nc(C[NH+](Cc3ccco3)C[C@H](O)CN3CCOCC3)[nH]c(=O)c12,C36207661_decoy,TRY1,Decoy,0,-8.13121,-7.44,-2.44,-7.157715286013978
C#CCOC[C@H](O)C[NH+](CCN1CCOCC1)Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1,C36207983_decoy,TRY1,Decoy,0,-8.32129,-5.29,-1.64,-5.571212097762607
CC(C)[C@H](c1nnnn1C[C@H]1CCCO1)[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C33937246_decoy,TRY1,Decoy,0,-8.66063,-6.84,-0.99,-6.435667912518624
CCNC(=O)N(CC[NH+](C)C)Cc1cc(Cl)ccc1OS(=O)(=O)c1ccc(NC(C)=O)cc1,C37423851_decoy,TRY1,Decoy,0,-8.78402,-7.44,-1.47,-6.783490779145819
O=C(NCCCn1cc[nH+]c1)C(=O)NC[C@@H]1OCCN1S(=O)(=O)c1ccc(Br)cc1,C09489526_decoy,TRY1,Decoy,0,-8.7937,-8.92,-2.42,-8.431697570035064
CCC[NH+](CC(=O)Nc1ccc(F)c(F)c1F)CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,C03415496_decoy,TRY1,Decoy,0,-7.7716,-7.71,-1.16,-8.650509845863018
CCOc1cc(C(=O)NCCC(=O)N2CCC3(CC2)[NH2+]CCC2=NC=N[C@H]23)cc(OCC)c1OCC,C38776399_decoy,TRY1,Decoy,0,-7.64924,-7.5,-1.85,-7.334553333821422
O=C(CN1C=C(/C=N/O)C=CC1)C1CCC(C2CCC(C(=O)C[NH+]3CCC[C@H](/C=N/O)C3)CC2)CC1,C38807864_decoy,TRY1,Decoy,0,-9.32432,-8.18,-1.47,-7.736790040663526
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)NCCCOC(C)C)C4(CC[NH2+]CC4)C3)cccc12,C39605237_decoy,TRY1,Decoy,0,-8.93235,-7.14,-2.01,-6.03255628678227
CCOc1cc(CCNC(=O)[C@@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)ccc1OC,C39653478_decoy,TRY1,Decoy,0,-9.3756,-6.99,-3.19,-7.13010456947512
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCCOCC(C)C)C2(CC[NH2+]CC2)C1,C39683229_decoy,TRY1,Decoy,0,-9.52746,-6.42,-2.53,-6.82264640358309
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1C[C@@H](C(=O)NCCCOCC(C)C)C2(CC[NH2+]CC2)C1,C39683240_decoy,TRY1,Decoy,0,-10.1141,-6.97,-4.32,-9.41271358354893
COc1cc(C(=O)N2C[C@H](C(=O)NCCSC(C)(C)C)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39696429_decoy,TRY1,Decoy,0,-8.76955,-5.22,-2.77,-5.935559642046655
CNC(=O)c1ccc(C[NH+](CC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)Cc2ccco2)cc1,C46569164_decoy,TRY1,Decoy,0,-7.79825,-6.65,-1.87,-5.654617630053389
COCCOC(=O)c1c(C)[nH]c(C(=O)NCCS(=O)(=O)N2CCN(c3cccc[nH+]3)CC2)c1C,C46816552_decoy,TRY1,Decoy,0,-9.12889,-6.43,-2.68,-6.590302344254368
COCC[NH+]1CCC(c2cc(C)c3nc([C@H]4C(=O)N=CC=C4NCCn4cc(Cl)cn4)[nH]c3c2)CC1,C52550811_decoy,TRY1,Decoy,0,-9.13244,-7.7,-2.63,-6.649130831384495
CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)[C@@H](C)N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C19949357_decoy,TRY1,Decoy,0,-9.90827,-7.95,-2.01,-7.400711909051607
COc1ccc(OC)c(NC(=S)N/C(=N/c2nc(C)cc(C)n2)N2CCN(c3cccc[nH+]3)CC2)c1,C14159754_decoy,TRY1,Decoy,0,-8.95756,-7.54,-3.46,-7.436372978540175
CC/C(N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OC)=C1/C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O,C63425943_decoy,TRY1,Decoy,0,-8.43649,-6.81,-1.67,-6.843533205036788
O=C(NCCC1=c2ccccc2=[NH+]C1)C(=O)NC[C@H](c1ccco1)N1CCN(c2ccccc2F)CC1,C63694477_decoy,TRY1,Decoy,0,-9.10479,-8.32,-2.24,-6.868945312858079
CCCN(C[C@@H]1NN=C(c2cccs2)O1)C(=O)CN1C(=O)N[C@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63855246_decoy,TRY1,Decoy,0,-7.96934,-8.44,-1.83,-7.462648919710415
COc1ccc(-c2nc3sc(N(C)CC(=O)NCCN4CC[NH+](C)CC4)nn3c2NC(C)(C)C)cc1,C64703600_decoy,TRY1,Decoy,0,-9.81534,-7.92,-2.17,-11.29270557023567
COc1cc(SC)ccc1C(=O)N[C@@H]1C=C(C(=O)N[C@@H](CCC(=O)[O-])C(N)=O)C[C@@H](O)[C@@H]1O,C04221824_decoy,TRY1,Decoy,0,-8.9055,-6.4,-2.81,-6.121181782695554
O=C(Cn1cc(I)c(C(=O)NC[C@H](O)CO)n1)NC[C@H](O)CO,C01634739_decoy,TRY1,Decoy,0,-7.96612,-5.63,-4.04,-6.621126361424919
O=C(Cn1cc(I)c(C(=O)NC[C@@H](O)CO)n1)NC[C@@H](O)CO,C01634742_decoy,TRY1,Decoy,0,-7.91707,-5.61,-3.85,-6.591568247237606
CCC(C)(C)NC(=O)[C@@H](c1ccc(N(C)C)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06077419_decoy,TRY1,Decoy,0,-8.42941,-5.17,-4.16,-5.618365179509572
CCC(C)(C)NC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06077461_decoy,TRY1,Decoy,0,-8.61085,-6.41,-2.52,-6.733529183617283
CCOC(=O)CNC(=O)[C@@H](C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1,C06546563_decoy,TRY1,Decoy,0,-6.10826,-6.39,-3.48,-7.536144584407706
CCOc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC(C)(C)C)c1ccc(C)o1,C06631422_decoy,TRY1,Decoy,0,-8.27489,-6.97,-1.01,-9.427257893556256
COc1cc(/C=N/NC(=O)Cn2nc(-c3nonc3N)nc2-c2nonc2N)ccc1OCC#N,C02215452_decoy,TRY1,Decoy,0,-8.96035,-5.83,-3.33,-5.787562067843973
O=C(C[C@@H]1CC[NH2+]C[C@@H]1Cc1cc(C[NH+]2CCOCC2)on1)NCC[NH+]1CCOCC1,C08623560_decoy,TRY1,Decoy,0,-9.94023,-7.16,-2.58,-6.972962962672311
O=[N+]([O-])c1ccc(OC[C@@H](O)C[NH2+]CCCCCC[NH2+]C[C@H](O)COc2ccc([N+](=O)[O-])cc2)cc1,C12374658_decoy,TRY1,Decoy,0,-7.30264,-6.49,-4.28,-6.1417873519155
O=[N+]([O-])c1ccc(OC[C@H](O)C[NH2+]CCCCCC[NH2+]C[C@@H](O)COc2ccc([N+](=O)[O-])cc2)cc1,C12374659_decoy,TRY1,Decoy,0,-8.06491,-5.91,-3.08,-6.809468858056376
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C12467565_decoy,TRY1,Decoy,0,-7.64157,-4.62,-3.21,-5.520520857318186
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C)C(=O)NC[C@H]2CCCO2)cc1,C12715201_decoy,TRY1,Decoy,0,-7.73899,-6.93,-3.35,-7.471134274998666
Nc1nc(SCCCCC(=O)NCC(=O)NCC(=O)NCC(=O)[O-])c2nc[nH]c2n1,C05349576_decoy,TRY1,Decoy,0,-7.68396,-6.71,-3.87,-7.387351906765226
O=[N+]([O-])c1ccc(OC[C@H](O)C[NH2+]CCCCCC[NH2+]C[C@H](O)COc2ccc([N+](=O)[O-])cc2)cc1,C12374660_decoy,TRY1,Decoy,0,-8.29855,-5.67,-4.19,-6.775872785022893
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2)s1,C20832566_decoy,TRY1,Decoy,0,-10.0356,-6.74,-2.48,-7.100430500635022
COc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(F)(F)F)n[nH]2)c1O,C20834557_decoy,TRY1,Decoy,0,-7.93229,-7.75,-2.78,-6.772985114864689
C=CCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cccc(O)c2)n1N,C20914907_decoy,TRY1,Decoy,0,-8.33242,-8.52,-3.13,-7.170424846737176
NC(=O)CSc1nnc(N/N=C/c2ccccc2OCc2ccccc2Cl)n1N,C21325491_decoy,TRY1,Decoy,0,-8.43579,-7.99,-0.88,-7.650145221290476
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]1O,C21981331_decoy,TRY1,Decoy,0,-6.45477,-5.84,-1.76,-5.152289752068907
CC(C)[NH2+]C[C@H](COc1cccc2ccccc12)O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@H]1O,C22066097_decoy,TRY1,Decoy,0,-5.79005,-7.43,-3.02,-6.708383377336217
COCCn1c(N)c(C(=O)CSc2nnc(C3CC3)n2CCC(N)=O)c(=O)[nH]c1=O,C22749501_decoy,TRY1,Decoy,0,-7.57704,-6.01,-2.48,-5.400219027610386
CC(=O)N(O)CCCCCNC(=O)C[C@@](O)(CC(=O)NCCCN(O)C(C)=O)C(=O)[O-],C31163090_decoy,TRY1,Decoy,0,-7.19659,-6.59,-3.89,-7.13455123943073
CC(=O)N(O)CCCCCNC(=O)C[C@](O)(CC(=O)NCCCN(O)C(C)=O)C(=O)[O-],C31163094_decoy,TRY1,Decoy,0,-7.09423,-6.55,-3.6,-5.741481530409527
Cc1cccc([C@H](CC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])NC(N)=O)c1,C32796276_decoy,TRY1,Decoy,0,-7.32806,-7.5,-2.71,-6.657564169714116
[NH3+]CCCCCC(=O)N[C@H](Cc1ccc(O)c(/N=N\c2ccc(NC(=O)C(=O)[O-])cc2)c1)C(=O)[O-],C27534300_decoy,TRY1,Decoy,0,-7.26122,-7.11,-2.97,-10.659716651385825
CC1=C(C(=O)[O-])/C(=C\CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](OC(=O)/C=C/c2ccc(O)cc2)C1,C35465883_decoy,TRY1,Decoy,0,-7.67756,-7.72,-1.56,-6.512949789578035
CCCc1cc(=O)oc2c(C)c(OCC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)ccc12,C36369704_decoy,TRY1,Decoy,0,-7.35451,-7.89,-3.29,-6.927294519708579
CCC[C@H](C(=O)NC1CCCC1)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C04374132_decoy,TRY1,Decoy,0,-9.13212,-5.75,-3.05,-7.576532638868652
CC(C)C[C@H](C(=O)NC(C)(C)C)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06190440_decoy,TRY1,Decoy,0,-8.42262,-7.25,-3.53,-8.74761010923051
CC1(C(=O)[O-])C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C(O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1,C39351841_decoy,TRY1,Decoy,0,-10.5996,-9.86,-2.24,-11.09281401970101
NC1=N[C@H](SCCCCC(=O)NCC(=O)NCC(=O)NCC(=O)[O-])C2=NC=NC2=N1,C39943672_decoy,TRY1,Decoy,0,-7.23587,-6.28,-2.6,-10.301150913736368
CC[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCCC2)n1c(N)nnc1SCC(=O)OC,C40174056_decoy,TRY1,Decoy,0,-9.15835,-5.93,-2.03,-7.319570623697414
CC[NH+](CC)C[C@H](O)Cn1c(=O)n(C[C@@H](O)C[NH+](CC)CC)c(=O)n(C[C@H](O)C[NH+](CC)CC)c1=O,C19203431_decoy,TRY1,Decoy,0,-7.78852,-5.6,-2.4,-6.422223438556845
COC(=O)C[C@H]1O[C@@H](O[C@]2(CC(=O)OC)O[C@H](C(=O)OC)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C44028880_decoy,TRY1,Decoy,0,-5.4527,-5.38,-3.04,-4.355436545946766
[NH3+]CCCOCCOCCOCCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C44831615_decoy,TRY1,Decoy,0,-9.92412,-4.84,-3.26,-6.544065681522589
CO[C@H](C[C@@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)c1c(O)ccc(C(C)=O)c1O)C(=O)[O-],C49601557_decoy,TRY1,Decoy,0,-5.60901,-5.47,-2.06,-4.563251785873731
COc1ccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)cc1O,C59879281_decoy,TRY1,Decoy,0,-8.89763,-7.79,-2.45,-9.550430754401935
COc1ccc(/C=N/Nc2nc(S[C@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)cc1O,C59879283_decoy,TRY1,Decoy,0,-9.64349,-6.12,-2.2,-6.608405252170827
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)NCc2ccco2)n1N,C59914547_decoy,TRY1,Decoy,0,-8.78227,-7.78,-1.92,-8.597408986783284
NC(=O)Cc1ccc(OCC2=[NH+][C@@H](C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)ON2)cc1,C63782757_decoy,TRY1,Decoy,0,-9.36552,-8.77,-1.3,-6.831015497746023
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(NC3CC[NH+](C(C)C)CC3)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63993848_decoy,TRY1,Decoy,0,-8.64386,-8.05,-2.15,-9.433674336125966
COC(=O)[C@H]1[C@H](NC(C)=O)c2cc(NC3CC[NH+](C(C)C)CC3)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63993850_decoy,TRY1,Decoy,0,-8.6691,-7.69,-2.38,-6.467949152740791
COc1c(O)c(C)c(CCCCCCCCCCO)c(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c1OC,C65742897_decoy,TRY1,Decoy,0,-6.88234,-5.47,-4.42,-5.388252170121602
COc1c(O)c(C)c(CCCCCCCCCCO)c(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c1OC,C65742899_decoy,TRY1,Decoy,0,-7.52654,-6.66,-5.85,-6.324550385942142
COc1c(O)c(CCCCCCCCCCO)c(C)c(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c1OC,C65742901_decoy,TRY1,Decoy,0,-7.73808,-5.96,-3.49,-8.863327365652852
CCC[C@H]([NH2+][C@@H](C)C(=O)N1[C@H](C(=O)O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)C[C@@H]2CCCC[C@@H]21)C(=O)[O-],C65748395_decoy,TRY1,Decoy,0,-5.52459,-7.2,-4.1,-6.055364454965561
CCC[C@H]([NH2+][C@@H](C)C(=O)N1[C@H](C(=O)O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)C[C@@H]2CCCC[C@@H]21)C(=O)[O-],C65748397_decoy,TRY1,Decoy,0,-6.14575,-6.03,-2.5,-5.03865023300462
CC(C)[NH2+]C[C@@H](COc1cccc2ccccc12)O[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65748510_decoy,TRY1,Decoy,0,-5.77153,-6.35,-2.99,-4.850281847532262
CC/C(=N\Cc1ccccc1C[NH+](C)C)C1C(=O)NC(=S)NC1=O,C09774922_decoy,TRY1,Decoy,0,-6.45844,-5.94,-0.94,-4.785935796372573
Cc1c(C[NH2+]C[C@]2(O)CCCN(Cc3ccccc3F)C2=O)cnn1C,C15073312_decoy,TRY1,Decoy,0,-7.3894,-6.74,-3.39,-6.582469031956142
CC(C)NC(=O)[C@H]1O[C@H](CC[NH+]2CCc3ccccc3C2)CC[C@@H]1O,C30878754_decoy,TRY1,Decoy,0,-8.35055,-6.22,-1.57,-5.117646580854388
CCCC[n+]1c(N)n(C[C@@H](O)c2ccc(Br)cc2)c2ccccc21,C01815133_decoy,TRY1,Decoy,0,-7.15914,-4.42,-2.73,-4.749147041714392
OCCn1ncc2c1CCC[C@@H]2[NH2+]Cc1ccc(I)o1,C37322347_decoy,TRY1,Decoy,0,-8.5922,-4.63,-1.57,-5.23167094106966
CCS(=O)(=O)CCOc1c(Br)cc(CC[NH3+])cc1OC,C37720735_decoy,TRY1,Decoy,0,-9.28335,-5.62,-3.55,-8.605272758974854
CC(=O)N1C[C@@H](C(=O)NC[C@@H](C)Oc2ccc(F)cc2)C2(CC[NH2+]CC2)C1,C39595394_decoy,TRY1,Decoy,0,-7.62955,-6.35,-1.48,-5.302013818310038
Cc1cc(C(=O)N2C[C@H](C(=O)NCCC(C)C)C3(CC[NH2+]CC3)C2)nn1C,C39601485_decoy,TRY1,Decoy,0,-8.04795,-5.18,-2.86,-4.96641749051608
COCCNC(=O)[C@@H]1CN(C(=O)c2c(Cl)ccc(C)c2F)CC12CC[NH2+]CC2,C39603459_decoy,TRY1,Decoy,0,-8.04054,-6.48,-1.0,-5.579219718530936
CC[C@@H](C)CNC(=O)[C@@H]1CN(C(=O)CCSC)CC12CC[NH2+]CC2,C39606271_decoy,TRY1,Decoy,0,-8.06067,-4.94,-2.68,-6.207182570731111
CC1(C(=O)N2C[C@H](C(=O)NCCN3CCOCC3)C3(CC[NH2+]CC3)C2)CCCCC1,C39625616_decoy,TRY1,Decoy,0,-9.15241,-7.69,-1.52,-7.592439718014372
CSCCC(=O)N1C[C@H](C(=O)NC2CCCC2)C2(CC[NH2+]CC2)C1,C39632465_decoy,TRY1,Decoy,0,-8.44585,-4.84,-3.13,-5.798719473286305
CC[C@H](COC)NC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39637984_decoy,TRY1,Decoy,0,-7.79388,-4.24,-1.5,-5.0178682387574565
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H]2CCOC2=O)C2(CC[NH2+]CC2)C1,C39660844_decoy,TRY1,Decoy,0,-7.45178,-4.99,-2.75,-4.960843966096885
CC(C)(CNC(=O)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2)N1CCOCC1,C39669586_decoy,TRY1,Decoy,0,-8.72401,-6.31,-2.27,-6.77259268906129
CCC[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(C)n(C)n2)CC12CC[NH2+]CC2,C39673906_decoy,TRY1,Decoy,0,-8.91756,-6.16,-1.92,-6.123068910713773
C#Cc1cccc(NC(=O)C(=O)NCc2ccnc(N3CC[NH+](C)CC3)c2)c1,C41491199_decoy,TRY1,Decoy,0,-9.04096,-8.35,-1.83,-7.434791093948663
C[C@@]1(C(=O)NCCCn2cc[nH+]c2)Oc2ccc(Cl)cc2NC1=O,C41550192_decoy,TRY1,Decoy,0,-8.61529,-5.12,-0.72,-5.6367766487542985
C[C@@H](C(=O)Nc1cccc2ncccc12)[NH+]1CCC(NS(C)(=O)=O)CC1,C42569394_decoy,TRY1,Decoy,0,-8.10383,-7.21,-1.18,-5.4728923179503095
CCC/[NH+]=C(\N)SCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1,C29494660_decoy,TRY1,Decoy,0,-7.9172,-4.45,-1.54,-5.743315248205054
C[C@H]1CCC(=O)N1c1ccc(N2CCC(N3CCO[C@H](CC[NH3+])C3)CC2)cc1,C43102961_decoy,TRY1,Decoy,0,-8.98427,-5.95,-1.47,-5.289240652451427
Cn1c(CCC(N)=O)nn(C[NH+](C)Cc2ccccc2C(F)(F)F)c1=S,C43595477_decoy,TRY1,Decoy,0,-5.77565,-6.94,-3.37,-6.563621995891348
COc1ccc([C@H]2[NH2+][C@H](C(=O)[O-])CS2)cc1C[NH+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C43604263_decoy,TRY1,Decoy,0,-9.33242,-6.2,-3.02,-5.735989033908679
C[NH+](CC(=O)NC(=O)N[C@H]1CCS(=O)(=O)C1)Cc1ccc(F)c(F)c1,C44438316_decoy,TRY1,Decoy,0,-7.60138,-5.81,-3.43,-5.026140287633473
O=C(CNC(=O)c1ccc(Br)s1)NCCn1cc[nH+]c1,C48623931_decoy,TRY1,Decoy,0,-8.07535,-4.95,-0.83,-4.89544076331333
COc1cc(OC)c(NC(=O)C(=O)NC2CC[NH+](C)CC2)cc1Cl,C48773781_decoy,TRY1,Decoy,0,-7.63154,-5.62,-2.17,-5.43181677195801
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCc2ccsc2)[NH+](C)C)cc1,C49504479_decoy,TRY1,Decoy,0,-8.9792,-6.68,-1.52,-7.173204827211538
O=C(NCC[NH+]1CCN(c2ccc(F)cc2)CC1)C(=O)NCc1ccsc1,C49512304_decoy,TRY1,Decoy,0,-9.35493,-7.46,-2.18,-6.345206055819356
Cc1ccc([C@H]2c3ccc(O)cc3Oc3nc[n+](CCCN4CCOCC4)c(N)c32)cc1,C49748055_decoy,TRY1,Decoy,0,-7.70676,-6.73,-1.08,-5.861545189523796
C[NH+](C)CCCN/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O,C19996424_decoy,TRY1,Decoy,0,-8.52338,-5.49,-0.61,-5.608174030965424
C[NH+](C)CCN/C=C1\C(=O)NC(=S)N(c2cccc(Cl)c2)C1=O,C02592387_decoy,TRY1,Decoy,0,-8.20505,-5.88,-0.48,-6.11983529797308
CN(CC[C@H]([NH3+])c1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1,C53940234_decoy,TRY1,Decoy,0,-8.3411,-4.74,-1.89,-5.61214443829341
COCCN(CC[C@H]([NH3+])c1ccc(Br)cc1)[C@H](C)COC,C53971775_decoy,TRY1,Decoy,0,-7.97731,-5.51,-2.58,-6.980141313973826
C[C@H](C(=O)Nc1c(F)cccc1F)[NH+]1CCC(NS(C)(=O)=O)CC1,C54209286_decoy,TRY1,Decoy,0,-7.55408,-5.62,-0.73,-4.929915196599487
C[NH2+]CCNS(=O)(=O)c1cc(OC)c(OC)cc1Br,C54244683_decoy,TRY1,Decoy,0,-7.64517,-5.33,-3.1,-8.169298022138658
CNC(=O)C[NH+]1CCC(NC(=O)CSCc2ccc(C#N)cc2)CC1,C48104170_decoy,TRY1,Decoy,0,-8.87315,-6.52,-1.31,-6.841042061092884
C[C@H](OC(=O)C1=C[C@H](S(N)(=O)=O)SC1)C(=O)C1=c2ccccc2=[NH+]C1,C64003045_decoy,TRY1,Decoy,0,-8.88195,-7.92,-3.31,-7.361668772416035
O=C(CC1=c2ccccc2=[NH+]C1)N1CCC(CN2CC(CO)=NN2)CC1,C64058190_decoy,TRY1,Decoy,0,-7.00199,-6.46,-2.04,-4.800460083745396
O=C1C(=O)[C@H](NCc2ccncc2)[C@H]1NCCC1=c2ccccc2=[NH+]C1,C64435968_decoy,TRY1,Decoy,0,-8.45141,-7.74,-1.09,-6.360408257150233
[NH3+]CCS[C@H]1CC(=O)N(c2ccc(Cl)cc2C(F)(F)F)C1=O,C16900125_decoy,TRY1,Decoy,0,-8.49345,-6.34,-1.17,-7.451568951753988
[NH3+]CCS[C@H]1CC(=O)N(c2ccc(Cl)c(C(F)(F)F)c2)C1=O,C16900147_decoy,TRY1,Decoy,0,-8.73451,-6.52,-1.34,-7.466223670074788
C[NH+]1CCN(CCCNC(=O)c2n[nH]c(C3CC3)c2Br)CC1,C65105346_decoy,TRY1,Decoy,0,-8.38929,-6.31,-0.24,-5.685692244361409
CCn1cnnc1CCNC(=O)[C@@]12CNC[C@@H]1C[NH+](C1CCCC1)C2,C65403368_decoy,TRY1,Decoy,0,-8.32891,-4.27,-2.16,-4.793121671473522
Cc1nn(C)c(N2CCOCC2)c1C[NH2+][C@@H](C)C(=O)NC1CCCC1,C65531272_decoy,TRY1,Decoy,0,-7.68537,-5.08,-2.14,-5.042377389168649
CC(C)c1nn(C[NH+]2CCC[C@H](CCC(N)=O)C2)c(=S)n1C1CC1,C66080320_decoy,TRY1,Decoy,0,-7.98553,-4.84,-2.28,-5.164105231859216
CC(=O)N[C@H](CC(=O)NC[C@H](c1cccs1)[NH+](C)C)c1c(F)cccc1F,C66592532_decoy,TRY1,Decoy,0,-8.38424,-4.83,-2.54,-5.923347999918109
CC(=O)N[C@H](CC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1c(F)cccc1F,C67104887_decoy,TRY1,Decoy,0,-7.23432,-6.28,-3.47,-5.625348032292668
CC(=O)Nc1ccc(C[NH2+]C[C@@]2(N3CCOCC3)CCSC2)cc1,C67218600_decoy,TRY1,Decoy,0,-6.75557,-4.81,-1.92,-4.555587882677921
O=C(NC1CC[NH+](C[C@@H](O)COC[C@@H]2CCCO2)CC1)c1ccsc1,C67460513_decoy,TRY1,Decoy,0,-8.01742,-5.56,-0.53,-5.415571871571189
Cn1cc(CN2C(=O)N[C@](Cc3ccc(F)cc3)(C3CC[NH2+]CC3)C2=O)cn1,C67541424_decoy,TRY1,Decoy,0,-7.25282,-5.14,-0.98,-4.634600072831455
COc1ccc(/C(O)=C2/C(=O)C(=O)N(CC[NH2+]CCO)[C@@H]2c2cccnc2)cc1,C03766488_decoy,TRY1,Decoy,0,-8.90552,-5.83,-2.66,-6.031598571218861
CC[NH+](CC(=O)NC(C)C)CC(=O)NN1C(=O)N[C@@](CC)(c2ccccc2)C1=O,C07682429_decoy,TRY1,Decoy,0,-7.12153,-6.17,-2.82,-7.81961867611554
NC(=O)c1ccsc1NC(=O)C[NH+](Cc1ccco1)[C@H]1CCS(=O)(=O)C1,C10834305_decoy,TRY1,Decoy,0,-7.54773,-6.78,-1.36,-6.347716883526229
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@H](c2cccn2C)[NH+]2CCOCC2)cc1,C11898693_decoy,TRY1,Decoy,0,-7.26468,-6.82,-3.47,-5.6606271302404085
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](c2cccn2C)[NH+]2CCOCC2)cc1,C11898694_decoy,TRY1,Decoy,0,-9.07915,-6.22,-2.31,-5.942873160310131
Cc1cc([C@@H](O)C[NH2+][C@@H](C)CCn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1O,C13207394_decoy,TRY1,Decoy,0,-7.36283,-7.82,-1.96,-6.855754841099924
NS(=O)(=O)c1cc(S(=O)(=O)c2ccc(C[NH2+]Cc3ccccn3)cc2)cs1,C13727897_decoy,TRY1,Decoy,0,-9.3793,-7.12,-2.89,-6.082594461949851
COc1cccc(C[NH2+]C2CCC(n3cc(C(=O)NCC(C)C)nn3)CC2)c1O,C14999939_decoy,TRY1,Decoy,0,-8.22542,-7.35,-1.33,-7.646977773450008
C#CCOc1ccc(C(=O)N[C@@H]2C[NH+](Cc3ccc(CO)o3)CCC[C@H]2O)cc1,C15672078_decoy,TRY1,Decoy,0,-7.79048,-6.07,-1.99,-4.917373151156704
Cc1cc(C)c(NC(=O)C[NH+](C)[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c(C)c1,C24378635_decoy,TRY1,Decoy,0,-6.88558,-6.52,-1.54,-6.123952166613056
CC(C)CNC(=O)c1ccccc1NC(=O)C[NH+]1CCC(NC(=O)C2CC2)CC1,C30285210_decoy,TRY1,Decoy,0,-7.13389,-7.14,-1.2,-6.896023108189087
CCC[NH+]1CCN(CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OCC)CC1,C23095775_decoy,TRY1,Decoy,0,-9.11974,-5.66,-1.93,-6.846795373479228
C/C=C(/C)C(=O)O[C@H]1CC[NH+]2CC=C(COC(=O)[C@@](O)([C@@H](C)O)C(C)(C)O)[C@H]12,C33831575_decoy,TRY1,Decoy,0,-7.79082,-6.26,-1.71,-6.660824993409575
C/C=C(/C)C(=O)O[C@@H]1CC[NH+]2CC=C(COC(=O)[C@@](O)([C@@H](C)O)C(C)(C)O)[C@H]12,C08628460_decoy,TRY1,Decoy,0,-8.09356,-5.33,-2.42,-5.779046926592364
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC2CC[NH+](C(C)C)CC2)cc1,C38730280_decoy,TRY1,Decoy,0,-9.16692,-7.55,-2.3,-6.744436552724664
Cc1cc(C(=O)N2C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)nn1C,C39693586_decoy,TRY1,Decoy,0,-8.28468,-5.92,-1.98,-5.642156421033759
CC[C@@H](CO)[NH2+]Cc1ccc(OC[C@H](O)c2ccc3c(c2)n(C)c(=O)n3C)cc1,C40721995_decoy,TRY1,Decoy,0,-7.84133,-7.26,-2.14,-5.8113085590940665
Cn1c(NCC[NH2+][C@H](CCO)CCc2ccc([N+](=O)[O-])cc2)cc(=O)n(C)c1=O,C45202005_decoy,TRY1,Decoy,0,-6.96257,-6.72,-2.66,-5.070097412623071
CC(C)[NH+](C)Cc1ccccc1CNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1,C45790659_decoy,TRY1,Decoy,0,-8.36476,-6.93,-3.5,-6.041046933842689
CC(C)COC[C@H](O)CNC(=O)NCC[NH+]1CCN(c2ccc(F)cc2)CC1,C46846071_decoy,TRY1,Decoy,0,-8.60779,-6.57,-3.33,-7.720187405109473
Cc1occc1C(=O)Nc1cc(NC(=O)NCCCn2cc[nH+]c2C)ccc1F,C47519653_decoy,TRY1,Decoy,0,-7.51865,-7.21,-2.51,-5.45545088379689
C[NH+](C)[C@@H](CNC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(F)c1,C49798374_decoy,TRY1,Decoy,0,-8.20013,-6.39,-2.99,-5.751344772482508
COCCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(NC(=O)c2scnc2C)CC1,C51099642_decoy,TRY1,Decoy,0,-8.62018,-6.67,-3.25,-5.972053383474762
CCCNC(=O)c1ccc(NC(=O)C(=O)NC[C@H](C)[NH+](CC)CC)cc1Cl,C54850703_decoy,TRY1,Decoy,0,-8.4945,-5.66,-3.5,-6.735373377141809
[H]/N=C1\S/C(=C/c2ccc(OCC[NH+]3CCCCC3)c(OC)c2)C(=O)N1c1nonc1N,C08780840_decoy,TRY1,Decoy,0,-8.77061,-8.09,-1.74,-10.530281529926398
C[NH+](C)[C@@H](CNC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccc(F)cc1,C56950364_decoy,TRY1,Decoy,0,-6.96256,-7.68,-3.77,-5.936242157382146
CCCCNC(=O)CSc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccccc1Cl,C33692116_decoy,TRY1,Decoy,0,-10.9374,-7.94,-1.26,-9.54116251108328
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NCc1ccccc1C[NH+]1CCCCC1,C58916179_decoy,TRY1,Decoy,0,-7.24334,-8.31,-2.24,-6.576301620710195
[NH2+]=C(N/N=C/c1ccc(O)cc1)S[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O,C04100071_decoy1,TRY1,Decoy,0,-6.23523,-8.34,,-6.141293074587456
NC(=O)[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)COC(=O)CC1=c2ccccc2=[NH+]C1,C63230165_decoy,TRY1,Decoy,0,-8.29025,-8.22,-1.26,-7.701433723683
CC[NH+]1CCN([C@H](C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]23)CC1,C63704244_decoy,TRY1,Decoy,0,-8.75304,-7.19,-0.64,-7.060787303051551
CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OCc1nc(N)nc(N(C)C)n1,C64170253_decoy,TRY1,Decoy,0,-8.15637,-7.74,-2.09,-7.804582629922636
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cn2nc(C)cc2C)[NH+]2CCCC2)cc1,C64237625_decoy,TRY1,Decoy,0,-8.40113,-6.44,-2.31,-5.95320798008693
CCCCN1C(=O)N=C([O-])[C@@H](N(C)C(=O)CCCC2=c3ccccc3=[NH+]C2)[C@H]1[NH3+],C64697308_decoy,TRY1,Decoy,0,-7.47447,-7.32,-3.84,-5.784299322200306
Cc1cc2occ(CC(=O)NNC(=O)NCCCn3cc[nH+]c3)c2cc1C(C)C,C64885639_decoy,TRY1,Decoy,0,-7.89295,-6.46,-4.2,-5.585856338455173
CC(C)OCc1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)oc2ccccc12,C64886640_decoy,TRY1,Decoy,0,-7.8247,-7.25,-3.17,-6.500469817555175
O=C(CCC(=O)c1ccc2c(c1)CCCC2)NNC(=O)NCCCn1cc[nH+]c1,C64886827_decoy,TRY1,Decoy,0,-8.6644,-6.55,-3.08,-5.9780832671033135
CC(C)c1ccccc1NC(=S)NNC(=O)C[NH+](C)[C@@H]1CCS(=O)(=O)C1,C66122654_decoy,TRY1,Decoy,0,-8.05709,-6.04,-1.29,-6.529618269170359
COCCOc1ccccc1NC(=O)NC[C@H](O)C[NH+]1CCc2ccccc2C1,C66403456_decoy,TRY1,Decoy,0,-7.26385,-6.68,-1.7,-6.702634615634185
Cc1cc(NC(=O)C(=O)NCc2cc[nH+]c(N(C)C)c2)ccc1C(=O)NC(C)C,C66719178_decoy,TRY1,Decoy,0,-8.3901,-7.54,-2.58,-6.272848258339144
CC[NH+]1CCC[C@@H](NC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1,C66986922_decoy,TRY1,Decoy,0,-8.81078,-7.09,-2.59,-5.920794694524026
CC(C)=CC[NH+]1CCC(NC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)CC1,C67000044_decoy,TRY1,Decoy,0,-9.15863,-6.07,-1.45,-5.595184921618399
C[NH+](C)[C@H](CNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)c1ccsc1,C67160995_decoy,TRY1,Decoy,0,-10.1164,-5.88,-2.55,-6.254920626983853
CNC(=O)C[NH+]1CCC(NC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)CC1,C67390555_decoy,TRY1,Decoy,0,-8.04384,-5.67,-2.35,-5.518221996235174
COCCNC(=O)NC(=O)[C@H](C)[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67401185_decoy,TRY1,Decoy,0,-8.42982,-7.02,-1.41,-6.492387635397797
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCNS(=O)(=O)CC)c2C1,C67524548_decoy,TRY1,Decoy,0,-9.1307,-5.32,-3.0,-5.555499778173222
[NH2+]=C(N/N=C/c1ccc(O)cc1)S[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O,C04100071_decoy2,TRY1,Decoy,0,-7.37929,-6.51,,-6.147395266343691
Cc1ccn2cc(CNC(=O)NC[C@@H](O)COc3ccc4c(c3)OCO4)[nH+]c2c1,C67605384_decoy,TRY1,Decoy,0,-8.76918,-7.16,-1.47,-5.1754783644377085
CC[NH+]1CCN(CCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@H]32)CC1,C67613152_decoy,TRY1,Decoy,0,-8.68118,-6.36,-1.14,-7.0793192144590105
CC[NH+]1CCN([C@@H](C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67613213_decoy,TRY1,Decoy,0,-8.61464,-6.35,-0.98,-6.574683952078469
CC[NH+](CC)CCCNC(=O)c1c(O)n2c3c(cc(F)cc3c1=O)CC[C@H]2C,C06076034_decoy,TRY1,Decoy,0,-8.44003,-6.43,-3.69,-5.494094583202959
C[NH+](C)CCN([C@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(N)cc1,C11804962_decoy,TRY1,Decoy,0,-7.08723,-6.72,-1.12,-9.105718671879496
CC(C)CCN1C(=O)N(CC(N)=O)C(=O)C12CC[NH+]([C@@H]1CCSC1)CC2,C14537912_decoy,TRY1,Decoy,0,-10.5095,-4.95,-1.36,-5.883708412186304
COc1ccc(-c2ncc(CN3CC[C@@H]([NH+]4CCC(O)CC4)[C@H](O)C3)cn2)cc1,C20204123_decoy,TRY1,Decoy,0,-9.25257,-5.29,-2.13,-5.081193730720129
C[NH+](Cc1c(F)cccc1Cl)Cn1nc(C2CC2)n(CCC(N)=O)c1=S,C24374668_decoy,TRY1,Decoy,0,-7.90352,-6.2,-2.56,-7.299535702002716
NC(=O)CCS(=O)(=O)CCN1CC[NH+](Cc2ccc(Cl)s2)CC1,C25702104_decoy,TRY1,Decoy,0,-9.40002,-4.86,-2.17,-5.408645993155476
CC(C)CN(C(=O)CS/C(N)=[NH+]/C(C)C)[C@H]1CCS(=O)(=O)C1,C29554221_decoy,TRY1,Decoy,0,-7.11979,-5.19,-1.76,-6.487104364977705
COc1ccc([C@H]2c3c(nc[n+](CCCO)c3N)Oc3ccc4ccccc4c32)cc1,C05255067_decoy,TRY1,Decoy,0,-7.58446,-5.2,-2.54,-4.6935534946529645
O=c1c(O)c(NC2CC2)c1=[N+]1CCC(CNc2nccc3nc(C(F)(F)F)ccc23)CC1,C35632617_decoy,TRY1,Decoy,0,-8.62766,-7.2,-2.42,-5.443612448008988
CCCC[n+]1c(N)n(C[C@H](O)c2ccc(Br)cc2)c2ccccc21,C01815132_decoy,TRY1,Decoy,0,-5.93841,-5.14,-1.92,-4.544508701229904
CCCCC[n+]1c(N)n(C[C@@H](O)COc2ccccc2C)c2ccccc21,C01758652_decoy,TRY1,Decoy,0,-7.67966,-6.67,-1.62,-6.759680964626155
COc1ccc(-c2oc3nc[n+](CCO)c(N)c3c2-c2ccc(OC)cc2)cc1,C00894753_decoy,TRY1,Decoy,0,-7.30311,-8.05,-3.05,-7.569438048211664
CCC(=O)N[C@H](CCSC)C(=O)N1CCC2(CC1)[NH2+]CCC1=NC=N[C@@H]12,C39035110_decoy,TRY1,Decoy,0,-8.51094,-6.3,-1.91,-5.5540454045100045
CCOCCCNC(=O)[C@@H]1CN(C(=O)CCSC)CC12CC[NH2+]CC2,C39604433_decoy,TRY1,Decoy,0,-8.35088,-4.73,-1.22,-5.630050376210714
CC[C@H](C)CNC(=O)[C@@H]1CN(C(=O)c2cncn2C)CC12CC[NH2+]CC2,C39606765_decoy,TRY1,Decoy,0,-8.40655,-6.37,-3.06,-6.32157004206648
CCCOCCNC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39607816_decoy,TRY1,Decoy,0,-7.86697,-5.47,-1.63,-5.916604005344401
O=C(NCCCN1CCOCC1)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39624955_decoy,TRY1,Decoy,0,-8.81488,-6.33,-3.34,-6.168048490956128
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCN3CCOCC3)C3(CC[NH2+]CC3)C2)c(C)c1,C39625870_decoy,TRY1,Decoy,0,-7.95012,-5.71,-1.69,-5.94698899243593
CCSCCNC(=O)[C@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2,C39656514_decoy,TRY1,Decoy,0,-9.71621,-5.99,-1.8,-6.593583863126935
CC(C)(CNC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2)N1CCOCC1,C39669666_decoy,TRY1,Decoy,0,-9.10042,-6.25,-1.29,-6.174938927639581
CSCCC(=O)N1C[C@@H](C(=O)NCC(=O)N(C)C)C2(CC[NH2+]CC2)C1,C39680611_decoy,TRY1,Decoy,0,-7.54719,-5.49,-1.65,-5.573333398290685
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NC2CCN(C(C)=O)CC2)C2(CC[NH2+]CC2)C1,C39687892_decoy,TRY1,Decoy,0,-8.30009,-6.2,-2.65,-6.359319807821887
C[C@H](Cn1cc[nH+]c1)NC(=O)NC[C@]1(N2CCOCC2)CCSC1,C41487790_decoy,TRY1,Decoy,0,-9.19904,-4.76,-0.77,-5.5237186914215535
CN(C)c1ccc(CNC(=O)C(=O)Nc2cccc3cccnc23)c[nH+]1,C41638323_decoy,TRY1,Decoy,0,-7.93167,-7.81,-1.54,-6.436655794067038
C[C@@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)C1,C41725934_decoy,TRY1,Decoy,0,-7.82632,-6.94,-3.89,-5.299742988783175
CCCN(CC(=O)N(C)C)[C@H](C[NH3+])c1cc(Br)cs1,C43287189_decoy,TRY1,Decoy,0,-7.46909,-4.8,-1.79,-5.244357727277188
CS(=O)(=O)NC1CC[NH+](C[C@@H](O)COc2ccc(F)cc2)CC1,C44892830_decoy,TRY1,Decoy,0,-8.27286,-5.06,-3.05,-5.164205807905253
Cn1cccc1[C@H](CNC(=O)C(=O)NCc1ccsc1)[NH+]1CCCC1,C49512800_decoy,TRY1,Decoy,0,-8.3145,-6.83,-1.22,-6.0869736132893735
COCCn1c(SCC(=O)N[C@H]2CCCCNC2=O)[nH+]c(C)c1C,C53722891_decoy,TRY1,Decoy,0,-8.8108,-6.3,-2.97,-5.540779968018224
CCC[NH2+]CCNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl,C54266591_decoy,TRY1,Decoy,0,-7.86604,-5.85,-4.61,-5.139357333578983
Cc1cccc(C)c1NC(=O)CN1CC[NH+](Cn2nc(C3CC3)[nH]c2=S)CC1,C29873189_decoy,TRY1,Decoy,0,-7.69853,-7.29,-1.42,-6.179489527269304
C[NH+](CC(=O)NCCNc1cccc(F)c1C#N)[C@@H]1CCS(=O)(=O)C1,C53469152_decoy,TRY1,Decoy,0,-6.50539,-6.69,-2.53,-8.841246697083813
C[NH+](CC(N)=O)CC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1,C46067137_decoy,TRY1,Decoy,0,-8.09846,-6.61,-1.32,-5.923971814561139
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/NCC[NH+]1CCCCC1,C19995842_decoy,TRY1,Decoy,0,-7.75199,-5.67,-0.96,-5.124223428825448
C=CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(CC(=O)N2CCCC2)CC1,C61050873_decoy,TRY1,Decoy,0,-7.69326,-6.99,-4.21,-6.242009977843201
CC[NH+](CC)CCN/C=C1\C(=O)NC(=O)N(c2ccccc2F)C1=O,C02306933_decoy,TRY1,Decoy,0,-7.60589,-5.23,-1.66,-5.050389273561136
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCCn1cc[nH+]c1,C61899278_decoy,TRY1,Decoy,0,-6.18189,-6.24,-1.52,-5.174458909232589
N#CCCNC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39774058_decoy,TRY1,Decoy,0,-7.48768,-7.13,-1.92,-7.076705014525619
Cc1noc(C)c1CNC(=O)C(=O)Nc1ccc(CC[NH+]2CCCC2)cc1,C63230102_decoy,TRY1,Decoy,0,-7.8581,-7.96,-1.82,-6.887748458368529
C[NH+](C)CC(C)(C)CNC(=O)C1CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1,C63802201_decoy,TRY1,Decoy,0,-7.42997,-4.73,-2.19,-5.071238446252546
O=C(NC1CC1)C1CC[NH+](C[C@@H](O)c2ccc3c(c2)OCCO3)CC1,C52863786_decoy,TRY1,Decoy,0,-8.1838,-5.41,-1.08,-5.532264481709743
CS(=O)(=O)c1ccc([C@H]2[C@@H](c3ccccc3)NC[NH+]2Cc2nc[nH]n2)cc1,C65398463_decoy,TRY1,Decoy,0,-7.32347,-5.79,-1.71,-5.590019642188297
CCN(C(C)=O)[C@@H]1CCN(c2nc(CC[NH3+])nc3sc(C)c(C)c23)C1,C65406477_decoy,TRY1,Decoy,0,-9.47898,-5.54,-2.43,-5.468203582784263
Cc1ccc(OC2(C(=O)N(C)Cc3cc(C4CC4)[nH]n3)CC[NH2+]CC2)cn1,C65436204_decoy,TRY1,Decoy,0,-7.67383,-5.56,-1.08,-5.728118810820992
CSc1cccc(NC(=O)C(=O)NCc2cccnc2N2CC[NH+](C)CC2)c1,C65588372_decoy,TRY1,Decoy,0,-8.27923,-6.91,-4.16,-5.78662929280833
CC[NH+]1CCN(CCNC(=O)C(=O)Nc2ccc(SC)nc2)CC1,C66208841_decoy,TRY1,Decoy,0,-9.11141,-6.06,-1.19,-6.270774012556088
CC(=O)N[C@H](CC(=O)NCC[NH+](C(C)C)C(C)C)c1c(F)cccc1F,C66602358_decoy,TRY1,Decoy,0,-7.59968,-5.77,-3.77,-5.5742142851958425
CC(C)[C@@H](CNC(=O)[C@H](C)NC(=O)C1CCOCC1)N1CC[NH+](C)CC1,C66932558_decoy,TRY1,Decoy,0,-7.81473,-5.27,-1.51,-4.859127529942083
Cc1nn(CCO)c(C)c1CNCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]c1,C67188747_decoy,TRY1,Decoy,0,-7.96298,-6.53,-1.15,-5.203191924904103
Cc1nn(CCO)c(C)c1CNCc1ccc(N2CCO[C@H](C)C2)[nH+]c1,C67188814_decoy,TRY1,Decoy,0,-7.97195,-6.08,-1.51,-4.959447471938385
CCCCn1c(N)c(N(CC)C(=O)C[NH+]2CCn3cccc3[C@H]2C)c(=O)[nH]c1=O,C15417272_decoy,TRY1,Decoy,0,-7.37326,-6.14,-1.88,-5.224294386594281
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3ccc(OC)cc3)C[NH+]12,C15708415_decoy,TRY1,Decoy,0,-7.63997,-4.52,-1.46,-4.850406370396301
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3ccccc3)C[NH+]12,C15708646_decoy,TRY1,Decoy,0,-6.30477,-7.3,-2.77,-5.892797894857788
Cc1cccnc1CCNCc1cccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c1,C19939621_decoy,TRY1,Decoy,0,-8.18498,-6.24,-2.43,-5.51859327594327
CC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H](c2cccn2C)N2CC[NH+](C)CC2)c1,C21157202_decoy,TRY1,Decoy,0,-9.12975,-6.39,-3.49,-6.880512245025
C[NH+](C)[C@@H](CNCC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)c1ccccc1,C22037631_decoy,TRY1,Decoy,0,-8.65966,-7.89,-3.11,-9.398407383268449
CC(C)Cn1c(N)c(C(=O)C[NH+](C)Cc2c(F)cccc2Cl)c(=O)[nH]c1=O,C28957830_decoy,TRY1,Decoy,0,-7.28629,-6.64,-1.39,-11.19840190761848
COC(=O)c1cc(S(=O)(=O)NC[C@H]([NH3+])CC(C)C)c(Br)s1,C36298847_decoy,TRY1,Decoy,0,-8.25986,-5.72,-4.36,-6.642233168286203
O=[N+]([O-])c1ccc(OC[C@@H](O)C[NH2+]CCNc2nccc(C(F)(F)F)n2)cc1,C04299474_decoy,TRY1,Decoy,0,-6.42518,-7.03,-2.95,-5.652795350043905
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)c(C)c1,C39601939_decoy,TRY1,Decoy,0,-7.23791,-5.43,-1.69,-5.409301389203128
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2ccncc2)CC12CC[NH2+]CC2,C39631769_decoy,TRY1,Decoy,0,-8.49585,-4.8,-1.05,-5.348477771094813
CCOC(=O)C1=C(CS[C@@H]2NN=C(C3=c4ccccc4=[NH+]C3)O2)NC(=O)N[C@@H]1C,C39760600_decoy,TRY1,Decoy,0,-8.35498,-7.67,-2.88,-6.9355793959118754
Cc1ccccc1C(=O)NNc1ncnc(NCC[NH+]2CCCCC2)c1[N+](=O)[O-],C40622683_decoy,TRY1,Decoy,0,-7.91037,-5.66,-2.61,-5.47078054386051
CC(=O)Nc1ccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2[N+](=O)[O-])cc1,C40622817_decoy,TRY1,Decoy,0,-6.89609,-6.97,-1.32,-5.539900530569011
COC[C@H](C)Nc1ncnc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1N,C40799420_decoy,TRY1,Decoy,0,-8.60429,-7.17,-1.42,-6.60668707024481
CC(C)C[C@H](CNC(=O)C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2)[NH+](C)C,C41322720_decoy,TRY1,Decoy,0,-10.2331,-5.85,-3.47,-5.637790846178024
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)C(=O)NC[C@@H](C)[NH+]3CCCC3)c2)n1,C41597034_decoy,TRY1,Decoy,0,-8.87425,-6.9,-2.29,-7.954358214119339
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NCc2ccc[nH+]c2N(C)C)cc1,C41638992_decoy,TRY1,Decoy,0,-7.49677,-5.82,-0.66,-5.539402764278103
C[NH+](C)CC(=O)Nc1cccc(CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1,C41639863_decoy,TRY1,Decoy,0,-7.8447,-7.17,-4.0,-6.127325078883365
CC(C)[NH+](C)Cc1ccccc1CNC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1,C45790661_decoy,TRY1,Decoy,0,-7.8763,-7.98,-1.85,-6.010190194098921
CC(C)COC[C@@H](O)CNC(=O)NCC[NH+]1CCN(c2ccc(F)cc2)CC1,C46846073_decoy,TRY1,Decoy,0,-8.03242,-5.86,-1.93,-6.149201032198631
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1,C48768553_decoy,TRY1,Decoy,0,-7.27802,-7.01,-3.43,-5.620164282243017
CCS(=O)(=O)NCCCNC(=O)NC[C@H](c1ccc(C)cc1)[NH+]1CCCC1,C51714556_decoy,TRY1,Decoy,0,-8.18401,-5.05,-1.82,-5.550922009905743
CCN(CC)S(=O)(=O)c1ccc(CCNc2cc(N)[nH+]c3nccnc23)cc1,C01701951_decoy,TRY1,Decoy,0,-8.59476,-6.93,-2.05,-9.55296931557702
C[NH+](C)[C@@H](CNC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(F)c1,C54042966_decoy,TRY1,Decoy,0,-7.50038,-7.34,-2.71,-5.857908949366597
CCc1ccc([C@H](CNC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[NH+](C)C)cc1,C54044257_decoy,TRY1,Decoy,0,-8.80999,-6.61,-1.41,-6.370949185848587
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NC2CC[NH+](CC(C)C)CC2)cc1,C54580281_decoy,TRY1,Decoy,0,-9.11649,-4.91,-2.81,-4.915877726592706
CCN(CC)c1ccc(NC(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c[nH+]1,C48173750_decoy,TRY1,Decoy,0,-8.27353,-5.83,-2.02,-6.027440420977351
COc1cc([N+](=O)[O-])ccc1-n1nc(C)c(/C=N/NC(=O)[C@H]([NH3+])CC(C)C)c1C,C59160655_decoy,TRY1,Decoy,0,-6.72927,-5.09,-2.7,-4.526313077312901
CC[NH+](CC)CCn1cc(NC(=O)CCc2c(C)nc3nc(N)nn3c2C)cn1,C63095926_decoy,TRY1,Decoy,0,-7.5223,-6.89,-1.77,-6.442133344415281
Cc1ccc2[nH+]c(CNC(=O)NC[C@H](O)COc3ccc([N+](=O)[O-])cc3)cn2c1,C63304139_decoy,TRY1,Decoy,0,-7.8827,-6.64,-1.37,-6.625688250295044
CSc1nnc(NC(=O)CS[C@@H]2NN[C@@H](c3ccco3)[NH+]2C2CC2)s1,C39977102_decoy,TRY1,Decoy,0,-8.95971,-5.69,-2.04,-5.582830965789912
COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)NCCCn2cc[nH+]c2)c1,C64375721_decoy,TRY1,Decoy,0,-7.76587,-8.42,-2.23,-7.665472126229952
COc1cc(C)c(S(=O)(=O)NNC(=O)NCCCn2cc[nH+]c2)cc1OC,C64375778_decoy,TRY1,Decoy,0,-7.12716,-6.91,-3.41,-6.049102930425058
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1ccccc1C(=O)c1cccs1,C64886546_decoy,TRY1,Decoy,0,-8.05021,-6.71,-3.69,-7.094313359992968
C=CCOc1ccc(/C=C/C(=O)NNC(=O)NCCCn2cc[nH+]c2)cc1OC,C64886865_decoy,TRY1,Decoy,0,-7.86852,-6.95,-2.4,-5.67501027083535
CC(C)c1ccccc1NC(=S)NNC(=O)C[NH+](C)[C@H]1CCS(=O)(=O)C1,C66122655_decoy,TRY1,Decoy,0,-8.24869,-6.8,-1.65,-5.791850664649783
CC[NH+]1CCC(NC(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1,C66360829_decoy,TRY1,Decoy,0,-7.59072,-6.54,-1.08,-5.866041388891083
COc1ccc([C@H](CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)[NH+](C)C)cc1,C66402987_decoy,TRY1,Decoy,0,-7.21444,-7.36,-0.89,-6.562720945445855
O=C(CCc1ccc(OC(F)(F)F)cc1)NNC(=O)NCCCn1cc[nH+]c1,C66632378_decoy,TRY1,Decoy,0,-6.4277,-7.2,-2.02,-5.528736802380561
CC[NH+]1CCC(NC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1,C66986897_decoy,TRY1,Decoy,0,-7.65625,-6.61,-4.4,-5.5215848309766695
C[NH+](C)[C@@H](CNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)c1ccsc1,C67160996_decoy,TRY1,Decoy,0,-9.4859,-5.38,-2.17,-5.593380393179623
CC1CC[NH+](CCCCNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67165244_decoy,TRY1,Decoy,0,-9.38018,-5.63,-1.88,-5.422043021433799
O=C(NC[C@@H](O)c1ccccc1F)C(=O)Nc1ccc(CC[NH+]2CCCC2)cc1,C67346446_decoy,TRY1,Decoy,0,-8.89528,-7.51,-1.68,-6.696325908830004
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2ccc(-c3cc(=O)[nH]c(C)n3)cc2)C1,C67393262_decoy,TRY1,Decoy,0,-8.0394,-5.19,-1.68,-5.385587009853731
COCCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67401186_decoy,TRY1,Decoy,0,-8.47475,-6.39,-2.23,-6.232213653699795
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCCNS(C)(=O)=O)c2C1,C67524673_decoy,TRY1,Decoy,0,-8.84191,-5.24,-2.27,-5.551491960155608
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2ccc(-c3nnnn3C3CC3)cc2)CC1,C67539147_decoy,TRY1,Decoy,0,-8.46666,-7.8,-0.71,-6.412843343922058
CCC[NH+]1Cc2cccc(NC(=O)C(=O)NCCCNS(=O)(=O)CC)c2C1,C67562388_decoy,TRY1,Decoy,0,-8.16234,-6.95,-2.25,-6.58846661921264
CC[NH+]1CCN([C@H](C)CNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC1,C67613220_decoy,TRY1,Decoy,0,-8.71353,-5.71,-2.19,-5.635572491643449
Cc1cc(C)c2[nH]c(=O)c(CN(CCO)C(=S)NCCC[NH+](C)C)cc2c1,C04132708_decoy,TRY1,Decoy,0,-7.41286,-6.26,-4.99,-5.192419537263682
OCC[NH+](CCO)C[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1,C06940247_decoy,TRY1,Decoy,0,-8.03142,-5.33,-1.36,-6.738084493844171
C[C@H](NC(=O)c1ccccc1Cl)C(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1,C14847254_decoy,TRY1,Decoy,0,-8.5855,-7.74,-1.81,-6.50413465539214
C=CCNC(=O)NC(=O)C[NH+](C)CC(=O)Nc1ccccc1Br,C16633220_decoy,TRY1,Decoy,0,-6.74821,-6.9,-2.24,-7.098312685987367
O=C(NCCN1CC[NH2+]CC1)/C(=C/c1ccccc1Cl)NC(=O)c1ccccc1Cl,C26803963_decoy,TRY1,Decoy,0,-9.97272,-5.79,-1.17,-6.525866685127425
CCOc1ccccc1NC(=O)c1sc(=S)n(CCC[NH+](CC)CC)c1N,C32952264_decoy,TRY1,Decoy,0,-7.78006,-5.99,-2.67,-5.472574851741098
CC[C@@H](C)CC(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39597910_decoy,TRY1,Decoy,0,-8.3931,-8.34,-1.67,-8.619173115656602
CC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(OC)cc23)C2(CC[NH2+]CC2)C1,C39599057_decoy,TRY1,Decoy,0,-8.47178,-7.49,-2.91,-7.065009906344442
CC(C)C(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631193_decoy,TRY1,Decoy,0,-9.46095,-6.66,-1.84,-7.654046904952328
CC(C)[NH+](C)Cc1ccccc1CNC(=O)NC[C@H](O)COc1ccccc1,C41491883_decoy,TRY1,Decoy,0,-6.90534,-6.63,-2.52,-5.416206705657241
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NC[C@H](C)[NH+]2CCC[C@H](C)C2)c1,C41654322_decoy,TRY1,Decoy,0,-7.98808,-6.74,-2.96,-5.98351265937565
CC(=O)Nc1cc(NC(=O)C(=O)NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1F,C41728385_decoy,TRY1,Decoy,0,-8.06119,-7.14,-2.6,-6.097410397602424
C[C@@H](NC(=O)NCc1cccc(NC(=O)C[NH+](C)C)c1)c1ccc(F)cc1F,C42804191_decoy,TRY1,Decoy,0,-8.4073,-7.19,-2.44,-6.1355674300386
CC(C)OCCCNC(=O)[C@H]1C[NH2+]C[C@@H]1C(=O)NCc1cc(F)ccc1F,C43222980_decoy,TRY1,Decoy,0,-8.17085,-6.73,-1.89,-6.2083270323327415
CSCCNC(=O)[C@H]1C[NH2+]C[C@@H]1C(=O)NCc1ccccc1C(F)(F)F,C43223173_decoy,TRY1,Decoy,0,-8.77489,-6.76,-1.51,-5.822211019837783
COCCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]C1CCC1,C43547995_decoy,TRY1,Decoy,0,-9.28035,-5.71,-3.44,-5.9522521469996335
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CC[NH+](CC(C)C)CC2)c1C,C45463596_decoy,TRY1,Decoy,0,-7.54405,-7.54,-3.4,-5.86470866543174
CCc1ccc([C@@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)[NH+](C)C)cc1,C49799276_decoy,TRY1,Decoy,0,-8.52057,-7.1,-1.14,-6.313388612232097
CCC[C@@H](C)NC(=O)[C@@H]1CCC[NH+](CC(=O)NC(=O)Nc2ccc(C)cc2)C1,C51051602_decoy,TRY1,Decoy,0,-7.89075,-8.23,-2.84,-7.078876434957876
CCCCNC(=O)NC(=O)C[NH+]1CC=C(c2c[nH]c3ccc(OC)cc23)CC1,C53073496_decoy,TRY1,Decoy,0,-8.11495,-5.89,-1.73,-5.019349014059417
CC[NH+]1CCN(c2ccc(N[C@@H](C)C(=O)NC(=O)NCC(C)C)c(C)c2)CC1,C56170348_decoy,TRY1,Decoy,0,-8.22752,-5.08,-3.44,-5.244182557839236
CC[NH+](CC)Cc1cccc(CN[C@H](C)C(=O)NC(=O)NCC(F)(F)F)c1,C56184712_decoy,TRY1,Decoy,0,-7.43823,-5.73,-2.01,-5.477596432318344
CCCNC(=O)NC(C)(C)C(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C56336802_decoy,TRY1,Decoy,0,-7.81642,-5.78,-0.61,-5.279483908454208
COc1ccccc1[C@H](C)NC(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1,C45609230_decoy,TRY1,Decoy,0,-8.21172,-7.23,-1.54,-6.454414734008299
COc1ccccc1[C@@H](C)NC(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1,C45609232_decoy,TRY1,Decoy,0,-9.51558,-7.55,-3.77,-6.983904551308696
COc1cc(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)ccc1NC(C)=O,C48379905_decoy,TRY1,Decoy,0,-8.64894,-5.52,-2.68,-5.94860075944182
C[NH+](C)[C@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccco1,C47727869_decoy,TRY1,Decoy,0,-7.70102,-5.89,-2.39,-5.858606963880597
C[C@@H]1CCCC[C@@H]1OCC[NH+]1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1,C59386634_decoy,TRY1,Decoy,0,-9.75026,-7.15,-2.57,-6.124918047117376
C[NH+]1CCN(c2ccccc2NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)CC1,C59875604_decoy,TRY1,Decoy,0,-8.81733,-7.33,-1.87,-6.332211066067471
C[C@H]1CCC[C@](CNC(=O)CCCNC(=O)NC2CCCCC2)([NH+](C)C)C1,C59891293_decoy,TRY1,Decoy,0,-9.39675,-4.95,-1.75,-5.37705496070918
CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N[C@H](C)c1[nH]cc(-c2ccccc2)[nH+]1,C60199654_decoy,TRY1,Decoy,0,-8.20359,-8.1,-3.52,-6.8154785620887
CCc1ccc([C@H](CNS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)[NH+](C)C)cc1,C60950152_decoy,TRY1,Decoy,0,-7.3003,-7.76,-2.02,-6.563493455287655
CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cc1,C48390071_decoy,TRY1,Decoy,0,-8.94529,-6.46,-3.73,-5.628964071958232
C[C@@]1(CSc2ccccc2C(=O)NCCC2=c3ccccc3=[NH+]C2)NC(=O)NC1=O,C63122399_decoy,TRY1,Decoy,0,-8.25534,-8.39,-3.2,-8.122790899150532
O=C(CNc1c2ccccc2[nH+]c2ccccc12)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-],C63142439_decoy,TRY1,Decoy,0,-7.15254,-9.83,-1.84,-7.980331521758474
C[NH+](C)[C@H](CNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)Cc1ccccc1,C63162424_decoy,TRY1,Decoy,0,-8.03588,-6.58,-1.87,-5.50232272484011
C=CCNC(=S)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NCc1ccco1,C64032437_decoy,TRY1,Decoy,0,-8.16269,-5.32,-5.33,-5.788970270332825
CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccc(F)c(NC(=O)C2CC2)c1,C64058288_decoy,TRY1,Decoy,0,-8.91364,-7.55,-1.73,-6.2689355599726
O=C(NCCCn1cc[nH+]c1)NNC(=O)C1(c2cccc(Cl)c2)CCCC1,C64886012_decoy,TRY1,Decoy,0,-7.99897,-7.32,-1.63,-6.482446451289936
N/C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)=[NH+]\Cc1ccco1,C66243529_decoy,TRY1,Decoy,0,-9.05051,-6.75,-0.79,-6.447704486368682
Cc1cccc(OC[C@@H](O)CNC(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1,C66334124_decoy,TRY1,Decoy,0,-7.78965,-6.66,-1.98,-5.900514883822297
Cc1cc(NC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)ccc1C(=O)NC(C)C,C66682141_decoy,TRY1,Decoy,0,-8.01395,-5.74,-3.46,-5.675506312620375
CC1CC[NH+](CCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC1,C67139343_decoy,TRY1,Decoy,0,-10.2866,-5.69,-1.77,-6.26015249917332
C[NH+](CCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)Cc1ccccc1,C67232328_decoy,TRY1,Decoy,0,-7.45567,-6.5,-0.94,-5.565029484680868
CC(C)C[NH+]1CCC(NC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC1,C67264551_decoy,TRY1,Decoy,0,-9.2391,-5.1,-2.23,-6.225783260524997
COCCNC(=O)NC(=O)C[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67400861_decoy,TRY1,Decoy,0,-8.0425,-7.71,-2.28,-6.255895685949676
CC(=O)NC[C@@H]1CCC[NH+](CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)C1,C67417396_decoy,TRY1,Decoy,0,-7.54805,-6.01,-2.3,-5.3079707516754855
COc1cc(OC)c(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1Cl,C67537314_decoy,TRY1,Decoy,0,-10.0323,-6.32,-2.11,-6.460233683048455
Cc1cccc(C)c1OC[C@H](O)CNC(=O)NCCCC[NH+]1CCC(C)CC1,C67602534_decoy,TRY1,Decoy,0,-7.24403,-6.51,-1.94,-5.610654584327605
COCCNc1ccc(CNC(=O)NCC[NH+]2CCc3sccc3C2)cc1,C67632481_decoy,TRY1,Decoy,0,-9.35431,-6.18,-1.92,-6.306014208057771
Cn1c(=O)[nH]c(=O)c2c1nc(NCC[NH+](C)C)n2C[C@@H](O)COc1ccccc1,C00625893_decoy,TRY1,Decoy,0,-6.80076,-7.25,-1.83,-6.705160531640733
Cc1ncc(CO)c(/C=N/NC(=O)CC[NH+]2CCN(c3ccccc3)CC2)c1O,C06369359_decoy,TRY1,Decoy,0,-8.9253,-5.79,-1.48,-6.281931520851836
Cc1cc([C@H](O)C[NH2+][C@@H](C)CCn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1O,C13207393_decoy,TRY1,Decoy,0,-8.31596,-7.66,-2.74,-5.825369541374069
Cc1cc([C@@H](O)C[NH2+][C@H](C)CCn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1O,C13207396_decoy,TRY1,Decoy,0,-7.06645,-7.6,-2.64,-5.119520948458901
O=C1NC[C@@H](CCC(=O)N2CCOCC2)[NH+]2C[C@@H](NC(=S)Nc3ccccc3)C[C@@H]12,C15708273_decoy,TRY1,Decoy,0,-7.04404,-7.28,-0.95,-7.045635246735661
Cc1cccnc1CCNCc1cccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c1,C19939622_decoy,TRY1,Decoy,0,-8.7903,-6.54,-3.06,-5.954900932435436
CCOC(=O)C[C@@H]1CCN(C(=O)NC(C)C)C[C@@H]1CC[NH+]1CCC[C@H]1C(N)=O,C20462811_decoy,TRY1,Decoy,0,-8.63833,-5.4,-3.1,-5.493492743994244
C=CCNC(=O)C[NH+]1CCN([C@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)CC1,C22760408_decoy,TRY1,Decoy,0,-8.52368,-7.66,-1.69,-6.801532012038966
C[NH+]1CCN(c2ccc(NC(=O)CNC(=O)CNC(=O)c3ccco3)cn2)CC1,C25011115_decoy,TRY1,Decoy,0,-7.37245,-8.68,-1.03,-6.376391262612398
CCCCNC(=O)CSc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1ccc(CC)cc1,C18213543_decoy,TRY1,Decoy,0,-8.76193,-6.55,-2.17,-7.913097858361894
CC[NH+]1CCN(CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC(C)C)CC1,C23095773_decoy,TRY1,Decoy,0,-8.84052,-6.42,-1.29,-6.774002320066362
CC[NH+](CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C,C03964325_decoy,TRY1,Decoy,0,-8.20008,-5.78,-2.99,-5.573804801358524
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2ccncc2)CC12CC[NH2+]CC2,C39631771_decoy,TRY1,Decoy,0,-8.66147,-5.54,-2.55,-5.375937063536013
CCOC(=O)C1=C(CS[C@@H]2NN=C(C3=c4ccccc4=[NH+]C3)O2)NC(=O)N[C@H]1C,C39760601_decoy,TRY1,Decoy,0,-8.1355,-7.8,-2.92,-6.350468326590216
CCOC(=O)C1=C(CS[C@H]2NN=C(C3=c4ccccc4=[NH+]C3)O2)NC(=O)N[C@H]1C,C39760603_decoy,TRY1,Decoy,0,-8.70934,-7.92,-2.18,-7.182815695024535
COC(=O)c1cc(Nc2ncnc(N3CC[NH+](C)CC3)c2N)cc(C(=O)OC)c1,C40705605_decoy,TRY1,Decoy,0,-8.71319,-6.03,,99.0
COC[C@@H](C)Nc1ncnc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c1N,C40799423_decoy,TRY1,Decoy,0,-9.34035,-5.79,-1.89,-5.80026116491097
COc1ccc(S(=O)(=O)c2c(C[C@@H]([NH3+])CO)c(-c3ccccc3)nn2C)cc1,C44466465_decoy,TRY1,Decoy,0,-5.95233,-5.39,-2.89,-4.709157688261221
CCOC(=O)NC(=O)C[NH+](CC)CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C,C45312652_decoy,TRY1,Decoy,0,-7.06206,-7.4,-2.43,-6.095688998330157
CCOC(=O)NC(=O)C[NH+](CC)CC(=O)NCC(=O)Nc1ccc(F)c(F)c1,C45469277_decoy,TRY1,Decoy,0,-7.90287,-7.54,-2.01,-6.989337600451957
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NC[C@H](c1cccs1)[NH+]1CCC(C)CC1,C45820252_decoy,TRY1,Decoy,0,-8.61604,-7.79,-1.73,-7.841398806981201
CC[NH+](CC)[C@H](C)CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C46280405_decoy,TRY1,Decoy,0,-8.69666,-5.35,-2.08,-5.936142568844845
CNC(=O)c1cccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1C,C48768329_decoy,TRY1,Decoy,0,-8.20294,-6.47,-2.24,-5.991053699652713
COCCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)c2ccc(C)s2)CC1,C51098419_decoy,TRY1,Decoy,0,-8.27452,-5.27,-2.72,-5.357379564043133
C[NH+](C)[C@H](CNC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(F)c1,C54042968_decoy,TRY1,Decoy,0,-7.00718,-6.91,-4.53,-5.653602797782964
CCc1ccc([C@@H](CNC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)[NH+](C)C)cc1,C54044259_decoy,TRY1,Decoy,0,-7.89829,-5.34,-1.41,-5.692840831927595
CCN(CC)c1ccc2cc(/C(N)=[NH+]\NC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)oc2c1,C27498767_decoy,TRY1,Decoy,0,-8.26499,-5.76,-2.49,-5.459929243461668
CCN(CC)c1ccc(NC(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c[nH+]1,C48173751_decoy,TRY1,Decoy,0,-8.16474,-6.03,-2.13,-6.22971996904232
COc1cc([N+](=O)[O-])ccc1-n1nc(C)c(/C=N/NC(=O)[C@@H]([NH3+])CC(C)C)c1C,C59160660_decoy,TRY1,Decoy,0,-7.79372,-6.17,-1.49,-5.513648220535597
CC[NH+]1CCN(Cc2ccc(NC(=O)NCCNS(=O)(=O)CC)cc2)CC1,C61528088_decoy,TRY1,Decoy,0,-8.00371,-5.13,-2.74,-4.977945418623423
Cc1occc1C(=O)Nc1cc(NC(=O)C(=O)NCCn2cc[nH+]c2)ccc1F,C48918168_decoy,TRY1,Decoy,0,-7.80033,-7.31,-0.76,-6.473183905623166
CCc1nc2sc([C@@H](c3ccc(Cl)cc3)[NH+](CCO)CCO)c(O)n2n1,C41634419_decoy,TRY1,Decoy,0,-8.33916,-4.42,-1.06,-5.595884703257193
C[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)C[C@H]1CS[C@H](NS(C)(=O)=O)N1,C63280051_decoy,TRY1,Decoy,0,-9.61431,-7.21,-1.83,-7.068647300815515
CCCCN1C(=O)N=C([O-])[C@H](N(C)C(=O)CCCC2=c3ccccc3=[NH+]C2)[C@H]1[NH3+],C64697313_decoy,TRY1,Decoy,0,-6.36321,-7.56,-2.08,-5.772541413331672
Cc1nc(-c2ccc(CC(=O)NNC(=O)NCCCn3cc[nH+]c3)cc2)cs1,C64886117_decoy,TRY1,Decoy,0,-7.68073,-6.64,-3.07,-6.366402572882332
CC[NH+]1CCN(c2ccccc2NC(=O)NCCCNS(=O)(=O)CC)CC1,C51233471_decoy,TRY1,Decoy,0,-7.63856,-6.92,-3.05,-6.70180344750963
Cc1nn(CCO)c(C)c1C[NH2+]CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1,C65977869_decoy,TRY1,Decoy,0,-7.67744,-7.46,-2.8,-7.2984174807583235
C[C@@H]1CN([C@@H](CN/C(N)=[NH+]/C[C@@H]2CCCO2)c2c(F)cccc2Cl)CCO1,C66243212_decoy,TRY1,Decoy,0,-8.88383,-6.5,-2.72,-5.687642934548616
COCCNC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2ccc(Cl)cc2)CCOCC1,C66391882_decoy,TRY1,Decoy,0,-7.88363,-6.52,-1.07,-6.517700317865178
Cn1cc(CCNC(=O)Nc2cccc(NC(=O)CC[NH+]3CCCCC3)c2)cn1,C66953134_decoy,TRY1,Decoy,0,-8.42389,-6.89,-4.55,-6.051801341519525
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCc1cccnc1N1CC[NH+](C)CC1,C66986247_decoy,TRY1,Decoy,0,-8.19005,-8.09,-2.41,-6.862804313906015
C[NH+](C)[C@H](CNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)c1ccsc1,C67160997_decoy,TRY1,Decoy,0,-10.3056,-5.94,-1.39,-7.012287046622327
C[C@@H]1CCC[NH+](CCCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)C1,C67165042_decoy,TRY1,Decoy,0,-10.6232,-6.24,-2.16,-7.336227948481835
O[C@H](C[NH2+]Cc1c[nH]nc1-c1ccc2c(c1)OCCO2)COc1cccc(F)c1,C67224348_decoy,TRY1,Decoy,0,-7.4021,-6.61,-1.74,-7.686909429756311
CC[NH+](CC)[C@H](CNC(=O)CCc1c(C)nc2nc(N)nn2c1C)c1ccco1,C67275232_decoy,TRY1,Decoy,0,-7.62131,-6.73,-1.01,-6.132225855481976
C[NH+](CCNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2)Cc1ccccc1,C67379876_decoy,TRY1,Decoy,0,-9.50643,-7.08,-1.65,-11.151074427942916
COCCNC(=O)NC(=O)[C@H](C)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67401187_decoy,TRY1,Decoy,0,-8.61977,-7.16,-2.27,-5.870477514102797
CCCC[NH+]1Cc2cccc(NC(=O)C(=O)NCC(=O)NCc3ccco3)c2C1,C67493686_decoy,TRY1,Decoy,0,-9.06813,-7.24,-3.77,-6.660623765149508
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc(-c3nnnn3C3CC3)cc2)CC1,C67539144_decoy,TRY1,Decoy,0,-9.2039,-7.78,-3.07,-6.837793463820182
CC[NH+]1CCN([C@@H](C)CNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC1,C67613202_decoy,TRY1,Decoy,0,-9.05565,-5.84,-2.12,-5.623759666180274
CC(C)CN(C(=O)C[NH2+][C@@H](C)[C@@H]1C[C@@H]2CC[C@H]1C2)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C03342169_decoy,TRY1,Decoy,0,-8.19875,-6.75,-2.73,-6.968555829672924
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+]C[C@H](O)c1ccc(O)c(C(N)=O)c1,C01570643_decoy,TRY1,Decoy,0,-8.07051,-7.64,-1.67,-7.469086665254887
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+]C[C@@H](O)c1ccc(O)c(C(N)=O)c1,C01570645_decoy,TRY1,Decoy,0,-8.15831,-7.49,-4.21,-8.168936449738096
CCOc1cc(C[NH2+][C@@H](CC)CO)c(Br)cc1OCC(N)=O,C06702252_decoy,TRY1,Decoy,0,-7.28663,-4.93,-4.73,-4.683788942894004
Cc1ccccc1Nc1nc(N)nc(C[NH+](C)CC(=O)Nc2cccc(F)c2)n1,C07493914_decoy,TRY1,Decoy,0,-6.59993,-8.14,-1.69,-8.059681112178973
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(OCc2ccc(Cl)cc2)cc1,C13942021_decoy,TRY1,Decoy,0,-7.75559,-8.01,-2.36,-7.629307301591641
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(OCc2ccccc2Cl)cc1,C16449874_decoy,TRY1,Decoy,0,-8.20591,-7.72,-1.73,-6.496428277773532
Cc1nnc(SCc2cc(=O)nc(NC(=[NH2+])Nc3cccc(Cl)c3)[nH]2)s1,C04993927_decoy,TRY1,Decoy,0,-9.22193,-6.87,-1.62,-5.705521525005896
C[NH+](Cc1ccccc1)[C@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1cccc(Cl)c1,C20465951_decoy,TRY1,Decoy,0,-7.24535,-7.64,-2.63,-5.423470468033359
NC(=O)N[C@@H](CC(=O)NCC1([NH+]2CCCCC2)CCCCC1)c1ccc(Cl)cc1,C22414129_decoy,TRY1,Decoy,0,-8.40528,-7.52,-4.85,-6.5782559284368585
NC(=O)N[C@H](CC(=O)NCC1([NH+]2CCCCC2)CCCCC1)c1ccc(Cl)cc1,C22414132_decoy,TRY1,Decoy,0,-9.27747,-5.45,-1.64,-6.562791008279747
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1,C25537133_decoy,TRY1,Decoy,0,-9.03914,-4.94,-1.23,-5.841008461597459
CC[C@H](C)[C@H](NC(N)=O)C(=O)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1,C25537142_decoy,TRY1,Decoy,0,-8.51586,-5.92,-1.45,-6.077012560334848
CC(C)(C)c1[nH+]n(C(C)(C)C)c(N)c1NC(=O)NCCCN1CCOCC1,C34784803_decoy,TRY1,Decoy,0,-8.45859,-6.22,-0.46,-6.2294583228367655
CC(C)S(=O)(=O)c1ccc([C@@H](CNO)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534443_decoy,TRY1,Decoy,0,-8.69321,-6.07,-1.69,-5.717480302495448
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccc(F)cc1Cl,C40744388_decoy,TRY1,Decoy,0,-8.28934,-6.91,-2.4,-7.6685394990893245
COC(=O)c1ccccc1Nc1ncnc(NCC[NH+]2CCCCC2)c1N,C40756259_decoy,TRY1,Decoy,0,-7.83064,-6.94,-1.44,-5.613951883790112
CC(C)Oc1cc(-c2ccc(CC[NH2+]C[C@H](O)c3c[nH+]ccc3N)cc2)ccc1C(=O)[O-],C40914437_decoy,TRY1,Decoy,0,-7.19561,-7.25,-1.85,-5.230463039465921
NC(=O)N[C@H](CC(=O)NCC1([NH+]2CCSCC2)CCCC1)c1cccs1,C41423524_decoy,TRY1,Decoy,0,-9.77918,-6.11,-2.01,-6.2945709791146855
CC(C)NC(=O)Nc1ccc(CNC(=O)NCC2([NH+](C)C)CCCC2)cc1,C47836024_decoy,TRY1,Decoy,0,-8.31263,-7.32,-2.97,-5.970198456499334
C[C@H]([NH2+]CC(=O)NCCSc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1,C49609532_decoy,TRY1,Decoy,0,-10.1768,-6.21,-4.11,-6.76093510872488
C[C@@H]([NH2+]CC(=O)NCCSc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1,C49609535_decoy,TRY1,Decoy,0,-8.94144,-7.59,-2.46,-6.80758343662903
[NH3+]CCCCCC(=O)NCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1,C04711341_decoy,TRY1,Decoy,0,-6.3734,-6.9,-2.88,-6.783269216470289
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3ccccc3C)n2)s1,C05901273_decoy,TRY1,Decoy,0,-9.53807,-7.04,-3.14,-7.834171363816223
Cc1cc(C)nc(N/C(=N/C(=S)Nc2cccc(C(F)(F)F)c2)NCCc2c[nH]c[nH+]2)n1,C18114567_decoy,TRY1,Decoy,0,-9.46059,-7.85,-1.76,-8.935499981178085
NC(=O)CSc1ccccc1NC(=O)C[NH+]1CCC(C(=O)NC2CC2)CC1,C55914635_decoy,TRY1,Decoy,0,-8.11653,-6.72,-3.03,-7.352888944837491
Cc1cc(OCC(N)=O)ccc1NC(=O)N[C@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1,C56725476_decoy,TRY1,Decoy,0,-8.27541,-6.37,-2.02,-5.827459079142406
C[C@H](CNC(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1)C[NH+]1CCCCC1,C57043865_decoy,TRY1,Decoy,0,-8.59433,-5.46,-2.45,-5.159771165367783
CSCC[C@H](NC(N)=O)C(=O)NC[C@@H](c1cccs1)[NH+]1CCCC1,C57288305_decoy,TRY1,Decoy,0,-8.59923,-5.79,-1.73,-6.24138626377449
CSCC[C@@H](NC(N)=O)C(=O)NC[C@H](c1cccs1)[NH+]1CCCC1,C57288308_decoy,TRY1,Decoy,0,-8.56292,-4.86,-2.93,-5.704415901873004
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3ccc(Cl)cc3)n2)s1,C09287020_decoy,TRY1,Decoy,0,-8.80151,-1.17,-2.15,-3.529243232380741
C[C@@H](NC(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1cccc(S(N)(=O)=O)c1,C58436531_decoy,TRY1,Decoy,0,-8.94907,-6.83,-2.52,-5.965036924840327
C[C@@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1)c1cccc(S(N)(=O)=O)c1,C58436533_decoy,TRY1,Decoy,0,-10.0174,-7.38,-3.39,-7.039634036918986
NC(=O)C1CC[NH+](CCCCNC(=O)Nc2cc(Cl)ccc2Cl)CC1,C58826058_decoy,TRY1,Decoy,0,-9.22536,-6.92,-2.36,-7.422209860190929
CC[NH+](CC)CCn1cc(NC(=O)C[C@H](NC(N)=O)c2cccs2)cn1,C63095733_decoy,TRY1,Decoy,0,-7.81764,-5.66,-2.28,-5.786658713077409
Cc1cc(OCC(N)=O)ccc1NC(=O)NC1CC[NH+](CC2CCCC2)CC1,C63393008_decoy,TRY1,Decoy,0,-8.44946,-7.56,-3.68,-6.416904621148026
CCNC(=O)NC(=O)[C@@H](C)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1,C65886885_decoy,TRY1,Decoy,0,-8.13956,-7.12,-3.87,-6.301486918253159
CCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115470_decoy,TRY1,Decoy,0,-8.42834,-6.89,-0.97,-10.45355792965382
CCCCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115474_decoy,TRY1,Decoy,0,-8.49018,-6.55,-1.64,-6.952973503856075
Cc1cc(Br)ccc1NC(=O)CCN/C(N)=[NH+]/C[C@@H]1CCCO1,C66246058_decoy,TRY1,Decoy,0,-9.17697,-4.96,-1.01,-7.125668519221484
CCN(CC)C(=O)Nc1ccc([C@H](C)[NH2+][C@H](C(N)=O)c2ccc(F)cc2)cc1,C66939578_decoy,TRY1,Decoy,0,-6.66142,-7.09,-2.4,-5.980765021692548
CCC[NH+]1Cc2cccc(N[C@H](C)C(=O)Nc3sccc3C(N)=O)c2C1,C66968016_decoy,TRY1,Decoy,0,-8.75813,-6.63,-2.72,-5.845474207809886
CC[NH+](C)CCNC(=O)NCc1cccc(NC(=O)Nc2cccc(C)c2)c1,C67001991_decoy,TRY1,Decoy,0,-7.82399,-5.47,-1.45,-5.701915228000318
CCNC(=O)NC(=O)[C@H](C)Nc1ccc(C)c(NC(=O)C[NH+]2CCCCC2)c1,C67437398_decoy,TRY1,Decoy,0,-7.58814,-7.47,-2.84,-6.804498373974056
CCC[NH+]1CCN(c2ccc(NC(=O)[C@H](NC(N)=O)C(C)C)cc2Cl)CC1,C67474094_decoy,TRY1,Decoy,0,-6.91585,-6.6,-4.25,-5.769891252831939
CCC[NH+]1CCN(c2ccc(NC(=O)[C@@H](NC(N)=O)C(C)C)cc2Cl)CC1,C67474095_decoy,TRY1,Decoy,0,-7.53353,-6.47,-1.59,-5.199102478983575
C[C@H](O)CNC(=O)C(=O)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C67490028_decoy,TRY1,Decoy,0,-7.85295,-5.35,-3.38,-4.892746568839954
CC1CC[NH+](C[C@H](O)CNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)CC1,C67538797_decoy,TRY1,Decoy,0,-7.98107,-6.11,-3.17,-5.910555427460977
NC(=O)Cc1ccccc1NC(=O)NC[C@@H]1CCC[NH+]1CC1CCCCC1,C67542538_decoy,TRY1,Decoy,0,-8.49515,-7.64,-1.98,-7.474449299932547
NC(=O)Cc1ccccc1NC(=O)NC[C@H]1CCC[NH+]1CC1CCCCC1,C67542541_decoy,TRY1,Decoy,0,-7.75412,-6.65,-3.02,-8.308087891370404
COc1cc2nc(NNC(N)=S)nc(NNC(N)=S)c2cc1OC,C03626846_decoy,TRY1,Decoy,0,-9.42461,-6.26,-1.48,-7.737770282310021
C[C@H]([NH3+])C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)[O-],C04533885_decoy,TRY1,Decoy,0,-9.29832,-5.93,-2.54,-5.904701756517989
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](C)[NH3+])C(=O)[O-],C04533886_decoy,TRY1,Decoy,0,-7.11219,-7.01,-2.06,-6.868109495057161
CC(=O)N[C@@H]1[C@@H](OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C=O)O[C@@H](CO)[C@@H](O)[C@H]1O,C04533997_decoy,TRY1,Decoy,0,-7.05491,-4.95,-2.41,-4.9263102489806
CC(=O)N[C@@H]1[C@@H](OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C=O)O[C@@H](CO)[C@@H](O)[C@@H]1O,C04533999_decoy,TRY1,Decoy,0,-5.05791,-4.69,-3.15,-4.688594396590518
S=C(NCC[NH+]1CCOCC1)NNC(=S)NCC[NH+]1CCOCC1,C04653394_decoy,TRY1,Decoy,0,-8.22298,-4.9,-2.15,-5.439051793098096
CCCO[C@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C05273648_decoy,TRY1,Decoy,0,-4.94302,-4.57,-3.43,-4.04105297717364
O=C(N/N=C\c1ccc(Cl)cc1Cl)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C05330009_decoy,TRY1,Decoy,0,-8.58612,-7.47,-1.56,-7.748025914002279
NC(=O)CCCCCOc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05759558_decoy,TRY1,Decoy,0,-6.82597,-6.35,-2.17,-6.136849839505643
NC(=O)CCCCCOc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05759559_decoy,TRY1,Decoy,0,-6.90012,-6.8,-4.09,-6.858667871478705
CCCCCN(CC(=O)NC(N)=O)c1c(N)n(CCCC)c(=O)[nH]c1=O,C11339031_decoy,TRY1,Decoy,0,-7.91832,-6.5,-1.48,-8.946822843605748
CC(=O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C13537961_decoy,TRY1,Decoy,0,-4.8099,-5.12,-2.74,-3.833034847958528
COC[C@@H]1O[C@H](COC[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14984501_decoy,TRY1,Decoy,0,-5.49522,-6.04,-2.45,-4.531787284095877
C=CCNC(=S)NCC(=O)NCCNC(=O)CNC(=S)NCC=C,C05377333_decoy,TRY1,Decoy,0,-7.22256,-4.72,-2.46,-5.778480136442735
CCOC(=O)CNC(=O)[C@@H](CSC(=O)N(C)O)NC(=O)CC[C@H]([NH3+])C(=O)[O-],C05729310_decoy,TRY1,Decoy,0,-8.21629,-6.56,-2.04,-7.637892062576966
CC(=O)N[C@H](C(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)C(C)(C)SN=O,C22059981_decoy,TRY1,Decoy,0,-6.46301,-4.67,-2.63,-4.717119558200159
CC(=O)OC[C@@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22066574_decoy,TRY1,Decoy,0,-5.3114,-5.2,-1.84,-4.165871652070012
CC(=O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22066581_decoy,TRY1,Decoy,0,-5.23591,-5.37,-3.48,-4.553831659722331
C=CCNC(=S)NNC(=O)CCCCC(=O)NNC(=S)NCC=C,C05225171_decoy,TRY1,Decoy,0,-7.40426,-5.13,-2.97,-6.174038578067117
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])C[C@H]1O,C27524155_decoy,TRY1,Decoy,0,-8.29713,-6.95,-1.26,-7.094389773360871
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@@H]([NH3+])C(=O)[O-])C[C@H]1O,C27524156_decoy,TRY1,Decoy,0,-6.97134,-6.94,-2.29,-7.131151614791523
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@H]([NH3+])C(=O)[O-])C[C@@H]1O,C27524157_decoy,TRY1,Decoy,0,-6.70057,-5.92,-0.94,-7.075514979635867
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@@H]([NH3+])C(=O)[O-])C[C@@H]1O,C27524158_decoy,TRY1,Decoy,0,-7.67307,-7.32,-1.74,-6.985772400328052
C[C@H](O)CC[C@@H]1[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H](O)CC1(C)C,C31156461_decoy,TRY1,Decoy,0,-6.17427,-4.71,-4.47,-4.429751836375252
C[C@H](O)CC[C@H]1[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@H](O)CC1(C)C,C31156471_decoy,TRY1,Decoy,0,-7.57365,-5.61,-1.64,-5.307771508714003
O=C1CN(CCNCC[NH2+]CCNCC[NH2+]CCN2CC(=O)NC2=O)C(=O)N1,C31371433_decoy,TRY1,Decoy,0,-8.16462,-6.13,-2.3,-6.690024232043793
CC(=O)N[C@H](C(=O)NC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C33782164_decoy,TRY1,Decoy,0,-5.2618,-5.07,-1.58,-3.7295535820879793
C[C@@H](O)CC[C@@H]1[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@H](O)CC1(C)C,C35455113_decoy,TRY1,Decoy,0,-7.40534,-5.2,-3.99,-4.62006273110883
CC(=O)N[C@@H](C(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C35643703_decoy,TRY1,Decoy,0,-6.82016,-7.4,-2.64,-9.70065876478577
CC(=O)N[C@@H](C(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(C)(C)SN=O,C35644451_decoy,TRY1,Decoy,0,-5.64437,-6.02,-1.72,-5.024417218485584
CC(=O)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@H](CO)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C35653151_decoy,TRY1,Decoy,0,-5.66998,-5.07,-4.16,-4.680617158254416
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](C[C@H]([NH3+])CC[C@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C37253580_decoy,TRY1,Decoy,0,-6.7268,-6.57,-1.02,-5.348217190424442
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C[C@H]([NH3+])CC[C@@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C38192471_decoy,TRY1,Decoy,0,-7.5347,-7.65,-2.08,-8.70843466733213
C[NH+](C)CCCN[C@H]1N=C2C(=O)N=C([NH-])N=C2N1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39939242_decoy,TRY1,Decoy,0,-6.6582,-6.47,-3.18,-6.561648138939242
CC1(C)CC(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)CC(C)(C)[NH2+]1,C40760930_decoy,TRY1,Decoy,0,-7.18287,-6.53,-1.22,-6.688932602266453
C[C@@H]1O[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C2OCCO2)[C@H](O)[C@H](O)[C@H]1O,C44228441_decoy,TRY1,Decoy,0,-6.67176,-5.12,-2.94,-4.616368903183387
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@H](CO)O[C@@H]1O)C(C)(C)SN=O,C44608331_decoy,TRY1,Decoy,0,-7.14954,-4.92,-2.57,-5.04313358162663
Nc1nccc2c1ncn2[C@@H]1O[C@H](CSCC[C@@H]([NH3+])C(=O)[O-])[C@@H](O)[C@H]1O,C49015809_decoy,TRY1,Decoy,0,-7.35584,-7.16,-1.32,-8.020603492861213
CCN1c2c(OCCC[NH3+])c[nH+]c(C3=NC=CC3)c2N[C@@H]1c1nonc1N,C52550779_decoy,TRY1,Decoy,0,-8.61464,-7.59,-0.78,-7.891391903600576
CCN1c2c(OCCC[NH3+])c[nH+]c(C3=NC=CC3)c2N[C@H]1c1nonc1N,C52550781_decoy,TRY1,Decoy,0,-6.82843,-6.52,-4.16,-6.464443756761393
CCN1c2c(OCCC[NH3+])c[nH+]c(C3=CN=CC3)c2N[C@@H]1c1nonc1N,C52550783_decoy,TRY1,Decoy,0,-7.74436,-7.01,-0.89,-8.69571366434363
CCN1c2c(OCCC[NH3+])c[nH+]c(C3=CN=CC3)c2N[C@H]1c1nonc1N,C52550785_decoy,TRY1,Decoy,0,-8.91823,-6.69,-1.84,-7.563584765921639
CCN1c2c(OCCC[NH3+])c[nH+]c(C3=CN=NC3)c2N[C@H]1c1nonc1N,C52550791_decoy,TRY1,Decoy,0,-8.82528,-4.86,-1.42,-4.953432822832564
CCOC(=O)CNC(=O)CNC(=O)CCCCc1c([O-])[nH+]c(N)[nH]c1=O,C05349782_decoy,TRY1,Decoy,0,-8.34056,-7.11,-2.13,-12.48259306624484
Cc1nn(CCO)c(C)c1/C=N/NC(=O)CSc1nc(N)cc(N)n1,C59914340_decoy,TRY1,Decoy,0,-8.57522,-6.87,-0.99,-6.127793369431751
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)Nc1cc(C)ccc1F,C63345143_decoy,TRY1,Decoy,0,-8.96535,-6.8,-0.76,-7.207524904751169
NS(=O)(=O)c1ccc(NCCC(=O)NNC(=O)NC2CC2)c([N+](=O)[O-])c1,C64427647_decoy,TRY1,Decoy,0,-8.9039,-6.71,-2.01,-6.9627056783701855
[NH3+][C@H](CCCNc1[nH]c2c([nH+]1)C=CCN2CCCC[C@H]([NH3+])C(=O)[O-])C(=O)[O-],C64859447_decoy,TRY1,Decoy,0,-6.99699,-5.35,-2.83,-5.673443878397404
Cc1sc2nc(CC[NH3+])nc(NCC[NH+]3CCC[C@H](C(N)=O)C3)c2c1C,C65469915_decoy,TRY1,Decoy,0,-9.55453,-6.02,-1.71,-7.306458047315177
CC(=O)OC[C@H]1O[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C65748740_decoy,TRY1,Decoy,0,-4.70746,-5.97,-3.56,-4.396248664742911
c1ccc(-c2nc(-c3cccnc3)cc(N3CCC4(CC3)OCCO4)n2)cc1,C01497842_decoy,TRY1,Decoy,0,-8.28042,-8.68,-1.0,-8.117771036380343
O=C(c1ccccc1Br)c1cc2c(cc1[N+](=O)[O-])OCCO2,C00910862_decoy,TRY1,Decoy,0,-6.35329,-5.66,-1.6,-4.49854081743171
c1cncc(-c2nnc3sc(COc4cccc5ccccc45)nn23)c1,C04511770_decoy,TRY1,Decoy,0,-6.13392,-8.47,-0.72,-6.78704459435003
CC(C)Cn1c(=O)n(C)c(=O)c2cc(C#N)c(-c3ccc(Cl)cc3)nc21,C03339733_decoy,TRY1,Decoy,0,-6.81762,-5.7,-1.23,-4.677214946839006
O=C1CCCC2=C1[C@H](c1ccc([N+](=O)[O-])cc1)CC(=O)N2c1ccc(F)cc1,C01079937_decoy,TRY1,Decoy,0,-6.28279,-5.5,-2.4,-4.021020986234844
O=C1S/C(=C\C=C\c2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1,C01188390_decoy,TRY1,Decoy,0,-6.90114,-6.81,-2.29,-5.509151548518149
Clc1cc2c(c(CSc3nnc(-c4ccco4)o3)c1)OCOC2,C04828462_decoy,TRY1,Decoy,0,-8.44713,-5.08,-2.47,-4.517981185396783
CCN1C(=O)/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)SC1=S,C04833674_decoy,TRY1,Decoy,0,-8.12221,-4.82,-1.16,-5.316767723999926
Fc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1,C01310350_decoy,TRY1,Decoy,0,-7.40663,-7.78,-1.21,-4.9749110671781365
CCCSc1nnc2n3nc(C)nc3c3c4c(sc3n12)CCCC4,C05561795_decoy,TRY1,Decoy,0,-8.17966,-6.19,0.31,-1.900764704999373
Cc1ccc(SC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c(C)c1,C04428022_decoy,TRY1,Decoy,0,-7.73113,-4.98,-1.66,-4.183177208272458
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCS[C@@H]1c1ccccc1,C04903120_decoy,TRY1,Decoy,0,-5.41737,-5.54,-2.53,-3.979240820477541
COc1c(S(=O)(=O)n2nnc3ccccc32)ccc(Cl)c1Cl,C04269382_decoy,TRY1,Decoy,0,-6.73131,-6.67,-1.09,-4.5989453205808895
CC[C@@H]1CCc2c(sc3ncn4nc(CCn5ccc(C)n5)nc4c23)C1,C02803881_decoy,TRY1,Decoy,0,-6.76255,-5.74,-5.71,-1.7160889178674386
COCc1cc(C)nc2sc3c(=O)n(-c4ccccc4Cl)nnc3c12,C06742815_decoy,TRY1,Decoy,0,-7.77848,-6.2,-2.19,-4.401772371586362
O=c1cc(CSc2nnc3ccccn23)nc2sc3c(n12)CCCC3,C07214167_decoy,TRY1,Decoy,0,-9.30187,-6.44,-2.67,-5.456184619421375
C[C@H](Oc1ccccc1)c1nn2c(=O)c(-c3ccccc3)nnc2s1,C08393752_decoy,TRY1,Decoy,0,-7.48572,-5.44,-0.75,-5.493503583083946
CC1=CC(C)(C)N(C(=O)CSc2nnnn2C)c2cc(C)c(C)cc21,C09419693_decoy,TRY1,Decoy,0,-5.95599,-5.08,-2.84,-4.151930714949892
Cc1ccc2c(CSc3nnc(-c4ccco4)n3C)cc(=O)oc2c1,C10014313_decoy,TRY1,Decoy,0,-7.65517,-4.81,-1.58,-4.934747306007769
O=c1cc(CSc2nnnn2C2CC2)c2c(ccc3ccccc32)o1,C14181949_decoy,TRY1,Decoy,0,-6.74539,-7.39,-4.68,-5.534149654542952
O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccccc2Br)cc1,C16086822_decoy,TRY1,Decoy,0,-6.1675,-5.78,-1.26,-5.068262896919966
Cc1ccc(/C=c2\s/c(=C\C(=O)C(C)(C)C)n(C)c2=O)cc1[N+](=O)[O-],C16386873_decoy,TRY1,Decoy,0,-7.17981,-5.92,-2.74,-5.350338190738943
Cc1cc(C)n(-c2cc(N3CCN(c4cccc(C)c4C)CC3)ncn2)n1,C21713417_decoy,TRY1,Decoy,0,-8.56394,-6.8,-1.58,-5.048352527412498
N#CC1(C(=O)OCc2cc(=O)n3c4c(sc3n2)CCCC4)CCCC1,C24746683_decoy,TRY1,Decoy,0,-8.64491,-6.93,-1.85,-5.327115030790539
CCN(Cc1ccc2c(c1)OCO2)c1ncnc2c1oc1ccccc12,C25006864_decoy,TRY1,Decoy,0,-8.25409,-7.02,-0.08,-5.118921723269358
O=c1c2oc3ccccc3c2ncn1Cc1coc(-c2ccc(F)cc2)n1,C26556595_decoy,TRY1,Decoy,0,-7.92179,-8.45,-0.99,-5.324628728672015
COc1ccc(C2=N/C(=C/c3cc(Cl)c4c(c3)OCO4)C(=O)O2)cc1,C32516767_decoy,TRY1,Decoy,0,-7.83744,-7.43,-0.96,-6.452181572151506
O=C1C=C[C@@H]2[C@H](c3ccc(Cl)cc3)C[C@H]1N2c1ccc([N+](=O)[O-])cn1,C15768852_decoy,TRY1,Decoy,0,-7.65475,-6.36,-2.24,-4.899788658341324
O=c1ccn(-c2cccc(F)c2)nc1-c1nc(-c2cccc(F)c2)no1,C33300447_decoy,TRY1,Decoy,0,-7.94842,-9.4,-0.97,-7.300138867602525
O=C1[C@H]2CCCN2[C@@H](c2ccc([N+](=O)[O-])cc2)N1c1ccc(Cl)cc1,C36497048_decoy,TRY1,Decoy,0,-7.4805,-6.2,-0.99,-5.5737122388580245
C[C@@H]1CCC[C@@H](C)N1S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-],C38039557_decoy,TRY1,Decoy,0,-6.34144,-5.01,-3.44,-3.5600373880777414
CC(C)=NO[C@H](C)C(=O)N1CCC2(CC1)CC(=O)c1cc(C)c(C)cc1O2,C39226656_decoy,TRY1,Decoy,0,-7.43989,-6.1,-2.08,-4.659743241912662
CCOc1cc(OC)cc2c1N(C)c1ncnc(Cl)c1N=C(Cl)C2,C39479511_decoy,TRY1,Decoy,0,-7.48704,-5.92,-2.93,-4.524979857380946
CC1=C[C@H]([C@H]2N=N[C@H](S)N2/N=C/c2cc(Br)ccc2F)N=N1,C39591677_decoy,TRY1,Decoy,0,-9.32662,-5.02,-0.87,-4.647692447499876
O=C1S/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)N1c1cccc(Cl)c1,C39860627_decoy,TRY1,Decoy,0,-7.36235,-5.92,-1.2,-4.836853491487362
COc1ccc(/C=C2\S/C(=N\c3ccccn3)N(C)C2=O)cc1OC,C39862305_decoy,TRY1,Decoy,0,-7.62936,-6.39,-3.34,-5.423673271482347
CCN1C(=O)/C(=C/c2ccccc2OC)S/C1=N\c1nnc(C)s1,C39866196_decoy,TRY1,Decoy,0,-7.17083,-5.03,-2.39,-4.389475621165142
C/C(=N\N=C(/C)[C@@H]1COc2ccccc2O1)[C@@H]1COc2ccccc2O1,C16849801_decoy,TRY1,Decoy,0,-7.64518,-5.52,-1.54,-5.102816642884706
O=[N+]([O-])c1ccc([C@@H](Br)c2cc3c(cc2Cl)OCCO3)o1,C40286264_decoy,TRY1,Decoy,0,-7.58765,-4.44,-0.61,-4.045433198919014
Cc1ccc(C)c(-c2ccnc(N3CCN(C(=O)c4ccco4)CC3)n2)c1,C40857936_decoy,TRY1,Decoy,0,-7.79707,-5.89,-2.28,-5.027045906768526
Cc1ccc(N2C[C@H](c3noc(-c4cccc(C#N)c4)n3)CC2=O)cc1Cl,C44424115_decoy,TRY1,Decoy,0,-8.47555,-5.76,-2.11,-4.8957596342009655
O=c1c2c3c(sc2ncn1Cc1noc(-c2cccs2)n1)CCCC3,C45101306_decoy,TRY1,Decoy,0,-8.86158,-5.9,-0.41,-5.053674253745866
O=[N+]([O-])c1ccc(N2CCN(c3ncccc3C(F)(F)F)CC2)cc1,C47509125_decoy,TRY1,Decoy,0,-6.57793,-5.61,-1.82,-4.336581493559181
N#C/C(=C/c1ccc(N2CCCCC2)o1)C(=O)c1ccc2c(c1)OCO2,C55041116_decoy,TRY1,Decoy,0,-7.72314,-5.66,-1.58,-5.005950788545756
Cc1nn(C)c(Cl)c1S(=O)(=O)Oc1ccc(Cl)c2cccnc12,C55977777_decoy,TRY1,Decoy,0,-8.13107,-5.25,-2.77,-4.464925378075815
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](C)Oc1ccc(-c2nnco2)cc1,C21042344_decoy,TRY1,Decoy,0,-7.02216,-6.37,-0.8,-4.675997024104509
CN(C)c1ccc([C@H]2CC(c3ccco3)=NN2C(=O)c2ccco2)cc1,C58196768_decoy,TRY1,Decoy,0,-7.80742,-6.92,-0.98,-8.418924300481784
CC(C)(C)C(=O)N1N=C(c2ccco2)C[C@@H]1c1ccc2nccnc2c1,C60101632_decoy,TRY1,Decoy,0,-8.62106,-5.71,-1.51,-5.204312395551375
Cc1ccc(/C=C2\Oc3c(cc4c(c3C)OCN(C[C@@H]3CCCO3)C4)C2=O)o1,C41588638_decoy,TRY1,Decoy,0,-7.60604,-5.86,-1.3,-4.660083876817023
COc1ccc(C2=N/C(=C/c3cn(-c4ccccc4)nc3C)C(=O)O2)cc1,C67006402_decoy,TRY1,Decoy,0,-7.31069,-7.74,-1.34,-6.602900606581628
COc1ccccc1CNC(=O)C(=O)NC[C@H](c1ccc2c(c1)CCCN2C)[NH+]1CCCCC1,C09138416_decoy,TRY1,Decoy,0,-10.6201,-8.53,-3.14,-7.90055018600567
Cc1ccc(CNC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCN(c3ccccc3F)CC2)cc1,C09829614_decoy,TRY1,Decoy,0,-9.05283,-9.27,-4.01,-9.715742954200437
COc1ccc(NC(=S)N(CC[NH+]2CCOCC2)Cc2cc3c(C)ccc(C)c3[nH]c2=O)cc1,C12566128_decoy,TRY1,Decoy,0,-9.55192,-7.56,-1.73,-8.622828653551666
COc1ccccc1CCNC(=O)[C@H]1CSC2(CCN(C(=O)C[C@@H](C)CC(C)(C)C)CC2)[NH2+]1,C16495919_decoy,TRY1,Decoy,0,-7.98987,-7.69,-1.64,-7.792324609225093
C[C@H](Cc1ccsc1)[NH2+]C1CCN(c2ccc(C(=O)NCCN3CCOCC3)cc2)CC1,C14998433_decoy,TRY1,Decoy,0,-10.0907,-5.98,-3.26,-6.113655701338676
CCN(CC)c1ccc(/C=N\NC(=O)C[NH+]2CCN(Cc3ccccc3Cl)CC2)c(O)c1,C19849466_decoy,TRY1,Decoy,0,-8.00569,-6.25,-1.59,-5.3938318016428575
Cc1ccc(C(=O)NCCCN2CC[NH+](C3CCCCC3)CC2)cc1NC(=O)C1=CSCCO1,C21019863_decoy,TRY1,Decoy,0,-11.1514,-7.33,-2.96,-7.116296432083545
Nc1ccc(CCN2CN(c3ccccc3)C3(CC[NH+](CCCC(=O)c4ccc(F)cc4)CC3)C2=O)cc1,C22048675_decoy,TRY1,Decoy,0,-8.88353,-9.12,-1.68,-7.351672319384311
O=C(NCCOc1ccc(C[NH+]2CCCC[C@H]2c2cccnc2)cc1)c1n[nH]c2c1CCCC2,C23129776_decoy,TRY1,Decoy,0,-8.81423,-8.34,-2.22,-7.975424412411428
O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1,C25383487_decoy,TRY1,Decoy,0,-9.56283,-6.85,-1.97,-6.163084837718477
O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)c1cc(S(=O)(=O)NC2CC2)ccc1Br,C25383619_decoy,TRY1,Decoy,0,-9.8142,-6.47,-2.16,-7.212897325246661
CCOC(=O)C1=C(C[NH+](C)Cc2ccc(OC)c(F)c2)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C25815348_decoy,TRY1,Decoy,0,-8.13469,-6.61,-2.89,-6.969457808799172
CCOc1ccc(CN2CC[NH+](CC(=O)NCC(=O)Nc3ccc(F)c(F)c3F)CC2)cc1,C27568065_decoy,TRY1,Decoy,0,-8.1917,-9.12,-1.51,-6.567438952777495
COc1ccccc1[C@H](CNC(=O)[C@H](NC(=O)c1c(F)cccc1F)C(C)C)[NH+]1CCCC1,C27570622_decoy,TRY1,Decoy,0,-9.62623,-6.08,-0.74,-7.324347821654818
COc1ccc([C@@H](CNC(=O)c2sc(NC(=O)c3ccco3)cc2C)[NH+]2CCCCC2)cc1,C27669153_decoy,TRY1,Decoy,0,-9.20164,-6.32,-2.14,-6.306566453841139
COc1ccccc1C(=O)c1c(NC(=O)C[NH+]2CCC(NC(=O)C3CC3)CC2)sc2c1CCCC2,C30281417_decoy,TRY1,Decoy,0,-9.66882,-6.81,-2.95,-6.416420239115859
CCCCN(CCCC)C(=O)c1sc2[nH+]c(N3CCOCC3)c3c(c2c1N)CCN(C)C3,C31808399_decoy,TRY1,Decoy,0,-8.10745,-4.93,-1.53,-5.133153633769955
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1,C32217735_decoy,TRY1,Decoy,0,-8.921,-6.72,-3.24,-6.003889667213575
C[C@@H](SCc1nc(=O)c2c(-c3ccccc3)csc2[nH]1)C(=O)NCCC[NH+]1CCCCC1,C32879711_decoy,TRY1,Decoy,0,-9.62987,-7.09,-2.5,-6.277517419424515
Cc1cc(C(=O)CN2CC[NH+](C/C=C/c3ccccc3)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1,C22809388_decoy,TRY1,Decoy,0,-10.6619,-8.14,-3.43,-6.626336179351964
COC[C@@H](O)C[NH+](Cc1ccccc1)Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1,C35746972_decoy,TRY1,Decoy,0,-8.87826,-7.89,-2.37,-7.463262397755136
CC(C)c1cc2c(=O)[nH]c(C[NH+](Cc3ccccc3)C[C@H](O)CN3CCOCC3)nc2s1,C35780925_decoy,TRY1,Decoy,0,-10.0223,-7.9,-4.51,-12.002940380209491
CC[C@@H](NC(=O)NC(C)(C)C)[C@H]1c2cc(OC)c(OC)cc2CC[NH+]1Cc1ccc(F)cc1,C36048485_decoy,TRY1,Decoy,0,-8.3947,-5.69,-1.41,-5.868846417385219
CCC[C@H](O)C[NH+](CCC)Cc1nc2sc3c(c2c(=O)[nH]1)CCN(Cc1ccccc1)C3,C36155942_decoy,TRY1,Decoy,0,-9.03601,-5.88,-3.74,-6.890436876671815
CC(C)[NH+](Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)[nH]1)C[C@H](O)COC(C)(C)C,C36206192_decoy,TRY1,Decoy,0,-8.24016,-6.72,-0.78,-7.248768869216305
CCC[C@@H](O)C[NH+](Cc1nc2scc(-c3cccc(Cl)c3)c2c(=O)[nH]1)Cc1ccco1,C36206404_decoy,TRY1,Decoy,0,-8.52534,-6.46,-4.14,-7.749917107189826
CCCCOc1ccc(NC(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CC[NH+](C)CC2)cc1,C38517970_decoy,TRY1,Decoy,0,-9.82357,-7.07,-3.98,-7.453358347948354
CCc1cc([C@@H](Nc2cccc[nH+]2)c2cccc(OC)c2OC)c(NC(=O)c2ccco2)s1,C38547925_decoy,TRY1,Decoy,0,-8.44931,-5.31,-3.12,-6.593622932530337
CSc1cccc(NC(=O)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CC[NH+](C)CC2)c1,C38636796_decoy,TRY1,Decoy,0,-10.0865,-5.97,-4.88,-6.6777148818989565
C[NH+](C)[C@H](CNC(=O)CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)c1ccccc1Cl,C29930096_decoy,TRY1,Decoy,0,-9.78969,-5.89,-2.01,-6.64056363840563
CC(C)OCCCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39605243_decoy,TRY1,Decoy,0,-9.52712,-7.37,-4.8,-7.278376816549544
CCOc1ccccc1CCNC(=O)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39652680_decoy,TRY1,Decoy,0,-9.53334,-6.21,-1.54,-6.507661984861846
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCCSCc2ccccc2)C2(CC[NH2+]CC2)C1,C39658709_decoy,TRY1,Decoy,0,-6.38173,-7.85,-1.63,-6.566612212637176
Cc1ccc(C)c(CCNC(=O)[C@@H]2CN(C(=O)[C@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)c1,C39677074_decoy,TRY1,Decoy,0,-8.58997,-6.32,-4.09,-6.685651320484009
CC(C)COCCCNC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39683385_decoy,TRY1,Decoy,0,-9.99336,-6.06,-2.19,-6.699601683280329
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)NCCOc2cccc(F)c2)C2(CC[NH2+]CC2)C1,C39685378_decoy,TRY1,Decoy,0,-7.99376,-8.03,-4.45,-7.476967280686993
CC(C)(C)SCCNC(=O)[C@@H]1CN(C(=O)COc2cccc(Cl)c2)CC12CC[NH2+]CC2,C39696464_decoy,TRY1,Decoy,0,-10.0603,-7.5,-3.3,-8.800774180131638
Cc1ccccc1-c1csc2nc(C[NH+](CC(C)C)C[C@H](O)COC(C)(C)C)[nH]c(=O)c12,C36205689_decoy,TRY1,Decoy,0,-8.06089,-6.88,-2.89,-6.874554763742512
COc1ccccc1-c1cc([C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=S)Nc2ccccc2)n(C)n1,C43525827_decoy,TRY1,Decoy,0,-8.81582,-8.29,-3.36,-6.38140887047731
S=C(NCCN1CCOCC1)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2CN1CCc2ccccc2C1,C43527032_decoy,TRY1,Decoy,0,-9.66358,-7.3,-1.4,-6.24931496220096
CC(C)c1ccc(CN2CC[NH+]([C@@H](C)C(=O)NCC(=O)Nc3ccc(F)c(F)c3F)CC2)cc1,C22919312_decoy,TRY1,Decoy,0,-9.10285,-6.8,-2.2,-5.974698464496441
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)/N=c1/[nH]c(C[NH+]2CCCCC2)cs1,C36652187_decoy,TRY1,Decoy,0,-9.58174,-7.37,-1.36,-10.345244731138369
COc1ccc(C[NH2+]Cc2cc3c(-c4ccc(OC)cc4)nn(-c4ccccc4)c3[nH]c2=O)cc1,C57720873_decoy,TRY1,Decoy,0,-7.85592,-8.78,-1.15,-7.760233440485202
CCOC(=O)c1c(NC(=O)CSC2=[NH+][C@](C)(CC)NN2c2ccccc2)sc2c1CCC2,C59564944_decoy,TRY1,Decoy,0,-9.86936,-6.91,-3.19,-7.874647236213
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccccc1)NCCc1ccccc1,C39792902_decoy,TRY1,Decoy,0,-9.18091,-8.92,-1.22,-12.23243231863877
COc1ccc([C@H](CNC(=O)C[C@H](NC(C)=O)c2ccc(C)cc2)C2=c3ccccc3=[NH+]C2)cc1,C63403672_decoy,TRY1,Decoy,0,-9.1585,-8.89,-3.26,-9.1015738946403
CCN1C[C@@H](/C=C(\NC(=O)c2ccc(OC)cc2)C(=O)NCCC2=c3ccccc3=[NH+]C2)c2ccccc21,C63514453_decoy,TRY1,Decoy,0,-8.602,-8.92,-1.39,-9.204081186665048
CCNC(=O)c1cn([C@@H](C)CC)cc(C(=O)NCCC2=c3cc(F)cc(F)c3=[NH+][C@@H]2C)c1=O,C64024026_decoy,TRY1,Decoy,0,-8.6591,-8.6,-3.29,-8.079033946813134
CC(=O)NC[C@@H]1CC=C(S(=O)(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2ccccc2)S1,C64231022_decoy,TRY1,Decoy,0,-10.0339,-8.49,-2.44,-9.105181940924616
COc1ccc(OC)c([C@H](Nc2cc(C)cc[nH+]2)c2cc(C)sc2NC(=O)c2ccco2)c1,C64790091_decoy,TRY1,Decoy,0,-10.6832,-4.79,-2.88,-6.044868828590344
OC[C@H]1[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)C[NH+]1Cc1ccccc1,C05888251_decoy,TRY1,Decoy,0,-8.97916,-5.61,-3.4,-5.958685183293125
CCC(C)(C)n1nnnc1[C@H](c1cc2cc(C)cc(C)c2[nH]c1=O)[NH+](Cc1ccccc1)Cc1cccnc1,C06077698_decoy,TRY1,Decoy,0,-7.51147,-6.78,-1.78,-6.468029686715883
CC[NH+](CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1,C01486219_decoy,TRY1,Decoy,0,-9.45155,-5.97,-3.22,-6.100782493995033
COCCn1nnnc1[C@@H](c1cc2ccc(C)cc2[nH]c1=O)[NH+](Cc1ccccc1)Cc1ccccc1Cl,C06410026_decoy,TRY1,Decoy,0,-6.28689,-6.95,-2.23,-5.856670445780368
CCCC1=NN(c2ccc(F)cc2)C(=O)[C@@H]1/C=N/CC[NH+]1CCN(C(=S)Nc2ccc(F)cc2)CC1,C08846416_decoy,TRY1,Decoy,0,-8.25963,-8.14,-1.98,-6.302207367742676
C=CCc1ccc(OC[C@H](O)C[NH+]2CCC(CN3C(=O)c4cccc5cccc(c45)C3=O)CC2)c(OC)c1,C11847321_decoy,TRY1,Decoy,0,-9.65957,-7.61,-3.26,-6.5647531185593575
Cc1ccc(OC[C@H](O)C[NH+]2CCC(CN3C(=O)c4cccc5cccc(c45)C3=O)CC2)c(C(C)(C)C)c1,C12170600_decoy,TRY1,Decoy,0,-8.52255,-7.97,-3.66,-5.874857271275053
COc1ccc(Cn2nnnc2C[NH+](Cc2ccc(F)cc2)Cc2cc3ccc(C)c(C)c3[nH]c2=O)cc1,C12832963_decoy,TRY1,Decoy,0,-8.41001,-9.23,-3.76,-9.574854825624026
CC[C@H](c1nnnn1Cc1ccccc1)[NH+](Cc1ccccc1OC)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C13065238_decoy,TRY1,Decoy,0,-7.06263,-6.12,-2.0,-6.408344294845871
CCOc1ccc2[nH]c(=O)c(C[NH+](Cc3ccc(C)cc3)Cc3nnnn3CCc3ccccc3)cc2c1,C13065466_decoy,TRY1,Decoy,0,-8.22614,-6.51,-1.98,-5.613620135961052
COc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C(O)C(=O)N2CCC[NH+](C)C)cc1OC,C08964562_decoy,TRY1,Decoy,0,-9.03741,-4.97,-3.19,-5.810084536249569
Cc1cccc2cc([C@@H](c3nnnn3Cc3ccccc3)[NH+](Cc3ccccc3)Cc3cccnc3)c(=O)[nH]c12,C06443734_decoy,TRY1,Decoy,0,-7.96097,-6.37,-2.47,-6.0338050223483375
Cc1ccc(C)c2[nH]c(=O)c([C@H](c3nnnn3C3CCCC3)[NH+](CCc3ccccc3)Cc3ccccc3)cc12,C06405507_decoy,TRY1,Decoy,0,-8.27611,-6.8,-3.15,-6.435412940761471
CC[NH+](CC)CCCN1C(=O)C(=O)/C(=C(/O)c2c(C)nc3ccccn23)[C@H]1c1cccc(Br)c1,C09007851_decoy,TRY1,Decoy,0,-7.31536,-6.67,-2.03,-5.239893351932185
CCOc1ccc([C@H]2/C(=C(\O)c3ccc4c(c3)C[C@H](C)O4)C(=O)C(=O)N2CC[NH+](CC)CC)cc1OCC,C09311992_decoy,TRY1,Decoy,0,-9.12542,-6.45,-2.43,-7.532851472921904
CCOc1ccccc1C=NNC(=O)C[NH+]1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1,C19850459_decoy,TRY1,Decoy,0,-9.84532,-6.79,-4.28,-6.361887796036987
Cc1ccc(OC[C@H](O)CN2CC[NH+](CCN3C(=O)c4cccc5cccc(c45)C3=O)CC2)c(C(C)(C)C)c1,C19901845_decoy,TRY1,Decoy,0,-9.87835,-7.61,-3.25,-6.162244766810857
COc1ccc(CC[NH2+]Cc2cc(Br)c(OCc3ccc4c(c3)OCCO4)c(OC)c2)cc1,C20876889_decoy,TRY1,Decoy,0,-8.09039,-7.01,-3.66,-6.777487781706363
COc1ccccc1-c1coc2cc(OCC(=O)NCCSCc3ccc(C[NH+](C)C)o3)ccc2c1=O,C27103607_decoy,TRY1,Decoy,0,-8.60267,-6.45,-1.97,-6.323020032352827
CC[NH+](CC)CCC[C@@H](C)NC(=O)CSc1nc(Cl)cc(N2CCN(C(=O)CC(C)(C)C)[C@H](C)C2)n1,C33704843_decoy,TRY1,Decoy,0,-9.37155,-6.19,-2.09,-8.05491905362476
CCCCSc1nc(N2CC[NH+](CC(=O)Nc3ccc(OC)cc3)CC2)c2c3c(sc2n1)CCCC3,C34756161_decoy,TRY1,Decoy,0,-9.1004,-7.69,-2.65,-6.999389334703142
C=C(C)CSc1nc(N2CC[NH+](CC(=O)Nc3ccc(OC)cc3)CC2)c2c3c(sc2n1)CCC3,C34757247_decoy,TRY1,Decoy,0,-11.0546,-6.83,-1.1,-6.780812817664461
CC(C)(C)CC(C)(C)Nc1c(-c2ccccc2OS(=O)(=O)c2cccc3cccnc23)[nH+]c2ccccn12,C35191076_decoy,TRY1,Decoy,0,-6.45643,-8.66,-2.01,-8.271526617002426
CC[NH+](CC)CCC[C@@H](C)NC(=O)CSc1nc(Cl)cc(N2CCN(C(=O)C(C)(C)C)[C@H](C)C2)n1,C35293672_decoy,TRY1,Decoy,0,-8.2935,-4.99,-2.94,-5.466544830217481
CC[C@H](C)[NH+](Cc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(OC)cc2)o1)Cc1ccccc1OC,C35745098_decoy,TRY1,Decoy,0,-9.31153,-6.01,-4.01,-6.854508115336828
CC(C)N(C)c1onc(-c2ccccc2)c1C[NH+](Cc1ccc(F)cc1)C[C@H](O)COCc1ccco1,C35760156_decoy,TRY1,Decoy,0,-7.12576,-7.41,-2.31,-7.47528603332326
CCc1nn(-c2ccc(F)cc2)c(N2CC[NH+](C(C)C)CC2)c1CN(CC(C)C)C(=O)NC1CCCCC1,C35954320_decoy,TRY1,Decoy,0,-8.07688,-6.73,-3.31,-5.855679570906502
COc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(C[NH+](Cc3ccsc3)Cc3ccco3)o2)cc1,C36202705_decoy,TRY1,Decoy,0,-9.84483,-7.78,-4.0,-7.459443972245661
COc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(C[NH+](Cc3cccc(F)c3)C[C@@H]3CCCO3)o2)cc1,C36203003_decoy,TRY1,Decoy,0,-10.4305,-8.58,-4.66,-8.883308749881666
COc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(C[NH+](Cc3ccccc3C)C[C@H]3CCCO3)o2)cc1,C36203200_decoy,TRY1,Decoy,0,-10.1424,-8.29,-1.91,-7.846924747376598
COc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(C[NH+](Cc3ccco3)Cc3ccc(C)s3)o2)cc1,C36203509_decoy,TRY1,Decoy,0,-9.55252,-8.01,-3.13,-7.680336603654489
COCCC[NH+](Cc1c(-c2ccc(F)cc2)noc1N1CCOCC1)C[C@H](O)COc1ccccc1C,C36249713_decoy,TRY1,Decoy,0,-8.81943,-6.9,-2.0,-8.45173926582307
Cc1nn(-c2cccc(Cl)c2)c(Oc2ccccc2)c1C[NH+](C[C@@H](O)COCc1ccccc1)C1CC1,C36301774_decoy,TRY1,Decoy,0,-8.73357,-6.95,-2.28,-7.627156112546324
COc1cccc(Oc2c(C[NH+](C[C@H](O)COC(C)C)C[C@@H]3CCCO3)c(-c3ccccc3)nn2C)c1,C36305582_decoy,TRY1,Decoy,0,-8.27638,-6.86,-2.78,-7.491336220128212
Cc1ccccc1OC[C@H](O)C[NH+](Cc1ccco1)Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1,C36308143_decoy,TRY1,Decoy,0,-8.43238,-7.06,-3.32,-7.091411302786344
CCOc1cc(C(=O)NCC[NH+]2CCN(c3nc4c(C)ccc(C)c4s3)CC2)cc(OCC)c1OCC,C38776763_decoy,TRY1,Decoy,0,-9.57518,-6.53,-2.39,-6.780227498822313
C[C@@H](NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccc(C(C)(C)C)cc3)no2)C1)c1ccc(S(C)(=O)=O)cc1,C38903908_decoy,TRY1,Decoy,0,-10.3767,-5.19,-3.54,-6.043904207190703
Cc1ccc(OC[C@H](O)C[NH+](Cc2ccc(-c3cc(Cl)ccc3Cl)o2)[C@@H]2CCS(=O)(=O)C2)cc1,C40313098_decoy,TRY1,Decoy,0,-10.1576,-5.34,-2.21,-6.556823687046165
CCN(CC)c1ccc(C[NH+](C[C@@H](O)COc2ccccc2Br)[C@@H]2CCS(=O)(=O)C2)cc1,C40316956_decoy,TRY1,Decoy,0,-9.33886,-6.61,-1.69,-6.91866025347466
CC(C)(C)c1ccc(C[NH+](C[C@H](O)COc2ccccc2Br)[C@@H]2CCS(=O)(=O)C2)cc1,C40316986_decoy,TRY1,Decoy,0,-8.70397,-6.09,-1.33,-6.469821736474649
CCOc1cc(C=O)ccc1OC[C@H](O)C[NH+](Cc1ccc(Cl)cc1Cl)[C@@H]1CCS(=O)(=O)C1,C40320406_decoy,TRY1,Decoy,0,-10.6897,-7.07,-4.9,-8.191087276881559
CC(C)c1ccc([C@@H](CNC(=O)c2ccc(S(=O)(=O)c3ccc(Br)cc3)o2)[NH+](C)C)cc1,C40323086_decoy,TRY1,Decoy,0,-9.26135,-7.88,-4.75,-6.9054507032273005
CCCS(=O)(=O)N1CCC(CNC(=O)c2ccccc2Cl)(c2cccc(N3CCOCC3)[nH+]2)CC1,C40872911_decoy,TRY1,Decoy,0,-9.38166,-6.71,-2.3,-6.376120689495667
COc1ccc(Br)cc1-c1nc(C[NH+]2CCC(C(=O)NCCC3=CCCCC3)CC2)c(C)o1,C40985361_decoy,TRY1,Decoy,0,-11.1417,-7.26,-2.88,-7.828981103263316
COc1cccc(Oc2c(C[NH+](CC(C)C)C[C@H](O)CN3CCOCC3)c(C)nn2-c2ccccc2)c1,C36341980_decoy,TRY1,Decoy,0,-9.13395,-7.23,-3.59,-8.745461082862702
CCSC1=NSC2=NC(=O)/C(=C\c3cc(Cl)c(OCCOc4ccccc4)c(OC)c3)C(=[NH2+])N12,C20114655_decoy,TRY1,Decoy,0,-8.4357,-5.41,-3.32,-4.806098742499461
CCCC[NH+](CCCC)Cc1c(O)ccc2c1O/C(=C/c1cc(Br)cc3c1OCOC3)C2=O,C41584222_decoy,TRY1,Decoy,0,-9.64161,-6.71,-2.61,-9.41946244650004
CCC[NH+](CCC)Cc1c(O)ccc2c(=O)c(Oc3ccccc3Br)c(C(F)(F)F)oc12,C41584550_decoy,TRY1,Decoy,0,-8.10341,-5.02,-3.9,-6.4588920452261815
C[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC(=O)NCCC1=c2ccccc2=[NH+]C1,C63350099_decoy,TRY1,Decoy,0,-8.96724,-7.68,-2.21,-6.061799449497371
CC(C)(C)OC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@H](SCC(=O)c2ccc(Cl)cc2)O1,C63458467_decoy,TRY1,Decoy,0,-9.37215,-8.44,-2.84,-7.779326705342767
CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CO)(C(=O)OC)[NH2+][C@H]2c1ccc(O)cc1,C04885057_decoy,TRY1,Decoy,0,-8.70488,-7.09,-4.0,-8.247314601546732
CC1CCC2(CC1)NC(=O)N(NC(=O)C[NH2+][C@@H](C)c1ccco1)C2=O,C07801579_decoy,TRY1,Decoy,0,-6.44293,-7.0,-0.79,-6.531307102118703
Cc1ccc2nc(C[NH2+]Cc3ccc(S(N)(=O)=O)cc3)cc(=O)n2c1,C07813777_decoy,TRY1,Decoy,0,-7.99144,-5.99,-2.38,-4.8867891392558445
O=S1(=O)CC[C@H](NC(=S)NCC[NH2+][C@@H]2CCS(=O)(=O)C2)C1,C05612920_decoy,TRY1,Decoy,0,-8.70359,-5.4,-1.71,-5.148632953249148
CCC[NH+]1CCc2c(sc(NC(=O)c3cc(C)no3)c2C(N)=O)C1,C13595675_decoy,TRY1,Decoy,0,-7.72255,-6.5,-4.12,-6.654442746806501
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)C1CCCC1,C20465265_decoy,TRY1,Decoy,0,-5.78364,-6.1,-0.98,-5.37443785075267
CCOc1c(C[NH2+]CCNCCO)cc(Br)cc1OC,C20477663_decoy,TRY1,Decoy,0,-8.26628,-4.06,-2.38,-4.817955644293899
Cc1nc(NC(=O)C[NH+]2CCC(C(N)=O)CC2)nc2c1C(=O)CC(C)(C)C2,C20633914_decoy,TRY1,Decoy,0,-8.86781,-6.03,-4.92,-5.796835044810131
C[C@H]([NH2+]CC(=O)c1c(N)n(C)c(=O)n(C)c1=O)c1ccccc1Cl,C25396284_decoy,TRY1,Decoy,0,-6.44034,-6.96,-3.04,-6.717139480779238
CCCNC(=O)C[NH+]1CCC(NC(=O)CCNC(=O)[C@@H]2C[C@H]2C)CC1,C31932125_decoy,TRY1,Decoy,0,-7.51999,-5.64,-3.32,-6.121243508823709
CCCNC(=O)C[NH+]1CCC(NC(=O)CCNC(=O)[C@H]2C[C@H]2C)CC1,C31932126_decoy,TRY1,Decoy,0,-7.38038,-5.26,-2.72,-6.120485712326804
CC1(C)NC(=O)N(CC[NH+]2CCC(C(=O)Nc3ccccc3O)CC2)C1=O,C32804020_decoy,TRY1,Decoy,0,-5.85519,-7.38,-2.09,-4.7132671248399305
Cc1ccc([C@@H]2c3ccc(O)cc3Oc3nc[n+](CCCO)c(N)c32)cc1,C05348821_decoy,TRY1,Decoy,0,-8.58196,-5.67,-1.51,-5.510887913581252
COc1ccccc1[C@@H]1c2ccc(O)cc2Oc2nc[n+](CCO)c(N)c21,C05350478_decoy,TRY1,Decoy,0,-6.18863,-5.47,-1.26,-4.512878193895219
[NH3+][C@@H](Cc1c[nH]c2ccccc12)c1nnc(SCc2ccccc2)o1,C01283334_decoy,TRY1,Decoy,0,-8.82214,-6.21,-1.31,-6.101958242542337
O=C(NCCCO)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39605516_decoy,TRY1,Decoy,0,-7.74703,-5.0,-0.99,-5.646859046761822
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39683873_decoy,TRY1,Decoy,0,-7.1731,-5.43,-2.09,-5.91383481956039
CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2,C39683919_decoy,TRY1,Decoy,0,-8.07862,-4.72,-1.22,-5.256868129697314
C[NH+](CC(N)=O)CC(=O)NC1(c2ccc3c(c2)OCCO3)CCCC1,C40539619_decoy,TRY1,Decoy,0,-7.08407,-6.76,-0.63,-5.3913981926188015
Nc1c(NC[C@H]2CCCO2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40687166_decoy,TRY1,Decoy,0,-6.75853,-4.98,-2.41,-4.397774862673123
CNC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@H](CC(C)C)[NH+](C)C,C41322480_decoy,TRY1,Decoy,0,-7.12524,-6.74,-3.09,-6.061945347286173
C=CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1,C43608266_decoy,TRY1,Decoy,0,-7.25833,-7.89,-0.03,-5.50667990024591
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@H]1CN(C(=O)c2cccnc2)CC12CC[NH2+]CC2,C44714000_decoy,TRY1,Decoy,0,-7.86944,-4.87,-1.01,-5.556846692208976
CC[NH+]1CCN(c2ccc(NC(=O)C(=O)NCCCO)c(C)c2)CC1,C48602675_decoy,TRY1,Decoy,0,-6.9856,-5.74,-0.87,-4.894010921036855
CCS(=O)(=O)NCCCNC(=O)NC1CC[NH+](CC(C)C)CC1,C51682160_decoy,TRY1,Decoy,0,-8.98112,-5.11,-2.98,-5.4253569941315485
CCS(=O)(=O)NCCCNC(=O)NC[C@@H](C)[NH+]1CCCC[C@@H]1C,C51684859_decoy,TRY1,Decoy,0,-8.59449,-5.65,-3.33,-5.517711741486768
CCS(=O)(=O)NCCCNC(=O)N[C@@H](C)C[NH+]1CCC[C@H](C)C1,C51712223_decoy,TRY1,Decoy,0,-7.55798,-5.5,-2.49,-5.347202725353972
CCS(=O)(=O)NCCCNC(=O)NC[C@@H](C)[NH+]1CCC(C)CC1,C51713749_decoy,TRY1,Decoy,0,-8.02227,-6.12,-2.65,-5.638116815858687
CN(Cc1n[nH]c2c1CCCCC2)C(=O)[C@H]1CCC[NH+](CC(N)=O)C1,C55281984_decoy,TRY1,Decoy,0,-8.11268,-6.51,-1.22,-5.256961209230924
CCc1[nH+]ccn1CC1(CNC(=O)CSc2nnc(N)s2)CC1,C55283536_decoy,TRY1,Decoy,0,-8.50189,-6.59,-2.15,-7.245183050497626
CCNC(=O)NC(=O)[C@H](C)[NH+](C)CC(=O)Nc1ccccc1SC,C31036362_decoy,TRY1,Decoy,0,-6.70778,-5.19,-1.3,-5.118782993990351
COCC[NH+](CCOC)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C57798225_decoy,TRY1,Decoy,0,-9.07786,-4.52,-2.93,-7.984194144030077
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC[C@H](C2OCCO2)C1,C60363222_decoy,TRY1,Decoy,0,-6.54277,-7.59,-0.02,-8.917537073279558
NC(=O)[C@H]1C=CS[C@@H]1NC(=O)COC(=O)CC1=c2ccccc2=[NH+]C1,C63731522_decoy,TRY1,Decoy,0,-7.85485,-5.27,-2.05,-5.109014719284054
CCN1C(S[C@H](C)C(=O)C2=c3ccccc3=[NH+]C2)=NN[C@@H]1CCC(N)=O,C64137726_decoy,TRY1,Decoy,0,-7.61169,-7.32,-2.63,-7.406656625129351
Nc1nc(N2CCOCC2)cc(N2CCC([NH+]3CCC[C@H](CO)C3)CC2)n1,C65393551_decoy,TRY1,Decoy,0,-8.40579,-5.5,-1.19,-4.477762722245271
O=C(NCCO)C1=C[C@@H]2CN(C(=O)[C@H]3C=c4cc(F)ccc4=[NH+]3)CCN2N1,C65404858_decoy,TRY1,Decoy,0,-6.66745,-5.28,-1.3,-4.591284467183226
CCCCc1[nH]cc(CN2CCN([C@H]3N=C(C(N)=O)CS3)CC2)[nH+]1,C65425997_decoy,TRY1,Decoy,0,-9.29799,-6.78,-1.14,-6.417258923054206
NC(=O)C[NH+]1CCC[C@@H](NC(=O)c2cc(F)cc(Br)c2)C1,C66448461_decoy,TRY1,Decoy,0,-7.9011,-5.25,-2.06,-5.046469340751494
NC(=O)C[NH+]1CCC[C@@H](NC(=O)c2ccc(F)cc2Br)C1,C66451752_decoy,TRY1,Decoy,0,-7.40795,-5.53,-1.24,-4.587058665125737
C=CC[NH+](CC(=O)Nc1sccc1C(N)=O)[C@@H]1CCS(=O)(=O)C1,C66559567_decoy,TRY1,Decoy,0,-8.92611,-5.08,-3.11,-6.409401608057642
CNC(=O)NC(=O)CCC[NH+]1CCC(NC(=O)CC2CCCC2)CC1,C66876981_decoy,TRY1,Decoy,0,-7.33286,-5.24,-2.94,-5.151013525156365
CC(=O)Nc1cc(NC(=O)NCCCCn2cc[nH+]c2)c(F)cc1F,C66981960_decoy,TRY1,Decoy,0,-8.15645,-6.41,-5.32,-6.319144506194319
CCC[NH+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)C1,C67393783_decoy,TRY1,Decoy,0,-10.0721,-7.95,-2.55,-6.342601093628511
C[C@@H](C(=O)NC(N)=O)N1CCN(Cc2cn3cc(Cl)ccc3[nH+]2)CC1,C67411373_decoy,TRY1,Decoy,0,-7.4877,-7.25,-3.03,-5.317336887657308
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@H]2CCOc3ccccc32)CC1,C67582268_decoy,TRY1,Decoy,0,-8.26996,-6.56,-1.44,-5.248828089051662
CC(C)CN1CCO[C@@H](CNC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)C1,C67609290_decoy,TRY1,Decoy,0,-9.77917,-6.36,-1.42,-6.899810313331128
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)NCCC[NH+]1CCCC1,C67611986_decoy,TRY1,Decoy,0,-9.08791,-5.41,-2.21,-5.571250856387685
Cc1cc(C)n(C[C@@H](C)NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)n1,C67629273_decoy,TRY1,Decoy,0,-7.99982,-6.43,-2.08,-6.925914996267001
Cc1cc(C)n(C[C@H](C)NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)n1,C67629280_decoy,TRY1,Decoy,0,-7.71634,-6.14,-1.47,-5.789015611554455
CC[C@@H](C(=O)NC(C)(C)C)N(Cc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C04161152_decoy,TRY1,Decoy,0,-7.83951,-7.01,-1.4,-9.072335899688666
C=CCNC(=S)NNc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1,C05382781_decoy,TRY1,Decoy,0,-7.39743,-7.08,-1.18,-6.338020119467453
O=c1[nH]c2ccc(Cl)cc2nc1/C(=N\Nc1ccccc1)[C@H](O)[C@@H](O)CO,C05286365_decoy,TRY1,Decoy,0,-8.92502,-7.65,-1.19,-7.494122166848355
O=c1[nH]c2ccc(Cl)cc2nc1/C(=N\Nc1ccccc1)[C@@H](O)[C@@H](O)CO,C05286367_decoy,TRY1,Decoy,0,-8.68147,-6.71,-0.03,-6.020721495782312
O=C1N[C@H](c2ccc(O)c(O)c2)[C@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1,C06222068_decoy,TRY1,Decoy,0,-7.07651,-6.36,-0.74,-5.366636834823647
Nc1nc(COC(=O)c2cccc(Cl)c2N)nc(Nc2ccc(F)cc2)n1,C08855649_decoy,TRY1,Decoy,0,-8.62632,-6.73,-2.92,-4.995745442445996
Nc1c(C(=O)Nc2ccc(OC(F)F)cc2)sc(Nc2ccc(Cl)cc2)c1C(=O)NC1CC1,C03277074_decoy,TRY1,Decoy,0,-9.21895,-5.25,-1.82,-5.577078738887406
C/C=C\C1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)[C@@H]([NH3+])c3ccc(O)cc3)[C@H]2SC1,C11592642_decoy,TRY1,Decoy,0,-8.45485,-7.62,-3.0,-7.276225145955632
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1,C12702417_decoy,TRY1,Decoy,0,-8.75729,-8.28,-1.47,-10.132647029432958
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCCC2)c2cccs2)c1,C12710915_decoy,TRY1,Decoy,0,-8.05712,-6.46,-3.61,-5.9841612129469794
COc1cc(NC(=O)c2sc3nc(N)c(C#N)cc3c2N)cc(OC)c1OC,C20000503_decoy,TRY1,Decoy,0,-8.42182,-4.86,-2.58,-7.732456275980525
Cc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n(N)c1=O,C03318187_decoy,TRY1,Decoy,0,-10.8664,-7.35,-1.15,-8.409267400547968
CC[C@@H](C)c1ccc(NC(=O)CCSc2n[nH]c(N/N=C(\C)c3ccc(N)cc3)n2)cc1,C20836797_decoy,TRY1,Decoy,0,-9.99665,-9.47,-1.8,-8.221508016042286
Nc1c(Cl)c(Cl)nc(C(=O)NNC(=S)NC[C@H]2CCCO2)c1Cl,C16273803_decoy,TRY1,Decoy,0,-9.32495,-5.55,-1.25,-6.75070776050951
N#CC1=C(N)N=C(SCC(=O)Nc2nccs2)[C@H](C(N)=O)C12CCCCC2,C23224683_decoy,TRY1,Decoy,0,-9.13663,-7.39,-3.02,-8.09498577118513
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NCCO)[C@H](O)C[C@@H]1O,C27640805_decoy,TRY1,Decoy,0,-10.7759,-5.21,-1.51,-7.078717653134021
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NCCO)[C@H](O)C[C@H]1O,C27640816_decoy,TRY1,Decoy,0,-10.6323,-5.62,-3.59,-8.722647378396246
CCCCC[C@H](O)/C=C/[C@H]1[C@@H](C/C=C\CCCC(=O)NCCO)[C@H](O)C[C@@H]1O,C27644578_decoy,TRY1,Decoy,0,-10.9512,-6.04,-2.66,-7.313599077833701
COc1ccc(NC(=O)/C=C(/C)NNC(=O)c2ccc(O)cc2O)cc1Cl,C04871624_decoy,TRY1,Decoy,0,-8.53033,-8.74,-1.16,-10.384562715621112
C[C@H](NS(=O)(=O)c1c(Br)cc(N)cc1Br)C(N)=O,C35791897_decoy,TRY1,Decoy,0,-6.69904,-5.17,-1.8,-4.549930566708038
CCCN(C(=O)c1ccccc1O)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36567667_decoy,TRY1,Decoy,0,-8.05224,-6.94,-2.83,-11.059529844259144
CC(C)[C@@H](Sc1nc(N)c2c3c(sc2n1)C[C@H](C)CC3)C(=O)NC(N)=O,C36812556_decoy,TRY1,Decoy,0,-8.96326,-8.28,-2.0,-6.473087070565532
CC(=O)Cc1cc(=O)c2c(C)cc(O)c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c2o1,C05890342_decoy,TRY1,Decoy,0,-6.21142,-6.96,-1.51,-5.2178496311887
CC1=C(CC/C(C)=C\COC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(C)(C)[C@H](C)CC1,C31165656_decoy,TRY1,Decoy,0,-8.63001,-5.38,-2.45,-5.623766041939653
O=C(C[C@@H]1CS[C@@H](NC(=O)NC2CCCCC2)N1)NCCc1c[nH]c2ccccc12,C39709739_decoy,TRY1,Decoy,0,-10.5086,-8.44,-1.54,-7.417576937553719
Cc1c(C(=O)NNC(=O)c2ccco2)oc2c1/C(=N/NC(N)=S)CC(C)(C)C2,C39856212_decoy,TRY1,Decoy,0,-6.60502,-7.36,-4.27,-5.125492843515088
Cc1cc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)no1,C40681061_decoy,TRY1,Decoy,0,-7.83056,-6.18,-1.99,-6.843958744160164
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3cc(C(F)(F)F)ccc3Cl)c2N)cc1,C40682718_decoy,TRY1,Decoy,0,-7.87189,-8.73,-3.1,-6.492628786919073
COc1ccc(Cl)cc1Nc1ncnc(NNC(=O)c2ccc(C)cc2)c1N,C40702480_decoy,TRY1,Decoy,0,-8.90718,-6.69,-2.79,-7.773983564643302
Cc1ccc(Cl)cc1Nc1ncnc(NNC(=O)C(c2ccccc2)c2ccccc2)c1N,C40705008_decoy,TRY1,Decoy,0,-8.85199,-6.53,-1.61,-5.989586564665873
CC(=O)Nc1ccc(Nc2ncnc(Nc3ccc4c(c3)OCCO4)c2N)cc1,C40762176_decoy,TRY1,Decoy,0,-7.46334,-6.39,-2.15,-5.008467038451742
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1nccs1,C40780866_decoy,TRY1,Decoy,0,-8.76696,-7.27,-2.36,-6.735390964410703
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccccc1Cl,C40781312_decoy,TRY1,Decoy,0,-8.49294,-6.28,-1.89,-5.779244813050635
COc1ccc(C(=O)NNc2ncnc(Nc3ccc(I)cc3)c2N)cc1,C40782374_decoy,TRY1,Decoy,0,-9.05607,-5.66,-2.26,-5.755422039226082
CC(C)(C)NNc1ncnc(Nc2ccc(I)cc2)c1N,C40782387_decoy,TRY1,Decoy,0,-8.14981,-4.5,-2.59,-4.754298633570105
COc1ccc(Nc2ncnc(NNC(=O)c3ccc(Br)cc3)c2N)cc1,C40782569_decoy,TRY1,Decoy,0,-8.11612,-5.94,-1.21,-6.744416294673006
Nc1c(NNC(=O)c2ccc(F)cc2)ncnc1Nc1ccc(F)c(Cl)c1,C40784619_decoy,TRY1,Decoy,0,-7.97932,-6.54,-1.44,-5.386761695203008
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3cccc(Br)c3)c2N)cc1,C40794676_decoy,TRY1,Decoy,0,-8.49267,-8.56,-2.5,-6.746886486424637
CCCCC[C@@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NCCO)[C@@H](O)C[C@H]1O,C43772157_decoy,TRY1,Decoy,0,-10.1035,-6.55,-3.33,-7.5795622911117055
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)cc23)O[C@H](CO)[C@H](O)[C@@H]1O,C44167795_decoy,TRY1,Decoy,0,-8.28311,-6.0,-2.49,-5.473226040328775
O=C(c1cccs1)[C@H]1[C@@H](c2ccc(O)c(O)c2)NC(=S)N[C@]1(O)C(F)(F)F,C57531387_decoy,TRY1,Decoy,0,-8.04955,-5.59,-1.07,-5.261603064287592
Cc1ccc(NC(=[NH2+])Nc2nc(CSc3nnc(C)s3)cc(=O)[nH]2)c(C)c1,C18164640_decoy,TRY1,Decoy,0,-9.1294,-5.97,-2.22,-5.27314670863651
COc1cc(OC)c([C@H]2C(C(N)=O)=C(N)Oc3[nH]nc(C)c32)cc1Br,C58950855_decoy,TRY1,Decoy,0,-5.6398,-5.11,-3.29,-4.52267796179142
N#Cc1cc(C#N)c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nc1N,C58951847_decoy,TRY1,Decoy,0,-11.1901,-6.37,-4.33,-7.773279339963321
COc1ccccc1/C=N/NC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)cc1O,C59385758_decoy,TRY1,Decoy,0,-8.35622,-5.73,-3.17,-5.2423726483046815
C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl,C06533284_decoy,TRY1,Decoy,0,-9.09183,-7.61,-1.01,-10.10051408530784
Cc1ccccc1Nc1nc(N)nc(CSc2nc(N)c(C#N)cc2C#N)n1,C60582952_decoy,TRY1,Decoy,0,-7.8982,-7.92,-1.89,-6.4058370303799945
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)CCCCNC(N)=O)cc2C1,C24305943_decoy,TRY1,Decoy,0,-7.96187,-7.07,-2.7,-7.571900517508603
C[C@H]1CCc2c(sc(NC(=O)CSC3=NC(=O)CC(N)=N3)c2C(N)=O)C1,C63229005_decoy,TRY1,Decoy,0,-9.20552,-7.25,-2.31,-6.913259659975018
Cc1cc(Br)cc(C)c1O[C@H](C)c1nc(N)nc(C)c1C(=O)NN,C66134871_decoy,TRY1,Decoy,0,-6.83851,-5.32,-2.78,-4.40003271134015
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(-c2ccc(Cl)cc2)o1,C04488476_decoy,TRY1,Decoy,0,-8.45168,-8.19,-2.62,-6.873976775246677
O=C([O-])c1c(C[NH+]2CCCCC2)c(O)c(O)c(O)c1C[NH+]1CCCCC1,C01603622_decoy,TRY1,Decoy,0,-7.46034,-6.18,-2.54,-5.226802057510117
CC1(C)CC(NC(=O)CCNC(=O)N2CC(=O)Nc3ccccc32)CC(C)(C)[NH2+]1,C20590958_decoy,TRY1,Decoy,0,-7.10299,-7.1,-1.5,-5.42175274442268
CCCC[C@H]1C[C@](C)(c2csc(NCCCNC(N)=S)[nH+]2)OC1=O,C27828755_decoy,TRY1,Decoy,0,-8.80609,-4.64,-2.14,-6.388727833549088
CCCCNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(NC(=O)CC)cc1,C30499377_decoy,TRY1,Decoy,0,-6.67779,-6.47,-2.27,-6.122424685860148
CCCCNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(NC(=O)CC)cc1,C30499381_decoy,TRY1,Decoy,0,-7.81847,-5.75,-1.67,-5.472992137439483
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)NC(=O)NCC(C)C)cc1,C30499809_decoy,TRY1,Decoy,0,-7.71445,-6.2,-1.78,-4.989311358569905
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC(=O)NC(C)(C)C)cc1,C30499849_decoy,TRY1,Decoy,0,-6.49477,-7.15,-2.15,-5.9679251133155375
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC(=O)NC(C)(C)C)cc1,C30499861_decoy,TRY1,Decoy,0,-7.33965,-6.85,-5.18,-2.888784799849061
NC(=O)C[NH+]1CCC(NC(=O)N[C@@H]2CCSc3ccc(F)cc32)CC1,C32802702_decoy,TRY1,Decoy,0,-9.00676,-4.56,-1.64,-5.955649267910903
NC(=O)C[NH+]1CCC(NC(=O)N[C@H]2CCSc3ccc(F)cc32)CC1,C32802703_decoy,TRY1,Decoy,0,-7.77534,-5.22,-3.41,-4.749858695262033
CCOc1c(Br)cc(Cl)cc1NC(=O)CNC(=O)C[NH3+],C37628092_decoy,TRY1,Decoy,0,-7.84185,-5.98,-2.76,-7.9340531632164675
CCCCc1ccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc1,C40680039_decoy,TRY1,Decoy,0,-7.87273,-5.65,-1.71,-6.119641660665979
CCCCc1ccc(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40680295_decoy,TRY1,Decoy,0,-6.83118,-7.66,-1.75,-6.219505245651946
Cc1cc(Nc2[nH+]cnc(Nc3ccc(Br)cn3)c2N)no1,C40680982_decoy,TRY1,Decoy,0,-8.05605,-6.46,-1.4,-5.16535808426115
Cc1cc(C)cc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)c1,C40682281_decoy,TRY1,Decoy,0,-8.78354,-6.27,-2.05,-4.750490343546698
CCc1ccccc1Nc1ncnc(Nc2cccc3[nH+]c(C)ccc23)c1N,C40688375_decoy,TRY1,Decoy,0,-8.69275,-5.85,-2.74,-5.492198042913246
CCc1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40688598_decoy,TRY1,Decoy,0,-8.33562,-6.71,-2.19,-5.902270571618671
Cc1ccc2c(Nc3ncnc(Nc4ccc(C)c(C)c4)c3N)cccc2[nH+]1,C40703084_decoy,TRY1,Decoy,0,-7.89022,-7.1,-2.0,-5.316467533620105
Cc1ccc(C)c(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)c1,C40704750_decoy,TRY1,Decoy,0,-8.8104,-7.28,-1.35,-8.089520444384084
Nc1c(NC2CCCCC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40708549_decoy,TRY1,Decoy,0,-8.36947,-6.98,-3.24,-5.593386781511072
C[NH+]1CCN(c2ncnc(NNC(=O)c3ccc(Cl)cc3)c2N)CC1,C40726335_decoy,TRY1,Decoy,0,-8.32392,-7.43,-1.11,-7.117843028649936
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(-c2ccccc2Cl)o1,C40744387_decoy,TRY1,Decoy,0,-8.44634,-7.68,-0.86,-7.555706690595265
Cc1ccc2c(Nc3ncnc(Nc4cccc(C)c4C)c3N)cccc2[nH+]1,C40755298_decoy,TRY1,Decoy,0,-8.44151,-5.76,-2.41,-5.334893733904536
Nc1c(NCC[NH+]2CCCCC2)ncnc1Nc1cccc2ncccc12,C40756405_decoy,TRY1,Decoy,0,-8.66989,-8.0,-2.27,-7.349418090806914
Cc1ccc2cccc(Nc3ncnc(NN4CC[NH+](C)CC4)c3N)c2n1,C40756838_decoy,TRY1,Decoy,0,-8.07638,-5.99,-2.32,-5.49910278035422
COCCCNc1nc[nH+]c(NN(c2ccccc2)c2ccccc2)c1N,C40757131_decoy,TRY1,Decoy,0,-6.72661,-5.6,-0.62,-5.071777689148589
CC(C)CCNc1nc[nH+]c(NN(c2ccccc2)c2ccccc2)c1N,C40777938_decoy,TRY1,Decoy,0,-7.49436,-5.69,-2.92,-5.994364438584335
Cc1ccc2c(Nc3ncnc(Nc4cccc(Cl)c4)c3N)cccc2[nH+]1,C40781895_decoy,TRY1,Decoy,0,-8.64581,-7.18,-1.7,-6.482181339175434
Cc1ccc2c(Nc3ncnc(Nc4ccc(F)cc4F)c3N)cccc2[nH+]1,C40800299_decoy,TRY1,Decoy,0,-8.59006,-8.27,-2.09,-10.077895668097955
Cc1ccc2c(Nc3ncnc(NC4CCCCCC4)c3N)cccc2[nH+]1,C40800979_decoy,TRY1,Decoy,0,-8.1898,-7.87,-0.91,-12.72551885328461
Cc1c(C(=O)NN2CC[NH+](C)CC2)oc2c1/C(=N/NC(N)=S)CCC2,C40824445_decoy,TRY1,Decoy,0,-9.71967,-6.68,-1.32,-8.334341757007905
C[NH+]1CCC(NS(=O)(=O)c2cc(Br)cnc2NN)CC1,C41070066_decoy,TRY1,Decoy,0,-7.51506,-5.81,-1.82,-5.027843172172841
C[NH+]1CCC[C@H](NS(=O)(=O)c2cc(Br)cnc2NN)C1,C41070166_decoy,TRY1,Decoy,0,-7.85489,-5.39,-2.91,-4.7138678978679485
CCOC(=O)N[C@H](CNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)CC(C)C,C42909066_decoy,TRY1,Decoy,0,-7.85403,-4.53,-1.92,-5.229922945534219
Cn1nc(C(F)(F)F)c([C@H]([NH3+])CC(N)=O)c1Oc1ccc(Cl)cc1,C44255329_decoy,TRY1,Decoy,0,-8.14981,-4.99,-1.81,-5.647579229768337
CC[NH+](CC)[C@@H](CNC(=O)NNC(=O)Nc1ccccc1C)CC(C)C,C45538566_decoy,TRY1,Decoy,0,-7.15088,-7.32,-2.58,-6.0722829762562025
CC/C(N[C@@H]1CCCC[C@@H]1[NH3+])=C1/C(=O)NC(=O)N(C2CCCCC2)C1=O,C20267175_decoy,TRY1,Decoy,0,-7.69174,-6.48,-2.36,-5.113944808572806
CC/C(N[C@H]1CCCC[C@@H]1[NH3+])=C1/C(=O)NC(=O)N(C2CCCCC2)C1=O,C20267177_decoy,TRY1,Decoy,0,-8.81575,-6.61,-2.04,-6.334861062576011
CC/C(N[C@@H]1CCCC[C@H]1[NH3+])=C1/C(=O)NC(=O)N(C2CCCCC2)C1=O,C20267179_decoy,TRY1,Decoy,0,-10.331,-6.3,-1.27,-6.088701868658664
O=C(C[NH+]1CCC(NC(=O)NC2CCCCC2)CC1)NC(=O)NC1CC1,C55027332_decoy,TRY1,Decoy,0,-7.76238,-5.11,-0.81,-5.27721048821409
COc1ccccc1CC(=O)NNC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C56541045_decoy,TRY1,Decoy,0,-6.64288,-7.03,-2.04,-5.1451738814841
C[C@H](NC(=O)Nc1ccc[nH+]c1N1CCCC1)c1ccc2[nH]c(=O)[nH]c2c1,C58229281_decoy,TRY1,Decoy,0,-8.7302,-6.99,-0.76,-6.105185027579887
C[C@@H](NC(=O)Nc1ccc[nH+]c1N1CCCC1)c1ccc2[nH]c(=O)[nH]c2c1,C58229283_decoy,TRY1,Decoy,0,-7.87583,-7.0,-0.76,-6.443358118725394
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3cc(O)ccc3cc2C(=O)Nc2cccc(Cl)c2Cl)cc1,C59170608_decoy,TRY1,Decoy,0,-9.16303,-6.57,-2.13,-5.854946210350428
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3cc(O)ccc3cc2C(=O)Nc2ccc(Cl)cc2Cl)cc1,C59170613_decoy,TRY1,Decoy,0,-10.5312,-8.98,-0.81,-9.088572852799608
CC1CC[NH+]([C@@H](C)CNC(=O)Nc2ccccc2SCC(N)=O)CC1,C65408648_decoy,TRY1,Decoy,0,-9.00668,-5.04,-4.29,-5.787710613502507
NC(=O)C1(NC(=O)C2(Oc3ccc(Cl)cc3)CC[NH2+]CC2)CCCC1,C65432732_decoy,TRY1,Decoy,0,-6.93246,-6.93,-1.66,-5.378055457362935
NNC(=O)C[C@H]1C(=O)NCC[NH+]1Cc1cccc(OC[C@H]2CCCO2)c1,C66115366_decoy,TRY1,Decoy,0,-8.18289,-6.66,-1.65,-5.734201340592538
NNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1ccc(OC[C@@H]2CCCO2)cc1,C66115388_decoy,TRY1,Decoy,0,-7.0235,-5.72,-0.6,-4.80494641541537
CCCCCC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCC[NH+](C)C,C04237041_decoy,TRY1,Decoy,0,-10.4809,-6.99,-2.17,-7.554700592292851
Cc1ccc(Nc2[nH+]c(Nc3ccc(C)cc3)c([N+](=O)[O-])c(N)c2[N+](=O)[O-])cc1,C04981631_decoy,TRY1,Decoy,0,-5.70038,-7.81,-1.09,-5.675850271185018
[NH2+]=C(Nc1nc(O)c2c(n1)CCCC2)Nc1ccccc1Sc1ccccc1,C09111218_decoy,TRY1,Decoy,0,-10.179,-8.23,-1.65,-9.705847255269148
CC(C)c1ccc([C@H]([NH2+]CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2cccs2)cc1,C09544802_decoy,TRY1,Decoy,0,-8.95298,-7.54,-0.9,-7.498920683234858
CC(C)c1ccc([C@@H]([NH2+]CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2cccs2)cc1,C09544803_decoy,TRY1,Decoy,0,-9.26006,-8.29,-2.68,-8.597986577609884
NC(=O)CC[C@@H]1[NH2+][C@@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(Cc3ccccc3Cl)C(=O)[C@H]12,C12872767_decoy,TRY1,Decoy,0,-6.90579,-7.55,-1.6,-6.021330436763104
Cc1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C08636336_decoy,TRY1,Decoy,0,-10.0025,-6.98,-2.11,-6.938908066344499
C#CCNC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)Nc3cccc(C(F)(F)F)c3)C[NH+]12,C15708449_decoy,TRY1,Decoy,0,-8.33495,-5.05,-2.04,-5.195681307304417
CC[NH+](CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1,C16697102_decoy,TRY1,Decoy,0,-9.2187,-7.61,-4.41,-7.4226119796923955
COCCNC(=O)C[NH+]1CCN([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C23367918_decoy,TRY1,Decoy,0,-10.0149,-5.14,-3.6,-6.7678864533088765
C[NH+](C)CCCNc1cc(NC2CCCCC2)c(N)c2c1C(=O)c1ccccc1C2=O,C06661737_decoy,TRY1,Decoy,0,-8.15555,-6.76,-1.64,-7.112931108334694
COc1ccc(-c2cc3ccccc3n2C[C@H](O)C[NH2+]C(CO)(CO)CO)cc1,C04058420_decoy,TRY1,Decoy,0,-7.79057,-5.75,-1.58,-5.283698726499826
CCN[C@H]([NH2+]CC)C(=O)COc1ccc([C@@H]2C3=NC(C(F)(F)F)=N[C@H]3OC(N)=C2C#N)cc1OC,C39167627_decoy,TRY1,Decoy,0,-9.5508,-6.72,-2.72,-7.098107947056299
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)NCCc4ccc(O)c(O)c4)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39661898_decoy,TRY1,Decoy,0,-10.7658,-7.7,-1.58,-6.902424489644536
CC1=C[C@H](C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)NN1C,C39684262_decoy,TRY1,Decoy,0,-8.65038,-9.29,-1.85,-8.371646326081073
Cc1cc(C)cc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c1,C40681962_decoy,TRY1,Decoy,0,-8.28819,-5.96,-1.12,-6.834945531089465
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1cc(C(F)(F)F)ccc1Cl,C40682528_decoy,TRY1,Decoy,0,-8.29287,-5.57,-2.17,-5.7470278443636165
CCc1ccccc1Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40688255_decoy,TRY1,Decoy,0,-8.06079,-6.42,-2.42,-7.066969705740743
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccccc1C(F)(F)F,C40701778_decoy,TRY1,Decoy,0,-7.4163,-7.65,-1.29,-6.685972388554679
Cc1ccc2c(Nc3ncnc(Nc4ccccc4C(F)(F)F)c3N)cccc2[nH+]1,C40701898_decoy,TRY1,Decoy,0,-7.32389,-8.17,-2.51,-8.259829036211332
COc1ccc(Cl)cc1Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40702401_decoy,TRY1,Decoy,0,-8.03144,-7.0,-4.22,-6.977100426315343
Cc1ccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)cc1C,C40702839_decoy,TRY1,Decoy,0,-8.19764,-5.96,-1.55,-6.040360605185175
Cc1ccc(C)c(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c1,C40704516_decoy,TRY1,Decoy,0,-7.38878,-7.82,-2.25,-6.781821588553722
Cc1cccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c1C,C40755057_decoy,TRY1,Decoy,0,-8.33665,-7.31,-1.11,-7.219830312914964
Cc1ccc(Nc2[nH+]cnc(NN(c3ccccc3)c3ccccc3)c2N)c(C)c1,C40755361_decoy,TRY1,Decoy,0,-7.49159,-7.25,-1.62,-6.705458265441412
Nc1c(NC23CC4CC(CC(C4)C2)C3)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40755662_decoy,TRY1,Decoy,0,-9.88662,-8.09,-0.65,-10.218228579911042
Nc1c(NCCC2=CCCCC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40755963_decoy,TRY1,Decoy,0,-8.54933,-7.76,-4.0,-6.650526240289423
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cccc(Cl)c1,C40777754_decoy,TRY1,Decoy,0,-8.63705,-7.72,-1.11,-6.189435901455894
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1cccc(C(F)(F)F)c1,C40777757_decoy,TRY1,Decoy,0,-7.45178,-7.76,-2.59,-6.9024774843813965
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(Cl)cc1,C40777763_decoy,TRY1,Decoy,0,-8.69573,-6.43,-1.17,-5.8211975746086
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(F)c(Cl)c1,C40777935_decoy,TRY1,Decoy,0,-7.93944,-7.74,-1.36,-5.857302961023349
Nc1c(NN(c2ccccc2)c2ccccc2)nc[nH+]c1Nc1ccc(F)c(F)c1,C40777999_decoy,TRY1,Decoy,0,-7.7687,-7.19,-1.65,-6.355992194813948
Nc1c(NC2CCCCCC2)nc[nH+]c1NN(c1ccccc1)c1ccccc1,C40778020_decoy,TRY1,Decoy,0,-8.08612,-6.35,-1.97,-7.072997461084395
Cc1ccc2c(Nc3ncnc(Nc4ccc(Cl)c(C(F)(F)F)c4)c3N)cccc2[nH+]1,C40797580_decoy,TRY1,Decoy,0,-8.61577,-8.75,-3.45,-7.815839057820438
Cc1ccc2c(Nc3ncnc(Nc4ccc(Oc5ccccc5)cc4)c3N)cccc2[nH+]1,C40801616_decoy,TRY1,Decoy,0,-9.86764,-8.19,-2.17,-8.928567386359953
CC(C)[NH+](C)Cc1ccccc1CNC(=O)C(=O)Nc1ccccc1CC(N)=O,C41488539_decoy,TRY1,Decoy,0,-7.82334,-7.1,-1.61,-5.805055042573208
CCCNC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)C1,C50998137_decoy,TRY1,Decoy,0,-6.82608,-6.07,-2.56,-6.095936826490252
N#CN/C(=N\c1cc(Cl)cc(Cl)c1)Nc1ccc(CC[NH2+]C[C@H](O)c2cccnc2)cc1,C27211040_decoy,TRY1,Decoy,0,-9.11998,-7.48,-2.41,-6.44261624406062
CCOc1cc(Br)c(/C=N/[NH+]=C(\N)c2nonc2N)cc1OCC,C04844989_decoy,TRY1,Decoy,0,-8.56289,-6.0,-1.91,-8.403928018590156
CCCCn1c(N)c(NCCC(C)C)c(=O)n(C[NH+]2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1=O,C62626252_decoy,TRY1,Decoy,0,-9.08308,-5.6,-2.76,-6.087412067776879
C[C@H](NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1ccc(S(N)(=O)=O)cc1,C39933368_decoy,TRY1,Decoy,0,-11.0072,-6.74,-2.94,-6.973759752142885
COc1cc(N2C(=O)[C@@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)[C@H](O)N[C@H]2O)cc(OC)c1OC,C64044451_decoy,TRY1,Decoy,0,-8.34014,-9.34,-1.96,-8.625172591645986
CC[NH+]1[C@@H](SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])NN[C@H]1c1ccco1,C64683797_decoy,TRY1,Decoy,0,-7.72451,-7.51,-1.95,-6.027533747603371
O=C(/C=C/c1ccc(C(=O)NC2CC2)cc1)NNC(=O)NCCCn1cc[nH+]c1,C64886179_decoy,TRY1,Decoy,0,-8.63575,-6.57,-2.08,-6.5714784132073385
O[C@H](C[NH2+]CCNc1nccc(C(F)(F)F)n1)Cn1ccc2ccccc21,C04299457_decoy,TRY1,Decoy,0,-7.31418,-5.9,-1.81,-4.934808046142238
C[NH+](C)CCNC(=O)[C@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)cc1,C03665846_decoy,TRY1,Decoy,0,-5.88275,-6.14,-0.33,-5.134389958015557
Nc1nc(C[NH+]2CCN(c3ccc(F)cc3)CC2)nc(Nc2ccccc2)n1,C04457411_decoy,TRY1,Decoy,0,-7.03352,-8.18,-1.29,-5.812866081526284
COc1cccc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C)C3)c1OC,C05169446_decoy,TRY1,Decoy,0,-8.80445,-6.52,-3.64,-7.270178279803923
Cc1c(-c2ccccc2)oc2c(C(=O)NC3CC[NH+](CC(N)=O)CC3)cccc2c1=O,C10922332_decoy,TRY1,Decoy,0,-8.52725,-5.95,-2.88,-5.551522856078963
C=CCNS(=O)(=O)c1ccc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C11423465_decoy,TRY1,Decoy,0,-7.5991,-4.89,-3.29,-4.437418226977891
O[C@H](COc1cccc(C[NH2+]CC2(O)CCCCC2)c1)CN1CCOCC1,C19225548_decoy,TRY1,Decoy,0,-9.08541,-6.94,-2.13,-6.070270231887323
O=c1cc(-c2ccc(O)cc2)nc(-c2ccc(C[NH+]3CCC[C@H]3CO)cc2)[nH]1,C20149500_decoy,TRY1,Decoy,0,-8.03657,-7.29,-2.2,-5.888927629151078
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)N[C@@H]3CCOc4ccccc43)sc2[nH+]1,C22313514_decoy,TRY1,Decoy,0,-7.67727,-9.12,-2.87,-7.51642986300432
C[C@@H](C(=O)NC(N)=O)[NH+]1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1,C23292002_decoy,TRY1,Decoy,0,-8.27805,-6.96,-1.72,-7.149494769637991
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)Cc1c(F)cccc1Cl,C26481358_decoy,TRY1,Decoy,0,-7.71556,-7.38,-1.66,-5.5922943656978
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CS/C(N)=[NH+]/Cc1ccco1,C29499559_decoy,TRY1,Decoy,0,-8.73426,-7.61,-1.21,-11.112329123056432
CCOc1ccccc1[C@@H]1C(C(N)=O)=C(C)[NH+]=C2N=C(c3cccs3)NN21,C00940766_decoy,TRY1,Decoy,0,-8.30381,-5.2,-3.04,-5.3947936608236144
Cc1cc(C(=O)NNC(=O)NCC2([NH+]3CCSCC3)CCCC2)c(C)o1,C47009063_decoy,TRY1,Decoy,0,-8.43472,-5.61,-2.0,-5.418963408618828
CCc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc(F)cc2)[NH+](C)C)cc1,C49799352_decoy,TRY1,Decoy,0,-7.34666,-7.79,-2.67,-6.586388541500116
NC(=O)[C@H]1CN(C(=O)NC[C@@H](c2c(F)cccc2Cl)[NH+]2CCCC2)CCO1,C51684476_decoy,TRY1,Decoy,0,-7.35924,-7.02,-1.82,-5.730630703671756
C[NH+](CC(N)=O)CC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1,C52830978_decoy,TRY1,Decoy,0,-9.20393,-6.94,-1.21,-6.95616925550612
CC[NH+](CC(=O)NC(C)(C)C)Cc1csc(-c2ccc(C(N)=O)cc2)n1,C53602825_decoy,TRY1,Decoy,0,-8.54224,-7.79,-3.21,-10.28241204555258
Cc1nc(C[NH2+]Cc2cn(CCC(N)=O)c3ccccc23)nc2c1CCCC2,C55568806_decoy,TRY1,Decoy,0,-7.84895,-8.33,-2.3,-6.553182313558687
CC(=O)Nc1ccc(Cl)c(NC(=O)NC[C@H](c2cccs2)[NH+](C)C)c1,C56693123_decoy,TRY1,Decoy,0,-7.91579,-4.92,-2.8,-5.909237091466379
O=C(CNC(=O)NC[C@@H]1CC[NH+](CC(F)(F)F)C1)Nc1ccc(F)cc1,C58213662_decoy,TRY1,Decoy,0,-7.57399,-7.33,-2.07,-5.716781199350681
CC(=O)Nc1cc(NC(=O)NCc2cc[nH+]c(N3CCCC3)c2)ccc1F,C58889298_decoy,TRY1,Decoy,0,-9.15584,-7.53,-1.43,-7.156915996827341
C=C1C=C([O-])N2C(=NC(NCC[NH+]3CCCCC3)=[NH+][C@H]2[C@H]2CC=CCC2)N1,C59619517_decoy,TRY1,Decoy,0,-8.50333,-6.64,-0.14,-7.890684643391043
C=C1C=C([O-])N2C(=NC(NCC[NH+]3CCCCC3)=[NH+][C@@H]2[C@@H]2CC=CCC2)N1,C59619519_decoy,TRY1,Decoy,0,-9.07751,-7.23,-0.85,-8.091754945362101
C[NH+](C)[C@@H](CNC(=O)NCCNC(=O)c1ccccc1F)c1ccsc1,C50099766_decoy,TRY1,Decoy,0,-8.00735,-7.34,-1.44,-6.716407377839824
Cc1cc(C)c(NC(=O)CNC(=O)Nc2ccc(N3CCCC3)[nH+]c2)c(C)c1,C48084691_decoy,TRY1,Decoy,0,-8.01484,-7.95,-2.52,-6.848455704629266
CC(=O)Nc1cc(NC(=O)NC2CC[NH+](CC(F)F)CC2)c(F)cc1F,C61786198_decoy,TRY1,Decoy,0,-7.57241,-6.02,-2.0,-5.208229675790077
C[C@H](CC[NH+](C)C)NC(=O)NNC(=O)c1ccc(F)cc1Br,C62504577_decoy,TRY1,Decoy,0,-7.88876,-6.28,-2.12,-5.706708372223554
Cc1cc(C)c(S(N)(=O)=O)cc1C(=O)NCC(C)(C)[NH+]1CCC[C@H](C)C1,C63340501_decoy,TRY1,Decoy,0,-9.34702,-5.68,-4.95,-6.709498557818253
O=C(C[C@@H]1NC(=O)c2ccccc2N=C1O)NCCC1=c2ccccc2=[NH+]C1,C63376240_decoy,TRY1,Decoy,0,-8.13979,-8.45,-2.01,-6.462377206451098
CC1=C(NC(=O)C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)[C@@H](C)N(C)N1,C63795383_decoy,TRY1,Decoy,0,-8.65666,-6.68,-1.2,-7.415335412149203
CC1=C(NC(=O)C(=O)NCCC2=c3cc(F)ccc3=[NH+][C@H]2C)[C@@H](C)N(C)N1,C63807247_decoy,TRY1,Decoy,0,-7.58919,-7.96,-4.12,-6.338313288700871
C[C@@H]1[C@H](C[NH2+]C[C@@H]2C=NN=C2c2ccccc2)c2ccccc2N1CC(N)=O,C63882516_decoy,TRY1,Decoy,0,-8.29534,-7.22,-2.97,-5.751955281382633
NC(=O)CSc1ccccc1NC(=O)N1CC[NH+](CC2CCCCC2)CC1,C65408624_decoy,TRY1,Decoy,0,-8.36844,-5.06,-4.22,-5.738323370811528
OCCC#Cc1ccc([C@H]2[C@H](c3ccccc3)NC[NH+]2Cc2nc[nH]n2)cc1,C65490792_decoy,TRY1,Decoy,0,-7.82028,-6.58,-2.05,-5.978812042743701
NS(=O)(=O)c1ccc(CCNC(=O)C[NH+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1,C65968313_decoy,TRY1,Decoy,0,-9.33393,-5.69,-4.57,-5.340542959501295
CC[C@@H](C)[NH+](C)CCNC(=O)NNC(=O)CSc1ccc(Cl)cc1,C66203103_decoy,TRY1,Decoy,0,-8.71386,-6.43,-1.39,-6.422059757081489
C[C@@H]([NH2+]CC1(c2cccc(Cl)c2)CCOCC1)C(=O)NC(=O)NC1CC1,C66389326_decoy,TRY1,Decoy,0,-9.85549,-7.04,-2.04,-6.575250737112677
COc1ccc2[nH]cc(C3CC[NH+]([C@@H](C)C(=O)NC(=O)NC4CC4)CC3)c2c1,C66436560_decoy,TRY1,Decoy,0,-7.62472,-5.88,-1.21,-4.888364673619756
NC(=O)C[NH+]1CCC[C@@H](NC(=O)c2nn(-c3ccccc3)c3c2CCCCC3)C1,C66448240_decoy,TRY1,Decoy,0,-7.94163,-6.51,-2.72,-5.467690170226809
O=C(NCC[NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1ccc(O)cc1,C66991983_decoy,TRY1,Decoy,0,-7.73054,-7.61,-1.54,-6.46708874634231
Cc1ccsc1C(=O)NNC(=O)NCC1([NH+]2CCSCC2)CCCC1,C67391259_decoy,TRY1,Decoy,0,-9.4074,-5.19,-1.11,-5.675162291359003
C[C@H](C(=O)NC(=O)NC1CC1)[NH+]1CCC([C@H](O)c2ccc(Cl)cc2)CC1,C67400589_decoy,TRY1,Decoy,0,-8.43333,-6.03,-1.79,-5.917031094231754
C[C@H](C(=O)NC(=O)NC1CC1)[NH+]1CCC([C@@H](O)c2ccc(Cl)cc2)CC1,C67400591_decoy,TRY1,Decoy,0,-7.63965,-6.26,-1.06,-5.046296764945161
CC(C)NC(=O)[C@@H](C)[NH+]1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1,C67486763_decoy,TRY1,Decoy,0,-8.2448,-5.79,-1.58,-5.355199356882356
CCOc1ccc(NC(=O)NC[C@H](O)C[NH+]2CCC(C)CC2)cc1Cl,C67545387_decoy,TRY1,Decoy,0,-9.0332,-6.67,-2.75,-7.837427605157167
CCOc1ccc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1Cl,C67545389_decoy,TRY1,Decoy,0,-8.96044,-1.39,-1.5,-4.667404343905177
CC1CC[NH+](C[C@H](O)CNC(=O)NCCOc2cccc(Cl)c2)CC1,C67627484_decoy,TRY1,Decoy,0,-9.25031,-7.27,-1.72,-11.93971535227002
Cc1c([C@H](C)NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)oc2ccccc12,C67629208_decoy,TRY1,Decoy,0,-9.12489,-8.11,-4.87,-8.134053090636108
CC1CC[NH+](C[C@H](O)CNC(=O)NCCOc2ccc3c(c2)CCC3)CC1,C67631564_decoy,TRY1,Decoy,0,-8.70722,-7.37,-1.38,-6.078140386394277
C[NH+](C)C[C@@H](O)COc1ccc(S(=O)(=O)c2ccc(OC[C@H](O)C[NH+](C)C)cc2)cc1,C06078927_decoy,TRY1,Decoy,0,-8.36772,-6.46,-2.77,-6.3246776937309725
C[NH+](C)CCCNC(=S)N(CC[NH+](C)C)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C06198513_decoy,TRY1,Decoy,0,-8.77629,-4.38,-2.24,-5.333747746591611
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H]([NH2+]Cc3cccs3)C[C@@H](c3ccc(F)cc3)[NH+]21,C08636011_decoy,TRY1,Decoy,0,-10.7013,-5.98,-3.1,-6.581927009946872
C[NH+](C[C@@H](O)COc1ccccc1C[NH2+]Cc1ccc2ncccc2c1)C1CCCCC1,C11932893_decoy,TRY1,Decoy,0,-9.63301,-6.32,-2.09,-6.671987049437795
CC[C@H](C)CNC(=S)Nc1ccc(N2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)[nH+]c1,C12369316_decoy,TRY1,Decoy,0,-8.26638,-5.51,-1.56,-4.301995094634982
COCCNC(=S)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2)CC1,C08636247_decoy,TRY1,Decoy,0,-7.90564,-6.31,-2.9,-5.623178824732005
COc1ccc(OC[C@H](O)C[NH2+]CC2([NH+]3CCCCC3)CCCCC2)c(C(C)(C)C)c1,C19360366_decoy,TRY1,Decoy,0,-8.09604,-5.27,-1.78,-5.280394474286188
COc1ccc(C[NH2+]Cc2ccc(F)cc2F)cc1OC[C@H](O)C[NH+]1CCCN(C)CC1,C19839638_decoy,TRY1,Decoy,0,-8.45001,-7.5,-3.5,-7.10445690361212
CC[NH+]1CCN(C[C@@H](O)COc2ccc(C[NH2+]CCn3nc(C)cc3C)cc2OC)CC1,C20999332_decoy,TRY1,Decoy,0,-7.75873,-5.9,-2.08,-5.364224729025208
CC[NH+]1CCN(C[C@@H](O)COc2ccc(OC[C@H](O)CN3CC[NH+](CC)CC3)cc2)CC1,C27529506_decoy,TRY1,Decoy,0,-10.1728,-6.45,-2.77,-7.177649117461638
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)N3NC(C(=O)NCCCn4cc[nH+]c4)=CC3=[NH+]2)cc1,C15745881_decoy,TRY1,Decoy,0,-8.45524,-7.57,-2.7,-7.021266981495765
COc1ccc(C[NH2+]Cc2cnc3ccccc3c2)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C23372973_decoy,TRY1,Decoy,0,-9.60197,-8.14,-3.12,-7.467053293767461
Cc1cc(C(=O)N2C[C@@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39595055_decoy,TRY1,Decoy,0,-9.12528,-8.46,-1.42,-7.375597273693686
CC[C@H](C)CC(=O)N1C[C@H](C(=O)NC[C@@H](c2cccnc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39595122_decoy,TRY1,Decoy,0,-10.592,-5.57,-3.74,-7.297249907230441
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(C)c2F)CC12CC[NH2+]CC2,C39626868_decoy,TRY1,Decoy,0,-9.3117,-7.15,-3.27,-6.762426837007281
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2c(Cl)ccc(C)c2F)CC12CC[NH2+]CC2,C39626873_decoy,TRY1,Decoy,0,-9.09872,-7.09,-2.61,-6.692632815798913
C[NH+](C)CCCNC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39627334_decoy,TRY1,Decoy,0,-8.14279,-7.04,-2.39,-7.160355284728504
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)NCC[NH+]3CCCCC3)C3(CC[NH2+]CC3)C2)cc1Cl,C39628181_decoy,TRY1,Decoy,0,-9.10676,-6.64,-1.33,-5.698448006366776
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39630702_decoy,TRY1,Decoy,0,-9.14733,-6.31,-1.5,-6.870411484428101
Cc1cc(C(=O)N2C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)ccc1F,C39630803_decoy,TRY1,Decoy,0,-8.42031,-6.77,-1.95,-7.63401975849747
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39630982_decoy,TRY1,Decoy,0,-9.29304,-5.56,-2.29,-6.524879133207518
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2)C(C)C,C39634770_decoy,TRY1,Decoy,0,-9.64792,-5.6,-2.29,-5.786551234220027
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39634891_decoy,TRY1,Decoy,0,-9.63952,-6.05,-3.87,-5.626826315483047
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39634892_decoy,TRY1,Decoy,0,-8.94577,-7.05,-1.58,-7.558706542723302
COc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)c3cc(C)n(C)n3)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663967_decoy,TRY1,Decoy,0,-8.63612,-8.3,-1.26,-7.231022383861422
CCC(=O)N1C[C@@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39664076_decoy,TRY1,Decoy,0,-9.05554,-7.46,-1.34,-6.546873387627921
CCC(=O)N1C[C@H](C(=O)NC[C@H](c2ccc(OC)cc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39664077_decoy,TRY1,Decoy,0,-8.78147,-6.43,-2.6,-6.619534398618848
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NC[C@@H](c2ccc(OC)cc2)[NH+]2CCCC2)C2(CC[NH2+]CC2)C1,C39664160_decoy,TRY1,Decoy,0,-10.2066,-8.07,-2.7,-9.71210292038341
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCc2cn3c(C)cccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670792_decoy,TRY1,Decoy,0,-9.34422,-5.89,-1.78,-5.85072446287738
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCc2cn3c(C)cccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670793_decoy,TRY1,Decoy,0,-8.74975,-6.93,-2.75,-6.207720526681535
CSCCC(=O)N1C[C@H](C(=O)NCCC2=c3cc(C#N)ccc3=[NH+][C@H]2C)C2(CC[NH2+]CC2)C1,C39674767_decoy,TRY1,Decoy,0,-7.81002,-7.02,-1.77,-5.687747725053334
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)c1F,C39678984_decoy,TRY1,Decoy,0,-8.40128,-6.27,-1.81,-5.621343313005215
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)c3c(C)noc3C)CC23CC[NH2+]CC3)CC1,C39683600_decoy,TRY1,Decoy,0,-8.16011,-6.7,-3.61,-5.4271312054029925
CCCCCCC(=O)N1C[C@H](C(=O)NCCN2CCC[NH+](C)CC2)C2(CC[NH2+]CC2)C1,C39685610_decoy,TRY1,Decoy,0,-8.68027,-5.64,-0.75,-5.879889831370613
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)NCCN4CCC[NH+](C)CC4)C4(CC[NH2+]CC4)C3)cccc12,C39685646_decoy,TRY1,Decoy,0,-10.5412,-7.99,-4.78,-7.702483081574935
COCCNC(=S)NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2)CC1,C43527326_decoy,TRY1,Decoy,0,-8.65153,-5.54,-2.09,-5.810461463282371
[NH3+][C@H](COc1cncc(/C=C/c2ccnc(SCc3ccccc3)c2)c1)CC1=c2ccccc2=[NH+]C1,C52627539_decoy,TRY1,Decoy,0,-9.85541,-8.37,-3.02,-7.17790960010082
CC[NH+]1CCN(C[C@H](O)COc2ccc(OC[C@H](O)CN3CC[NH+](CC)CC3)cc2)CC1,C27529504_decoy,TRY1,Decoy,0,-9.57509,-6.4,-4.83,-6.726983049868669
CCC[NH+]1CCC(N2C[C@H]([NH2+]Cc3ccc(OC)c(C)c3C)C[C@H]2C(=O)NC(C)C)CC1,C23362508_decoy,TRY1,Decoy,0,-8.96067,-6.71,-2.74,-7.705991706812786
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N1CCC(c2[nH]c(-c3ccc(F)c(F)c3)c[nH+]2)CC1,C58178841_decoy,TRY1,Decoy,0,-9.08579,-7.23,-0.64,-5.8515388012539145
COc1cc(C[NH2+]CC[NH2+]CCO)cc(Cl)c1OCc1ccc(Cl)cc1Cl,C22942543_decoy,TRY1,Decoy,0,-9.07558,-5.77,-2.86,-5.615288187736264
CCOc1cccc(C[NH2+]CCN2CC[NH2+]CC2)c1OCc1ccc(Cl)cc1Cl,C22937346_decoy,TRY1,Decoy,0,-9.61272,-6.19,-1.26,-7.859730360933137
COc1ccc([C@@H](C[NH2+]C[C@H](O)COc2ccc(Br)cc2)C2=c3ccccc3=[NH+]C2)cc1,C63234628_decoy,TRY1,Decoy,0,-9.62207,-8.2,-1.77,-8.735456663887142
COc1ccc(Cl)cc1C(=O)NC(=S)Nc1cc(C2[NH+]=c3ccccc3=[NH+]2)ccc1C,C63268768_decoy,TRY1,Decoy,0,-8.0154,-7.96,-2.31,-5.5320765879695895
CCOC(=O)C1=C(CS[C@@H]2[NH+]=c3cccnc3=[NH+]2)NC(=O)N[C@H]1c1cc(C)ccc1C,C63515322_decoy,TRY1,Decoy,0,-7.53512,-5.96,-1.93,-5.632941395851761
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@H]1C=C2[NH+]=C(c3ccc(F)cc3)C=C(C(F)(F)F)N2N1,C63547005_decoy,TRY1,Decoy,0,-9.53551,-8.65,-1.67,-6.815146969917536
Cc1ccc2c(c1)=C(CCNC(=O)[C@@H]1C=C3[NH+]=C(c4ccc(F)cc4)C=C(C(F)(F)F)N3N1)C[NH+]=2,C63547027_decoy,TRY1,Decoy,0,-9.89977,-9.23,-2.2,-7.140854485562022
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(N[C@H](C)CC(C)(C)OC)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63985836_decoy,TRY1,Decoy,0,-8.97656,-6.86,-0.99,-6.5216352929183525
COC(=O)[C@@H]1[C@@H](NC(C)=O)c2cc(NC3CCOCC3)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63994209_decoy,TRY1,Decoy,0,-9.78314,-6.75,-1.86,-6.679502639430304
CC(C)[C@@H](NC(=O)CS[C@H]1N=NNN1c1ccccc1Cl)C1[NH+]=c2ccccc2=[NH+]1,C64164334_decoy,TRY1,Decoy,0,-8.60298,-8.54,-1.98,-8.270327837984487
CCc1ccc([C@H](Nc2cc(C)cc[nH+]2)c2ccc3cccnc3c2O)cc1,C02874296_decoy,TRY1,Decoy,0,-10.2072,-7.83,-0.49,-9.87424609463595
COc1ccc(Nc2ccnc3cc(Cl)ccc23)cc1C[NH2+]CC(C)C,C01666894_decoy,TRY1,Decoy,0,-8.16192,-5.71,-1.7,-7.45695158579719
CCOc1cccc([C@H]2CC(c3ccc(C)cc3)=N[C@H](c3cccc(F)c3)[NH2+]2)c1O,C04730014_decoy,TRY1,Decoy,0,-9.15599,-6.3,-1.87,-5.768949280804876
CCc1ccc([C@H](Nc2cccc[nH+]2)c2cc(Cl)c3cccnc3c2O)cc1,C02868280_decoy,TRY1,Decoy,0,-8.73874,-7.71,-1.11,-9.2224243398644
OCCN(CCO)c1cc(/C=C\c2c3ccccc3cc3ccccc23)[nH+]c2ccccc12,C05640796_decoy,TRY1,Decoy,0,-7.56702,-7.6,-1.03,-8.494051274595527
CCOc1c(C)cc(S(=O)(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(C)c1C,C07616258_decoy,TRY1,Decoy,0,-7.68053,-7.23,-3.81,-8.1664555069714
COc1cccc(C[NH2+]C[C@H](C)O)c1OCc1ccc(Cl)cc1Cl,C08498054_decoy,TRY1,Decoy,0,-8.74247,-5.39,-1.78,-5.6221242295699945
O=c1oc2c(C[NH2+]CCc3ccc(F)cc3)c(O)c(Cl)cc2c2c1CCC2,C08739526_decoy,TRY1,Decoy,0,-9.5862,-8.74,-1.91,-6.433118154890723
CCOc1ccc(C2=N[C@@H](c3cccc(F)c3)[NH2+][C@H](c3cc(Cl)ccc3O)C2)cc1,C09542721_decoy,TRY1,Decoy,0,-8.49387,-8.06,-0.89,-7.21509773396065
Cc1nc(Oc2ccc(Br)cc2CC[NH3+])cc(-c2ccccc2)n1,C11849542_decoy,TRY1,Decoy,0,-8.604,-5.96,-1.87,-5.282392592140432
CCOc1cc(CC[NH3+])cc(Cl)c1OCCOc1ccccc1Cl,C11959088_decoy,TRY1,Decoy,0,-9.71703,-6.07,-2.02,-8.633933197347295
CC1(C)CC(O)CC(C)(C)[NH+]1C[C@@H](O)CO[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C,C12289264_decoy,TRY1,Decoy,0,-7.32531,-5.62,-4.97,-0.7612309056514523
CCOc1ccc([C@H]2c3[nH]c4ccccc4c3CC[NH+]2Cc2nc(C)c[nH]2)cc1,C12441447_decoy,TRY1,Decoy,0,-7.18662,-8.42,-0.98,-8.468290387266931
CCOc1ccc([C@@H]2c3[nH]c4ccccc4c3CC[NH+]2Cc2nc(C)c[nH]2)cc1,C12441449_decoy,TRY1,Decoy,0,-7.8472,-5.55,-0.65,-4.988395774945544
CC1(C)CC(N(Cc2ccccc2)C(=S)Nc2cccnc2)CC(C)(C)[NH2+]1,C05945300_decoy,TRY1,Decoy,0,-8.04287,-6.75,-2.56,-7.419490770494671
OCC1(CCCc2ccccc2)CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1,C12301885_decoy,TRY1,Decoy,0,-8.09977,-6.84,-1.75,-5.518520405455523
CCOc1ccccc1[C@@H]1c2[nH]c3ccccc3c2CC[NH+]1Cc1[nH]cnc1C,C12305600_decoy,TRY1,Decoy,0,-6.53344,-6.17,-0.37,-5.114001970126671
OC[C@@H]1CCCN(c2nc3cc(F)ccc3cc2C[NH2+]C2CCCCCC2)C1,C14880702_decoy,TRY1,Decoy,0,-9.23821,-5.7,-1.2,-5.869745758722069
Oc1ccc(-c2cncnc2)cc1C[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1,C19224712_decoy,TRY1,Decoy,0,-8.07128,-8.07,-1.12,-7.401739877367382
COc1cc(C[NH+]2C[C@H]3CCC[C@](O)(c4ccccc4OC)[C@H]3C2)ccc1O,C19569209_decoy,TRY1,Decoy,0,-8.76807,-6.28,-2.96,-5.533709481570222
C[C@@H](C/N=C1\N=C(N2CCCCCC2)S1)NC1CC(C)(C)[NH2+]C(C)(C)C1,C20872244_decoy,TRY1,Decoy,0,-8.53609,-6.33,-1.47,-5.665407108084414
COc1ccc([C@@H]2C/C(=N\O)[C@H](C(C)C)[C@H](c3ccc(OC)cc3)[NH2+]2)cc1,C05042945_decoy,TRY1,Decoy,0,-7.44501,-5.14,-1.58,-4.448149615605347
CCOc1cccc(C[NH2+]CCO)c1OCc1ccc(Cl)cc1Cl,C02845560_decoy,TRY1,Decoy,0,-8.41804,-5.77,-3.84,-5.815629875052924
Cc1ccc2[nH]c(C[NH+]3CCC(CO)(C[C@@H]4CCCCO4)CC3)c(C)c2c1,C12227048_decoy,TRY1,Decoy,0,-8.59987,-7.52,-2.5,-5.899226486842235
CC(C)(C)c1ccccc1NC(=O)NC1CC[NH+](Cc2c(F)cccc2Cl)CC1,C04324671_decoy,TRY1,Decoy,0,-7.88143,-6.24,-3.37,-5.881409145105884
OCC1(CCOc2ccccc2)CC[NH+](Cc2cc(Cl)ccc2O)CC1,C12507370_decoy,TRY1,Decoy,0,-8.75382,-7.15,-2.33,-7.193582587928519
CCOc1cc(C[NH2+]CCO)cc(Br)c1OCc1cccc(Cl)c1,C40741701_decoy,TRY1,Decoy,0,-8.81673,-4.78,-0.84,-5.281243844696983
COc1cccc(C[NH2+]CCCO)c1OCc1ccc(Cl)cc1Cl,C40744862_decoy,TRY1,Decoy,0,-7.74747,-4.34,-2.89,-4.829936748910945
Cc1ccc(C)c(OC[C@H](O)C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)c1,C42657713_decoy,TRY1,Decoy,0,-6.60792,-6.43,-3.97,-4.852326472653964
CCOc1ccccc1[C@H]1c2[nH]c3ccccc3c2CCN1Cc1[nH]c[nH+]c1C,C43071618_decoy,TRY1,Decoy,0,-8.91614,-6.76,-1.62,-8.380959255385823
Cc1cc(N(C)C)ccc1NC(=O)NCC1([NH+]2CCSCC2)CCCC1,C46015139_decoy,TRY1,Decoy,0,-10.1245,-6.22,-3.02,-6.361684359921639
CN(C)c1cc(F)c(CCNC(=S)Nc2ccc(Cl)c[nH+]2)c(F)c1,C13759879_decoy,TRY1,Decoy,0,-9.72451,-5.46,-1.61,-5.579721484247212
CCC[NH2+][C@@H](C)c1cnc(-c2cc(Br)c(O)c(OC)c2)s1,C54160356_decoy,TRY1,Decoy,0,-8.98568,-4.73,-1.66,-5.086351984179661
Oc1ccc(Br)cc1C[NH2+]Cc1ccc(Cn2cccn2)cc1,C58441065_decoy,TRY1,Decoy,0,-7.75866,-4.99,-1.29,-4.63209713601604
CCc1ccc(Cl)c(CC)c1NC(=O)NC[C@@H](c1cccs1)[NH+](C)C,C58858960_decoy,TRY1,Decoy,0,-10.1895,-4.28,-3.37,-6.035923360833512
CC1(C)CC(N(Cc2ccncc2)C(=S)Nc2ccc(F)cc2F)CC(C)(C)[NH2+]1,C05945420_decoy,TRY1,Decoy,0,-9.05444,-5.97,-1.6,-5.904627999020915
C[C@H](Nc1ccc([NH+]2CCCCCC2)cc1)C(=O)NC1(C#N)CCCCC1,C60943136_decoy,TRY1,Decoy,0,-8.72122,-5.11,-1.68,-5.0422489862540845
C[C@H](NC(=O)Nc1ccccc1C[NH+]1CCSCC1)c1ccccc1Cl,C61790506_decoy,TRY1,Decoy,0,-7.73842,-6.15,-2.05,-5.460749106915712
Cc1cccc(NC(=S)N[C@H](C)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)c1C,C22928314_decoy,TRY1,Decoy,0,-8.25029,-6.7,-2.47,-5.910196691008456
Cc1ccc2c(c1)=C(CCNC(=O)[C@@H]1C=C(c3ccc(Cl)cc3)ON1)C[NH+]=2,C63552152_decoy,TRY1,Decoy,0,-7.72874,-8.46,-1.79,-6.266720391544767
CC1=C(C(=O)NCCC2=c3ccccc3=[NH+]C2)[C@@H](Cl)N(c2ccccc2)N1,C63857901_decoy,TRY1,Decoy,0,-7.16944,-8.17,-2.08,-9.229633635033544
O=C(NC[C@H](C1=c2ccccc2=[NH+]C1)[C@H]1CC=CS1)c1n[nH]c2ccccc12,C63994113_decoy,TRY1,Decoy,0,-8.14965,-8.17,-2.45,-6.168345284037697
COCCNC(=S)NC[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl,C64041618_decoy,TRY1,Decoy,0,-8.91801,-6.09,-2.15,-6.304740163631074
Cc1ccccc1NC(=S)N[C@H](C)[C@H](c1ccccc1)N1CC[NH+](C)CC1,C22928322_decoy,TRY1,Decoy,0,-6.78914,-5.48,-1.69,-4.877545223144879
O=C(C[NH+]1CCC(NC(=O)C2CCCCC2)CC1)NC1CCCCCCC1,C65963735_decoy,TRY1,Decoy,0,-8.86208,-5.58,-2.13,-5.312675780631973
O=C(C[NH+]1CC2C[C@@H]3CC1C[C@H](C2)C3)NCC(=O)Nc1ccc(F)c(F)c1,C65968231_decoy,TRY1,Decoy,0,-7.76221,-6.23,-1.19,-5.367063258848064
CC(C)[C@@H]([NH2+]CC1(c2ccc(Cl)cc2)CCOCC1)C(=O)NC(C)(C)C,C66391913_decoy,TRY1,Decoy,0,-7.72264,-6.31,-2.74,-5.794476440890018
O[C@H](COc1ccc(Cl)cc1Br)C[NH+]1CCC[C@H]1c1ccc[nH]1,C66422111_decoy,TRY1,Decoy,0,-7.69236,-4.97,-2.07,-4.718297825909571
CCCC[NH+]1Cc2cccc(N[C@@H](C)C(=O)Nc3c(F)cccc3F)c2C1,C66967415_decoy,TRY1,Decoy,0,-8.76361,-5.97,-2.73,-5.951364255705417
CC(C)(C)c1nc(C[NH2+]C[C@@H](O)COc2ccc(C(F)(F)F)cc2)cs1,C67255002_decoy,TRY1,Decoy,0,-7.68979,-5.01,-2.26,-5.031398412262505
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C04557188_decoy,TRY1,Decoy,0,-5.93384,-4.85,-3.76,-4.076340602777122
O=[N+]([O-])c1ccccc1O[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C05260484_decoy,TRY1,Decoy,0,-5.1485,-5.73,-3.44,-5.029657565048084
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C05260511_decoy,TRY1,Decoy,0,-6.41324,-5.75,-2.66,-4.73098016510157
O=C1NC(=O)C(=CNC(=S)Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)C(=O)N1,C01637582_decoy,TRY1,Decoy,0,-8.16847,-7.29,-2.8,-5.951885276341262
O=S(=O)(c1ccc(NC(=S)N/N=C/c2ccc(O)c(O)c2O)cc1)N1CCOCC1,C03259044_decoy,TRY1,Decoy,0,-9.62355,-6.72,-2.85,-8.096665523120949
Nc1ncnc2c1nc(N/N=C/c1ccc(-c3ccc([N+](=O)[O-])cc3)cc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975202_decoy,TRY1,Decoy,0,-8.10301,-8.41,-2.14,-7.779845646568944
Nc1ncnc2c1nc(N/N=C/C=C/c1ccc([N+](=O)[O-])o1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975212_decoy,TRY1,Decoy,0,-7.9864,-8.49,-1.97,-8.259892112900381
Cc1oc2c(C)c3oc(=O)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(C)c3cc2c1C,C12896787_decoy,TRY1,Decoy,0,-8.19694,-8.09,-2.46,-6.041895216446834
Cc1oc2cc3oc(=O)c(CC(=O)N(C)C[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)c(C)c3cc2c1C,C12897154_decoy,TRY1,Decoy,0,-8.52434,-8.24,-1.72,-6.44730740507749
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H]2O)cc1,C13519127_decoy,TRY1,Decoy,0,-5.00633,-5.98,-1.62,-4.139839863642367
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)cc1,C13520551_decoy,TRY1,Decoy,0,-5.84528,-5.41,-3.49,-4.423900710770561
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205645_decoy,TRY1,Decoy,0,-5.67749,-5.85,-3.19,-4.302620811151066
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205667_decoy,TRY1,Decoy,0,-5.34351,-7.95,-1.96,-4.832682287258943
O=[N+]([O-])c1ccccc1O[C@@H]1O[C@@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C15205684_decoy,TRY1,Decoy,0,-4.08771,-7.16,-2.22,-4.017374459447228
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C15250057_decoy,TRY1,Decoy,0,-5.17866,-6.05,-2.07,-4.837582866455859
[NH3+]CC(=O)OCN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@@H]2C1=O)[C@@H]1[C@@H]2C(=O)N(COC(=O)C[NH3+])C(=O)[C@@H]2[C@H]31,C16941673_decoy,TRY1,Decoy,0,-8.92071,-5.68,-2.66,-5.685813698402633
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccs3)n2)s1,C20834298_decoy,TRY1,Decoy,0,-11.2257,-6.39,-3.95,-7.709216123522991
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc4ccccc34)n2)s1,C20905600_decoy,TRY1,Decoy,0,-10.2888,-9.09,-3.99,-7.981027610581287
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3cccc(O)c3)n2N)sc2c1CCC2,C20914700_decoy,TRY1,Decoy,0,-9.88726,-9.88,-2.6,-8.197736866513454
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22064985_decoy,TRY1,Decoy,0,-6.19748,-6.66,-1.65,-5.444735198997538
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)cc1,C22064995_decoy,TRY1,Decoy,0,-5.79008,-7.5,-3.92,-5.649462358729398
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C22065075_decoy,TRY1,Decoy,0,-5.51532,-6.89,-2.93,-4.662790008255917
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C25692786_decoy,TRY1,Decoy,0,-6.63204,-7.85,-1.7,-7.499738330019997
COc1cc(O)cc(C)c1C(=O)O[C@H]1[C@@H](O)[C@@H](O)[C@@H](OC2[C@@H](O)[C@H](O)C(O)[C@H](O)[C@@H]2O)O[C@@H]1CO,C31165244_decoy,TRY1,Decoy,0,-9.42763,-9.42,-3.46,-8.478122181104172
O=C(N/N=C/[C@@H](O)[C@H](O)[C@H](O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1Cl,C33957523_decoy,TRY1,Decoy,0,-9.37116,-7.56,-3.74,-7.398530356802182
COc1cc2oc(=O)ccc2cc1[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)C(C)(C)O,C35465837_decoy,TRY1,Decoy,0,-7.44865,-7.17,-2.92,-5.855615787138481
O=[N+]([O-])c1cccc(N[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)c1,C06444701_decoy,TRY1,Decoy,0,-5.83947,-5.62,-2.62,-4.454432543575155
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645664_decoy,TRY1,Decoy,0,-5.48413,-6.68,-1.93,-6.251423686669606
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C35645721_decoy,TRY1,Decoy,0,-5.44619,-6.62,-2.78,-4.618198946682534
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645765_decoy,TRY1,Decoy,0,-5.84854,-6.2,-2.2,-4.836963278383776
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)nnn1-c1nonc1N,C36022873_decoy,TRY1,Decoy,0,-7.35945,-8.47,-3.39,-8.981589922644796
[N-]=[N+]=Nc1ccc(CC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1,C36372330_decoy,TRY1,Decoy,0,-7.23202,-8.11,-2.34,-8.482497349321237
O=[N+]([O-])c1ccccc1O[C@H]1O[C@@H](CO)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C37246084_decoy,TRY1,Decoy,0,-4.33745,-6.09,-3.12,-4.281872643408681
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccco2)cc1,C06601073_decoy,TRY1,Decoy,0,-7.93805,-6.43,-2.28,-6.009087130274732
COc1ccc([C@H]2Oc3c(OC)cc(CCCO)cc3[C@H]2CO)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C35455003_decoy,TRY1,Decoy,0,-9.03647,-5.82,-2.89,-6.083363240102057
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C39937351_decoy,TRY1,Decoy,0,-6.31149,-6.79,-1.91,-4.932918058527409
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C39937363_decoy,TRY1,Decoy,0,-4.92359,-7.49,-1.73,-5.666849935141427
COc1cc(O)cc(C)c1C(=O)O[C@H]1[C@@H](O)[C@@H](O)[C@@H](OC2[C@@H](O)[C@@H](O)C(O)[C@@H](O)[C@H]2O)O[C@@H]1CO,C35459075_decoy,TRY1,Decoy,0,-8.62816,-6.2,-3.82,-6.078732398533578
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]2O)cc1,C44021686_decoy,TRY1,Decoy,0,-4.63423,-6.21,-3.56,-4.37465144790966
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1,C44021721_decoy,TRY1,Decoy,0,-6.12682,-7.42,-3.56,-5.18074167645764
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C44963950_decoy,TRY1,Decoy,0,-5.96758,-7.32,-3.67,-4.9720538027944
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)cc1,C44963966_decoy,TRY1,Decoy,0,-4.93262,-6.39,-1.8,-4.6566856007869255
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CCCC[C@H]2O)O[C@H](CO)[C@H]1O,C49601713_decoy,TRY1,Decoy,0,-9.96626,-9.15,-2.11,-7.874798371365695
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](O[C@@H]2CCCC[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,C49601730_decoy,TRY1,Decoy,0,-9.56237,-9.55,-2.8,-8.264136585123003
O=C(CS[C@H]1N[C@H](c2ccco2)Nc2cc(=O)[nH]n21)NCCC1[NH+]=c2ccccc2=[NH+]1,C63648746_decoy,TRY1,Decoy,0,-8.93541,-6.02,-2.16,-6.271536315342361
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O)C(=O)[O-],C64020207_decoy,TRY1,Decoy,0,-7.52884,-6.5,-2.12,-6.1954800600431
C[C@H](O)[C@@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O)C(=O)[O-],C64137034_decoy,TRY1,Decoy,0,-7.92522,-7.31,-1.22,-9.097543645452568
C[C@H](O)[C@@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64137036_decoy,TRY1,Decoy,0,-7.50745,-7.16,-3.18,-7.399167688029501
C[C@H](O)[C@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O)C(=O)[O-],C64198127_decoy,TRY1,Decoy,0,-7.50213,-8.45,-2.15,-7.663074211203843
C[C@@H](O)[C@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64198137_decoy,TRY1,Decoy,0,-7.23066,-7.11,-2.58,-7.262864526305083
CCCCNc1nc2c(s1)C[C@]1(C)CC[C@@H]([C@H](C)C(=O)NCC[NH+]3CCOCC3)[C@H](O)[C@H]1[C@@H]2C,C03840576_decoy,TRY1,Decoy,0,-9.52876,-6.9,-2.55,-6.690139868219452
CC1=C(/C=C/C(C)=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)C(C)(C)CCC1,C04482093_decoy,TRY1,Decoy,0,-10.1358,-6.71,-3.78,-6.5111615731324175
COc1ccc(N2CC[NH+](CC(=O)N=C(NCCc3c[nH]c4cc(OC)ccc34)Nc3nc(C)cc(C)n3)CC2)cc1,C08758628_decoy,TRY1,Decoy,0,-10.5598,-8.68,-2.41,-7.542410033978981
C[NH+](Cc1c(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)nnn1-c1nonc1N)C1CCCCC1,C02450221_decoy,TRY1,Decoy,0,-10.0528,-8.31,-3.29,-8.56093318140807
Cc1sc2nc(C[NH+]3CCC(C)CC3)nc(N[C@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C,C09647499_decoy,TRY1,Decoy,0,-9.15461,-6.34,-2.29,-5.773530964629236
COc1cccc([C@@H](C[NH2+][C@H](C)C(=O)N2CC(=O)Nc3ccccc32)c2c[nH]c3ccccc23)c1OC,C09723373_decoy,TRY1,Decoy,0,-7.03964,-8.4,-2.56,-6.263864570470138
CCOc1ccc(N2C(=O)Nc3ccccc3[C@@]2(O)C(=O)NCCC[NH+](C)Cc2ccccc2)cc1,C03670317_decoy,TRY1,Decoy,0,-7.15231,-5.42,-1.79,-6.171490583665929
CC[NH+](CC)CCCNC(=O)[C@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccc(Cl)cc1,C03670431_decoy,TRY1,Decoy,0,-9.10753,-4.93,-2.67,-6.566341918634102
COc1ccc(-c2n[nH]cc2C[NH+]2CCC([C@]3(CCc4ccccc4)NC(=O)NC3=O)CC2)cc1,C11911567_decoy,TRY1,Decoy,0,-7.97752,-6.95,-2.14,-7.160440633091143
CC[NH+](CC(=O)Nc1ccc2c(c1)OCCO2)CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O,C15452630_decoy,TRY1,Decoy,0,-9.11005,-6.78,-1.67,-6.6069074846055
COc1ccc(Cl)cc1NC(=O)c1c(NC(=O)C[NH2+]Cc2ccco2)sc2c1CCCC2,C15946861_decoy,TRY1,Decoy,0,-8.62135,-7.98,-2.36,-8.044805256464775
COC(=O)c1c(NC(=O)C[NH+]2CC[C@@]3(O)CCCC[C@@H]3[C@@H]2c2ccc(O)c(OC)c2)sc2c1CCCC2,C16013003_decoy,TRY1,Decoy,0,-9.44967,-6.46,-2.07,-7.015357691702524
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccc(C(F)(F)F)cc2)nnn1-c1nonc1N,C03640574_decoy,TRY1,Decoy,0,-8.08285,-5.46,-3.21,-5.921250043277786
C[C@H](C(=O)NCCN1CCOCC1)[C@@H]1CC[C@@]2(C)Cc3s/c(=N\C(=O)C[NH+](C)C)[nH]c3[C@@H](C)[C@@H]2[C@H]1O,C20504561_decoy,TRY1,Decoy,0,-9.68089,-6.33,-4.09,-6.520517417879838
C[C@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+](C)CC(=O)Nc1ccccc1C(F)(F)F,C20686131_decoy,TRY1,Decoy,0,-9.96726,-6.5,-2.92,-6.63969323153744
CCOC(=O)C1=C(C[NH+](C)CC(=O)Nc2ccccc2Br)NC(=O)N[C@H]1c1ccco1,C23038629_decoy,TRY1,Decoy,0,-7.72983,-7.08,-1.7,-6.427387358006235
CCOc1ccc([C@H]([NH2+]CC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)C(C)C)cc1OCC,C24777977_decoy,TRY1,Decoy,0,-8.62958,-6.0,-2.77,-6.125198808316974
O=C(C[NH2+]Cc1ccncc1)Nc1ccc2c(c1)Cc1c(-c3ccc(-c4ccc(O)cc4)cc3)n[nH]c1-2,C28822262_decoy,TRY1,Decoy,0,-10.6434,-7.12,-3.69,-6.621324275320315
C[NH+](Cc1c(C(=O)N/N=C/c2c(F)cccc2Cl)nnn1-c1nonc1N)C1CCCCC1,C09478785_decoy,TRY1,Decoy,0,-9.32034,-8.83,-2.49,-7.53032879820636
Cc1ccc(NC(=O)C[NH+]2CCN(c3nc(SCC(N)=O)nc4sc5c(c34)CCCC5)CC2)cc1,C34756503_decoy,TRY1,Decoy,0,-10.3672,-8.46,-0.95,-8.65301993783399
Cc1ccc(NC(=O)CSc2nc(N3CC[NH+](CC(N)=O)CC3)c3c4c(sc3n2)CCCC4)cc1,C34756763_decoy,TRY1,Decoy,0,-9.83488,-7.59,-1.65,-6.262855508590166
CCc1c(C)sc2nc(SCC(N)=O)nc(N3CC[NH+](CC(=O)Nc4ccccc4C)CC3)c12,C34762236_decoy,TRY1,Decoy,0,-9.99314,-7.65,-2.02,-7.849271867627934
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H]([NH2+]CCO)C[C@@H](c3ccc(OC(F)(F)F)cc3)N12,C12603011_decoy,TRY1,Decoy,0,-7.9363,-6.02,-0.9,-6.244693361422832
CCNC(=O)c1cc2c(-c3cc(OCC[NH+]4CCCC4)c(Cl)cc3Cl)nc(N)nc2s1,C36966109_decoy,TRY1,Decoy,0,-9.66608,-6.38,-1.71,-7.873235041192437
CC[NH+](CC)C[C@H](C)CNC(=O)[C@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)c(Cl)c1,C03670413_decoy,TRY1,Decoy,0,-8.34856,-5.16,-1.96,-5.807576411561325
CC[NH+](CC)C[C@@H](C)CNC(=O)[C@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)c(Cl)c1,C03670412_decoy,TRY1,Decoy,0,-8.43506,-4.53,-1.86,-5.318612246445083
C=CCn1c(Cc2csc(NC(=O)CC[C@H]3[NH+]=C(c4ccc(CC)cc4)NO3)n2)n[nH]c1=S,C38798884_decoy,TRY1,Decoy,0,-10.2553,-7.55,-2.95,-7.247014995213163
C[NH+]1[C@@H](SCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccccc2)NN[C@H]1c1ccc(Br)cc1,C38990268_decoy,TRY1,Decoy,0,-9.69639,-6.18,-2.78,-5.8464273660618025
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C=C(c2ccc(OCc3ccc(Cl)cc3)cc2)NN1,C39006598_decoy,TRY1,Decoy,0,-9.25311,-6.85,-0.91,-6.755282063775846
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@H]1C=C(c2ccc(OCc3ccc(Cl)cc3)cc2)NN1,C39006599_decoy,TRY1,Decoy,0,-8.54513,-8.82,-2.12,-7.093594014881462
CCO[C@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(S(=O)(=O)Oc3ccccc3)cc2)CCN1,C39534380_decoy,TRY1,Decoy,0,-7.27887,-8.26,-3.0,-6.468949612599002
Cc1ccc(Oc2ncccc2C(=O)N2C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1,C39631849_decoy,TRY1,Decoy,0,-9.06446,-6.71,-2.75,-6.377372863231792
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39631893_decoy,TRY1,Decoy,0,-10.2303,-7.81,-1.67,-7.645343128265535
COc1ccc(OC)c(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)c1,C39631910_decoy,TRY1,Decoy,0,-8.94836,-6.56,-1.83,-6.459590537511948
O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@H]1CN(C(=O)COc2cccc(Cl)c2)CC12CC[NH2+]CC2,C39676452_decoy,TRY1,Decoy,0,-10.8925,-8.72,-1.73,-10.02787194312271
COc1ccc(N2[C@@H](SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)NN[C@H]2c2ccccc2)cc1,C39926565_decoy,TRY1,Decoy,0,-8.63168,-6.14,-3.79,-6.56939089431352
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2[N+](=O)[O-])cc1,C40627903_decoy,TRY1,Decoy,0,-5.88907,-6.15,-3.2,-5.3658336552317545
N#Cc1ccc([C@H]([NH2+]Cc2ccc3c(c2)OCO3)[C@H](C[NH2+]Cc2ccc3c(c2)OCO3)C(=O)[O-])cc1,C43209056_decoy,TRY1,Decoy,0,-8.12238,-8.1,-3.39,-7.089327906651444
CCCCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)NCCN3CCOCC3)[C@H](O)[C@H]1[C@@H]2C,C43548645_decoy,TRY1,Decoy,0,-10.239,-6.21,-2.53,-7.318781551919613
Cc1c(Nc2c(C#N)cncc2/C=C/CC[NH+]2CCC(NS(=O)(=O)C(C)C)CC2)ccc2[nH]ccc12,C45358070_decoy,TRY1,Decoy,0,-9.93601,-7.34,-1.56,-6.930138603380303
CCCCN(C(=O)C[NH+](C1CC1)[C@@H](C)c1ccccc1Cl)c1c(N)n(CCC)c(=O)[nH]c1=O,C59333871_decoy,TRY1,Decoy,0,-8.01159,-6.59,-2.0,-8.714511723944435
Cc1cc(C)c(-c2csc(NC(=O)C[NH+](C)[C@@H](C)c3cccc(S(N)(=O)=O)c3)n2)c(C)c1,C60377256_decoy,TRY1,Decoy,0,-9.03832,-7.63,-3.49,-6.492415215673746
Cc1cc(C)c(-c2csc(NC(=O)C[NH+](C)[C@H](C)c3cccc(S(N)(=O)=O)c3)n2)c(C)c1,C60377257_decoy,TRY1,Decoy,0,-9.36331,-7.43,-2.38,-6.213017405922184
O=C(NCCC1=c2ccccc2=[NH+]C1)c1ccc2c(c1)S[C@@H](NS(=O)(=O)c1ccc(F)cc1)N2,C63279879_decoy,TRY1,Decoy,0,-9.4721,-7.79,-2.57,-6.132514762546766
Cc1cc(C)nc(N/C(=N/C(=O)Nc2ccc([N+](=O)[O-])cc2)NCCC2=c3ccccc3=[NH+]C2)n1,C63308277_decoy,TRY1,Decoy,0,-8.51354,-7.89,-3.84,-6.7104861525789286
Cc1cc(C)nc(N/C(=N/C(=O)Nc2cccc([N+](=O)[O-])c2)NCCC2=c3ccccc3=[NH+]C2)n1,C63744041_decoy,TRY1,Decoy,0,-8.0042,-7.65,-1.89,-5.898639026113413
CC1=C(C(=O)C(=O)NNC(=O)CC2=c3ccccc3=[NH+]C2)[C@H](C)N(c2cccc(C(F)(F)F)c2)N1,C63905996_decoy,TRY1,Decoy,0,-8.23567,-8.44,-0.83,-6.94507929170292
COc1ccc(C(=O)N[C@@H]2NC3=C(C(=O)NCCC4=c5ccccc5=[NH+]C4)CCC[C@H]3S2)cc1,C64375488_decoy,TRY1,Decoy,0,-10.9541,-8.93,-2.8,-8.033202436410368
COc1ccc2c(c1)=C(CCNC(=O)c1ccc(C)c(NC(=O)[C@@H]3NSc4ccccc43)c1)C[NH+]=2,C64540110_decoy,TRY1,Decoy,0,-10.3246,-8.67,-3.59,-7.375994105244648
CC(C)[C@H](NS(=O)(=O)c1ccccc1)[C@H]1[NH+]=C(c2ccc3c(c2)[nH]c(=O)c(=O)n3C(C)C)NO1,C64890714_decoy,TRY1,Decoy,0,-9.23368,-8.51,-3.12,-7.016199131617228
CC[NH+](CC)CCCNC(=S)N(CCC[NH+](CC)CC)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C06193051_decoy,TRY1,Decoy,0,-9.90438,-5.66,-3.27,-7.008675145329165
CCOc1ccc2[nH]c(=O)c(CN(CC[NH+]3CCCC3)C(=S)NCCC[NH+](CC)CC)cc2c1,C06193090_decoy,TRY1,Decoy,0,-9.4352,-5.99,-2.48,-7.428563001662662
CN(C)c1ccc(NC(=S)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1,C08635612_decoy,TRY1,Decoy,0,-9.18844,-7.75,-3.29,-6.89829853186852
S=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ncccn2)CC1)Nc1ccc(-n2cccn2)cc1,C08635695_decoy,TRY1,Decoy,0,-8.96072,-7.53,-1.47,-6.302848007626909
O=C(C[NH+]1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1)NN/C=N\OCc1ccc(Cl)cc1,C08873748_decoy,TRY1,Decoy,0,-8.58289,-7.59,-2.36,-5.934804331518459
Cc1cc(N2CC[NH+](C)CC2)nc2ccc(NC(=S)NCCC[NH+]3CCN(c4ccccc4F)CC3)cc12,C20153859_decoy,TRY1,Decoy,0,-10.2125,-7.22,-2.66,-6.218739737407799
[H]/N=c1\cc(C)sn1/C(=[NH+]\C1CC(C)(C)[NH2+]C(C)(C)C1)N(Cc1ccc(OC)c(OC)c1OC)C1CCCC1,C20343872_decoy,TRY1,Decoy,0,-8.74066,-5.23,-2.55,-5.903322264793413
C[NH+](CCC[NH2+]Cc1cccn1-c1nnc(N2CC[NH+](C3CCCCC3)CC2)s1)C1CCCCC1,C09265771_decoy,TRY1,Decoy,0,-10.1694,-5.77,-3.04,-6.082103840188376
CC[NH+](CC)Cc1c(C)[nH]c2c3c(ccc2c1=O)Oc1c(ccc2c(=O)c(C[NH+](CC)CC)c(C)[nH]c12)O3,C17123993_decoy,TRY1,Decoy,0,-7.88062,-6.27,-2.53,-5.242068835438168
NC(=O)C1CCN(c2cc(-c3noc([C@@H]4CCC[NH+]4Cc4cccc(OC(F)(F)F)c4)n3)cc[nH+]2)CC1,C35424743_decoy,TRY1,Decoy,0,-9.00227,-9.75,-3.63,-8.711121955437099
CC[NH+]1CCC[C@H]1CNC(=O)[C@H](CC(C)C)N1CC[C@@]2(CCC[NH+]2CC(=O)Nc2ccc(OC)cc2)C1=O,C39266319_decoy,TRY1,Decoy,0,-7.98097,-7.31,-2.51,-6.98697618898674
COc1ccc(C(=O)N2C[C@H](C(=O)NC[C@@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)cc1OC,C39594339_decoy,TRY1,Decoy,0,-10.0319,-5.6,-2.49,-6.205924466920256
COc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)cc1OC,C39594343_decoy,TRY1,Decoy,0,-8.83537,-8.2,-3.27,-7.598058465542126
COc1ccc(C(=O)N2C[C@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)cc1OC,C39594347_decoy,TRY1,Decoy,0,-9.89273,-6.11,-2.53,-6.21084148007014
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)NC[C@H](c3cccnc3)[NH+]3CCCC3)C3(CC[NH2+]CC3)C2)c1C,C39594836_decoy,TRY1,Decoy,0,-9.43176,-8.29,-2.16,-7.0390230176652215
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2c(-c3ccccc3Cl)noc2C)CC12CC[NH2+]CC2,C39626816_decoy,TRY1,Decoy,0,-8.35523,-5.54,-2.69,-5.3932187419460735
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39626971_decoy,TRY1,Decoy,0,-9.89105,-6.68,-1.8,-7.070964294578428
Cc1cc(=O)oc2c(OCC(=O)N3C[C@@H](C(=O)NCC(C)(C)C[NH+](C)C)C4(CC[NH2+]CC4)C3)cccc12,C39630996_decoy,TRY1,Decoy,0,-10.3019,-6.28,-1.16,-6.425648562636563
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c1C,C39634799_decoy,TRY1,Decoy,0,-8.67935,-5.45,-4.42,-6.049377797628458
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39634839_decoy,TRY1,Decoy,0,-9.17959,-6.78,-3.09,-5.917309396608192
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39634840_decoy,TRY1,Decoy,0,-9.84801,-5.4,-1.76,-5.873562882570261
COc1ccc([C@H](CNC(=O)[C@@H]2CN(C(=O)c3cccc(OC(C)=O)c3C)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663840_decoy,TRY1,Decoy,0,-8.99427,-7.57,-3.77,-6.896276800481139
COc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)c3csc(Cl)c3OC)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663885_decoy,TRY1,Decoy,0,-8.49721,-7.46,-1.73,-7.009842429242503
COc1ccc([C@H](CNC(=O)[C@@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)[NH+](C)C)cc1,C39663888_decoy,TRY1,Decoy,0,-8.33054,-6.6,-2.35,-7.608736877646567
CC(=O)Oc1ccccc1C(=O)N1C[C@@H](C(=O)NC[C@H](c2ccccc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39675577_decoy,TRY1,Decoy,0,-9.39914,-6.69,-4.66,-7.308533314610718
CC(=O)Oc1cccc(C(=O)N2C[C@H](C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)c1C,C39675778_decoy,TRY1,Decoy,0,-8.91838,-5.44,-3.92,-5.895989158409125
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678962_decoy,TRY1,Decoy,0,-8.33233,-4.97,-4.47,-6.031468798979505
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1C[C@@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678973_decoy,TRY1,Decoy,0,-9.6952,-6.64,-2.06,-6.9021021009189285
Cc1ccc(Oc2ncccc2C(=O)N2C[C@@H](C(=O)NCCCC[NH+](C)C)C3(CC[NH2+]CC3)C2)cc1,C39679037_decoy,TRY1,Decoy,0,-8.4285,-7.71,-2.17,-8.664737486965368
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39679045_decoy,TRY1,Decoy,0,-8.5265,-5.78,-1.46,-6.755234054096241
Cc1cc(=O)oc2c(OCC(=O)N3C[C@H](C(=O)NCCCC[NH+](C)C)C4(CC[NH2+]CC4)C3)cccc12,C39679070_decoy,TRY1,Decoy,0,-9.68089,-6.06,-4.32,-6.674023004141588
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)c3cc(C)oc3C(F)(F)F)CC23CC[NH2+]CC3)CC1,C39683564_decoy,TRY1,Decoy,0,-9.52415,-5.87,-2.57,-6.253748475036714
COc1ccccc1N1CC[NH+](C[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=O)Nc2cccc(SC)c2)CC1,C43527368_decoy,TRY1,Decoy,0,-10.8418,-7.3,-1.67,-6.854230353203365
CS(=O)(=O)CC[NH2+]Cc1ccc(-c2ccc3c(Nc4ccc(Oc5ccccn5)cc4)cc[nH+]c3c2)o1,C45187025_decoy,TRY1,Decoy,0,-9.18073,-7.3,-2.82,-5.410162020058593
COc1cc2[nH+]c(N3CCC(CCCC4CC[NH2+]CC4)CC3)nc(NCc3ccccn3)c2cc1OC,C45364283_decoy,TRY1,Decoy,0,-11.4974,-8.69,-3.48,-8.4521964473417
Cc1c2oc3c(C)ccc(C(=O)OCC[NH+]4CCCC4)c3nc-2c(C(=O)OCC[NH+]2CCCC2)c(N)c1=O,C05179273_decoy,TRY1,Decoy,0,-10.4235,-7.34,-2.77,-8.538437015063725
C[NH+]1[C@@H](CCC(=O)NCc2cccnc2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1cccc(OC(F)(F)F)c1,C22921068_decoy,TRY1,Decoy,0,-7.81092,-8.62,-1.79,-7.0201375413051625
C[NH+]1[C@@H](CCC(=O)NCc2cccnc2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1ccc(C(F)(F)F)cc1,C35442450_decoy,TRY1,Decoy,0,-6.9873,-6.35,-3.54,-5.392708150975109
N#CN/C(=N\CCCNc1ccccc1[N+](=O)[O-])NCCCCOc1cccc(C[NH+]2CCCCC2)c1,C13456522_decoy,TRY1,Decoy,0,-8.62518,-6.14,-2.4,-7.360771373651055
COc1ccc(/C=C(\NC(=O)c2ccc(Cl)cc2Cl)C(=O)NCCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63431765_decoy,TRY1,Decoy,0,-9.34396,-8.88,-3.59,-9.07281181895463
COc1ccc(N2CC[NH+](CCCNC(=O)C3CCN([C@@H]4[NH+]=c5ccc(C)cc5=[NH+]4)CC3)CC2)cc1,C63694659_decoy,TRY1,Decoy,0,-7.5654,-6.62,-1.7,-5.686450556196035
CC[C@@H](S[C@@H]1[NH+]=c2ccccc2=C2[NH+]=C(CCC3=C(C)N=N[C@@H]3C)NN21)C(=O)Nc1ccc(F)cc1,C63708312_decoy,TRY1,Decoy,0,-9.95469,-8.29,-1.85,-8.270325260865306
CC[C@@H](S[C@@H]1[NH+]=c2ccccc2=C2[NH+]=C(CCC3=C(C)N=N[C@@H]3C)NN21)C(=O)Nc1ccc(OC)cc1,C63708321_decoy,TRY1,Decoy,0,-10.376,-8.2,-3.41,-9.026198293320414
CC[C@H](C)Nc1c[nH+]c2c(c1)[C@@H](NC(=O)[C@@H]1CCOC1)[C@@H](C(=O)OC)N2CCC1=c2ccccc2=[NH+]C1,C63980512_decoy,TRY1,Decoy,0,-8.64478,-6.96,-3.52,-7.965970509108426
CC[C@H](C)CNc1c[nH+]c2c(c1)[C@@H](NC(=O)COC)[C@@H](C(=O)OC)N2CCC1=c2ccccc2=[NH+]C1,C63985770_decoy,TRY1,Decoy,0,-8.77631,-5.96,-1.87,-6.644296420935601
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(NCc3ccccc3F)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63993802_decoy,TRY1,Decoy,0,-8.72341,-7.85,-1.61,-7.600496651113759
C=CCOc1ccccc1C[NH+]1C[C@H](SC2[NH+]=c3ccccc3=[NH+]2)C[C@H]1C(=O)NCc1cccnc1,C64007081_decoy,TRY1,Decoy,0,-10.5009,-7.5,-2.36,-8.08276357814387
CCCC(=O)N[C@H]1c2ccc(C[NH+]3CCC(C4[NH+]=c5ccccc5=[NH+]4)CC3)nc2S[C@@H]1C(=O)OC,C64093770_decoy,TRY1,Decoy,0,-8.11514,-7.46,-3.19,-6.095175991022593
CCOC(=O)N1CCN(c2[nH+]c3cc4c(cc3cc2C[NH2+]CCC2=c3ccccc3=[NH+]C2)CCC4)CC1,C64622372_decoy,TRY1,Decoy,0,-9.96658,-7.95,-2.83,-7.933517405611291
COc1cccc([C@@H](C[NH2+][C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)C2=c3ccccc3=[NH+]C2)c1OC,C64697154_decoy,TRY1,Decoy,0,-7.48448,-8.54,-3.71,-7.582072887053645
COc1ccc(NC(=O)[C@H]2C[C@H](CCSC)[NH2+][C@]23C(=O)Nc2ccccc23)cc1,C04090652_decoy,TRY1,Decoy,0,-8.93181,-5.95,0.23,-6.817003368241204
Cc1cccc(N2CC[NH+](CC(=O)Nc3sccc3C(N)=O)CC2)c1C,C07486417_decoy,TRY1,Decoy,0,-6.73879,-7.3,-1.19,-5.0096750314665845
C[C@@H]([NH2+]CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)c1cccc(Cl)c1,C08704765_decoy,TRY1,Decoy,0,-10.412,-8.94,-2.8,-8.678286566558818
CC(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C11423932_decoy,TRY1,Decoy,0,-8.68069,-5.65,-3.72,-5.526140176551047
Cc1ccc(Cl)cc1NC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12747787_decoy,TRY1,Decoy,0,-7.96826,-5.98,-1.48,-5.312550180100612
O=C(C[C@@H]1C(=O)NCC[NH+]1CC1CCCCC1)NCc1cc2cc(F)ccc2[nH]1,C20601007_decoy,TRY1,Decoy,0,-8.40332,-8.31,-1.72,-7.306273961082597
CCOC(=O)C1=C(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)NC(=O)N[C@@H]1CC,C32764829_decoy,TRY1,Decoy,0,-7.89745,-6.89,-1.35,-5.77488947558203
C[C@@H](C(=O)NC1CCCCC1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C15043568_decoy,TRY1,Decoy,0,-7.0791,-6.35,-3.3,-4.844092712824407
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@@H]([NH2+]CCO)C[C@@H](c3ccccc3)N21,C12603084_decoy,TRY1,Decoy,0,-8.44067,-5.85,-2.11,-6.3873094840251134
O=C(OC[C@H](O)CO)c1ccccc1Nc1cc[nH+]c2cc(Cl)ccc12,C00607910_decoy,TRY1,Decoy,0,-9.109,-7.36,-0.61,-14.48494802809248
O=C(OC[C@@H](O)CO)c1ccccc1Nc1cc[nH+]c2cc(Cl)ccc12,C03872687_decoy,TRY1,Decoy,0,-9.6208,-7.29,-1.48,-10.29451922848344
Nc1cc(=O)[nH]c(S[C@@H](C(=O)C2=c3ccccc3=[NH+]C2)c2ccccc2)n1,C38791130_decoy,TRY1,Decoy,0,-8.02535,-7.47,-1.91,-7.377547493964878
CC[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@@H]1c1cccc(C)c1,C39353299_decoy,TRY1,Decoy,0,-8.1126,-5.69,-4.22,-5.8845511387967
CCc1ccccc1NC(=O)NC1CC[NH+](CC(=O)Nc2ccccc2)CC1,C43402650_decoy,TRY1,Decoy,0,-8.09025,-7.41,-2.37,-6.734928409384956
CCC(=O)Nc1cccc(NC(=O)NC[C@@H](CC)[NH+]2CCc3ccccc3C2)c1,C44104756_decoy,TRY1,Decoy,0,-8.66967,-6.04,-1.14,-5.34457062834168
CCC[C@@H](C(=O)NCC[NH+]1CCCC1)n1c(-c2ccccc2)cc(C(N)=O)c1C,C44144907_decoy,TRY1,Decoy,0,-7.50978,-6.61,-2.55,-7.073230632417972
CC[C@@H](C)NC(=O)CCNC(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1,C47787321_decoy,TRY1,Decoy,0,-7.17264,-6.04,-1.94,-4.820199008149762
C[C@H](CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)C[NH+]1CCCCC1,C48085587_decoy,TRY1,Decoy,0,-8.64917,-5.49,-2.77,-5.447609282518078
CNC(=O)c1ccc(NC(=O)NCC2([NH+]3CCCCC3)CCCCC2)c(C)c1,C48188129_decoy,TRY1,Decoy,0,-9.16565,-6.1,-1.51,-5.823887868566087
COc1cc(C[NH2+][C@@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)cc(OC)c1OCC(N)=O,C48260491_decoy,TRY1,Decoy,0,-9.32621,-5.2,-1.02,-6.034437697153494
CC(=O)Nc1ccc(C)c(NC(=O)NCc2ccccc2C[NH+]2CCCC2)c1,C48274443_decoy,TRY1,Decoy,0,-8.22024,-6.54,-1.48,-5.838981211919197
CC[NH+](CC)Cc1cccc(CNC(=O)Nc2ccc(F)c(C(=O)NC)c2)c1,C50085404_decoy,TRY1,Decoy,0,-8.03285,-6.25,-3.32,-5.646183222374857
CNC(=O)c1cc(NC(=O)NC2CC[NH+](Cc3ccccc3C)CC2)ccc1F,C50085492_decoy,TRY1,Decoy,0,-8.1039,-8.39,-2.67,-6.000066598559684
CC(C)COc1ccccc1NC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C52622171_decoy,TRY1,Decoy,0,-7.79253,-5.23,-2.46,-5.001496630009198
COc1ccc(C[NH+](CC(=O)Nc2sccc2C(N)=O)[C@H](C)C2CC2)cc1,C53097751_decoy,TRY1,Decoy,0,-7.63423,-6.5,-0.51,-5.890126802913575
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C54276922_decoy,TRY1,Decoy,0,-7.90646,-6.0,-2.66,-5.876037282094037
Cc1c(C(=O)NNC(=O)NCC2([NH+](C)C)CCCCC2)oc2ccccc12,C54402592_decoy,TRY1,Decoy,0,-8.08679,-5.45,-1.55,-5.362723793708361
CNC(=O)c1ccc(NC(=O)NCc2ccccc2C[NH+](C)C)cc1Cl,C56694858_decoy,TRY1,Decoy,0,-9.07955,-5.85,-2.26,-5.232730859885296
CCC(=O)Nc1ccc([C@@H](C)NC(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1,C47832738_decoy,TRY1,Decoy,0,-8.2671,-7.22,-1.75,-5.860929275939898
C[C@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)CCCNC(=O)NC2CCCCC2)C1,C60016048_decoy,TRY1,Decoy,0,-8.67941,-6.56,-4.08,-5.865649967277537
C[C@@H]1C[C@H](C)C[NH+](CCCCNC(=O)NCCNC(=O)c2ccccc2F)C1,C50142051_decoy,TRY1,Decoy,0,-8.56381,-6.43,-1.16,-5.686948190682128
CNC(=O)Cc1ccccc1NC(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCC1,C61749946_decoy,TRY1,Decoy,0,-9.03318,-7.25,-1.38,-7.988774995509118
O=C(CNC(=O)NCCC[NH+]1CCc2ccccc2C1)Nc1ccc(F)cc1,C64626183_decoy,TRY1,Decoy,0,-7.94552,-6.72,-1.49,-5.489108580205988
C[NH+](C)[C@@H](CNC(=O)NCC(=O)Nc1cccc(F)c1)c1ccc(F)cc1,C51717828_decoy,TRY1,Decoy,0,-8.29271,-7.84,-2.96,-7.501826447475205
O=C(NCc1ccccc1C[NH+]1CCCC1)Nc1ccc2c(c1)C(=O)NC2=O,C65771514_decoy,TRY1,Decoy,0,-8.46463,-5.82,-1.85,-5.474628379145061
O=C(Cc1ccc(Cl)cc1)NNC(=O)Nc1ccc(N2CCCC2)[nH+]c1,C65775006_decoy,TRY1,Decoy,0,-8.67333,-6.86,-1.44,-6.539164780088157
O=C(NCCC[NH+]1CCc2ccccc2C1)Nc1ccc2c(c1)C(=O)NC2=O,C65788899_decoy,TRY1,Decoy,0,-8.32293,-5.43,-1.57,-4.894404430902531
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)/C=C/c2ccc(OCC(N)=O)cc2)C1,C65835740_decoy,TRY1,Decoy,0,-8.58928,-6.28,-3.47,-5.89734674880603
C[C@H]([NH2+]CC1(c2cccc(F)c2)CCOCC1)C(=O)NC(=O)NC(C)(C)C,C66390220_decoy,TRY1,Decoy,0,-6.84807,-7.0,-1.01,-5.555561157641849
Cc1ccc(NC(=O)NC[C@@H](C)[NH+]2CCCC[C@@H]2C)cc1C(=O)NC(C)C,C66684415_decoy,TRY1,Decoy,0,-7.64204,-5.61,-1.93,-5.361630431666383
COc1cc(C[NH2+][C@@H]2CCCC[C@H]2C(C)(C)C)cc(OC)c1OCC(N)=O,C67186457_decoy,TRY1,Decoy,0,-7.98982,-5.13,-3.63,-5.2657208151736175
Cc1ccsc1C(=O)NNC(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1,C67359415_decoy,TRY1,Decoy,0,-7.17096,-5.78,-1.5,-4.969861458112358
CCCNC(=O)[C@H](C)[NH+]1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1,C67401520_decoy,TRY1,Decoy,0,-8.01025,-5.14,-2.63,-5.899737168502154
CC(=O)Nc1ccc(C)c(NC(=O)NC[C@H]2CCC[NH+]2CC2CCCCC2)c1,C67544026_decoy,TRY1,Decoy,0,-8.89432,-5.8,-2.05,-6.061417179801468
C[NH+](C)CC(=O)Nc1cccc(CNC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)c1,C67564114_decoy,TRY1,Decoy,0,-9.27218,-7.5,-1.28,-8.305807103339049
Cc1cccc(C)c1OC[C@H](O)CNC(=O)NC[C@@H](c1ccccc1)[NH+](C)C,C67589609_decoy,TRY1,Decoy,0,-7.95545,-6.0,-1.21,-6.065384541664964
COc1ccc([C@@H](NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)C(C)C)cc1,C67610446_decoy,TRY1,Decoy,0,-9.30943,-5.25,-1.75,-6.8570508851041945
COc1ccc([C@@H](NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)C2CC2)cc1,C67611798_decoy,TRY1,Decoy,0,-8.75864,-7.41,-2.05,-9.170491012591569
COCCNc1ccc(CNC(=O)NC[C@@]2([NH+](C)C)CCC[C@H](C)C2)cc1,C67631901_decoy,TRY1,Decoy,0,-8.74528,-5.59,-3.29,-5.448945984508521
CC1CC[NH+](C[C@H](O)CNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)CC1,C67634030_decoy,TRY1,Decoy,0,-9.35043,-7.88,-2.84,-6.3816776726005
Oc1ccc(CCCC[NH2+]C[C@H](O)c2ccc(O)c(O)c2)cc1,C01537194_decoy,TRY1,Decoy,0,-7.98183,-5.74,-2.6,-4.957455451305967
COc1cc2c(cc1O)CC[NH+](C[C@@H](O)C[NH2+]CCO)[C@H]2C,C04029370_decoy,TRY1,Decoy,0,-8.82552,-4.5,-2.12,-5.703879081282556
Nc1nc(NCCC[NH3+])nc(NC[C@H]2CCCO2)c1[N+](=O)[O-],C05163249_decoy,TRY1,Decoy,0,-7.4073,-6.49,-0.09,-8.19443655360596
Cc1cc(CO)c(O)c(C[NH2+]Cc2cc(C)cc(CO)c2O)c1,C01638892_decoy,TRY1,Decoy,0,-8.66531,-5.68,-3.19,-5.779126883788485
COc1cc2c(cc1O)CC[NH+](C[C@@H](O)C[NH2+]CCO)[C@@H]2C,C01837058_decoy,TRY1,Decoy,0,-8.84306,-4.74,-2.11,-5.220375576451151
CC[NH+](CC)CCC[C@@H](C)NC(=O)c1coc([C@@H]([NH3+])CO)n1,C06274524_decoy,TRY1,Decoy,0,-8.54236,-5.85,-1.26,-7.835729807695859
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1ccc(CCCCc2ccccc2)cc1,C08627897_decoy,TRY1,Decoy,0,-10.4488,-7.13,-1.97,-8.43730546534191
COc1cc(C[NH2+]CC(C)(C)C[NH+](C)C)ccc1OC[C@H](O)C[NH+]1CCC(O)CC1,C11816627_decoy,TRY1,Decoy,0,-7.8047,-5.95,-3.79,-5.350720715535142
CCc1nc(N)nc(N)c1-c1ccc(NCC[NH3+])c([N+](=O)[O-])c1,C05479321_decoy,TRY1,Decoy,0,-7.92771,-7.39,-2.63,-7.5869722022954225
CC(C)(C[NH2+]C[C@@H](O)COc1ccccc1)C[NH2+]C[C@H](O)COc1ccccc1,C16043809_decoy,TRY1,Decoy,0,-6.65431,-6.25,-4.07,-8.359817104412693
Cc1cc2c(N[C@H](C(=O)NCC[NH3+])[C@H](C)O)ncnc2s1,C31946511_decoy,TRY1,Decoy,0,-7.8939,-6.99,-1.57,-7.623840525699908
CC[NH+](CC)CCOc1ccc([C@H](C[NH3+])[NH+](C)CCO)cc1,C32069319_decoy,TRY1,Decoy,0,-7.29643,-5.12,-1.25,-5.176456053018047
CC[NH+](CC)CCCNc1ccc(NC(=O)CCC[NH3+])cn1,C31961039_decoy,TRY1,Decoy,0,-8.56046,-5.41,-3.91,-5.560109477556003
C[NH+](CCO)[C@H](C[NH3+])c1ccc(OCC[NH+]2CCCCC2)cc1,C32086252_decoy,TRY1,Decoy,0,-8.93818,-5.68,-1.12,-5.575538908145817
CCOc1cc([C@@H](C[NH3+])[NH+](C)CCO)ccc1OCC[NH+](C)C,C32087093_decoy,TRY1,Decoy,0,-9.06659,-4.18,-2.37,-6.215015308104076
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CCC[NH3+])c2C(N)=O)C1,C33521095_decoy,TRY1,Decoy,0,-9.20631,-5.83,-1.49,-6.348303280652526
CC[NH+](CC)CCC[C@H](C)NC(=O)c1coc([C@@H]([NH3+])CO)n1,C06274542_decoy,TRY1,Decoy,0,-9.01564,-5.32,-2.16,-6.053643234839594
OC[C@@H](O)[C@@H](O)[C@H](O)/C(C[NH+]1CCCCC1)=N\Nc1ccccc1,C37263662_decoy,TRY1,Decoy,0,-8.03339,-6.2,-1.52,-6.236508973106646
C[NH+](CCC(=O)Nc1c(Cl)cc(N)cc1Cl)CC(N)=O,C37268133_decoy,TRY1,Decoy,0,-7.38983,-5.11,-2.45,-5.134807916819185
CC(C)[NH+](CCNc1ccc(S(N)(=O)=O)cc1N)C(C)C,C37333583_decoy,TRY1,Decoy,0,-8.93176,-5.45,-1.93,-5.680137187566249
CC(C)[NH+](CCNc1cc(N)cc(S(N)(=O)=O)c1)C(C)C,C37934027_decoy,TRY1,Decoy,0,-8.46774,-5.84,-3.38,-7.037571882142384
CC(C)=CCS[C@@H]1NN[C@H]([C@@H]([NH3+])Cc2c[nH]c3ccccc23)O1,C39016295_decoy,TRY1,Decoy,0,-8.706,-6.79,-1.43,-6.2718122839227854
Cc1cccc(C(=O)N/N=C(\[C@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)c1,C40151319_decoy,TRY1,Decoy,0,-8.53052,-7.7,-1.94,-6.77267755933089
Cc1cccc(C(=O)N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)c1,C40151323_decoy,TRY1,Decoy,0,-8.41788,-6.76,-2.0,-6.702458308132569
CCc1ccccc1Nc1[nH+]cnc(NNc2ccccc2)c1N,C40688237_decoy,TRY1,Decoy,0,-7.79238,-5.85,-1.18,-4.565360997873063
CCCCNc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40706527_decoy,TRY1,Decoy,0,-7.8005,-4.49,-1.91,-4.992821941793652
NC(=S)c1ccccc1OC[C@H](O)C[NH+](CCO)CCO,C40750699_decoy,TRY1,Decoy,0,-6.70634,-4.86,-3.03,-5.322549639539602
Nc1c(NCCC2=CCCCC2)nc[nH+]c1NNc1ccccc1,C40755925_decoy,TRY1,Decoy,0,-7.15745,-5.76,-1.05,-4.817136848479656
Nc1c(NCCc2cccs2)nc[nH+]c1NNc1ccccc1,C40757670_decoy,TRY1,Decoy,0,-7.09174,-6.0,-2.13,-5.79210118088618
CC(C)[NH+](CC(N)=O)[C@@H](C)C(=O)Nc1cc(Cl)ccc1N,C42427887_decoy,TRY1,Decoy,0,-6.98087,-5.88,-1.15,-5.424219107767131
N[C@H](C[NH3+])c1cn(C[C@H]([O-])[NH2+]Cc2ccco2)c2ccccc12,C44473786_decoy,TRY1,Decoy,0,-8.53774,-7.02,0.1,-6.121010270917601
N[C@@H](C[NH3+])c1cn(C[C@H]([O-])[NH2+]Cc2ccco2)c2ccccc12,C44473792_decoy,TRY1,Decoy,0,-8.91967,-6.59,-3.21,-7.044195862783467
NS(=O)(=O)c1ccc(OCC[NH+]2CCC(C[NH3+])CC2)cc1,C44514163_decoy,TRY1,Decoy,0,-8.81185,-6.04,-1.1,-5.827012650532262
CC(C)C[C@@H](C[NH+](C)C)Nc1cc(N)cc(S(N)(=O)=O)c1,C49555051_decoy,TRY1,Decoy,0,-8.81907,-4.57,-3.08,-6.065785034787708
COc1cc(C[NH+]2CC[C@@H]([NH3+])C2)cc(Cl)c1OCC(N)=O,C50227867_decoy,TRY1,Decoy,0,-9.24368,-6.08,-1.09,-7.649984099423917
[NH3+][C@@H](CNc1nccc(-c2ccncc2)n1)[C@H](O)C1=c2ccccc2=[NH+]C1,C52569931_decoy,TRY1,Decoy,0,-7.81884,-5.72,-1.44,-5.518109332038994
Cc1cc(N)[nH+]c(C[C@H]2C[NH2+]C[C@H]2OCC[NH2+]CCc2cccc(F)c2)c1,C40402515_decoy,TRY1,Decoy,0,-8.58529,-7.13,-0.5,-6.822728121920732
Cc1cc(N)[nH+]c(C[C@@H]2C[NH2+]C[C@H]2OCC[NH2+]C[C@H](F)c2cccc(F)c2)c1,C49054901_decoy,TRY1,Decoy,0,-9.91788,-6.17,-1.21,-7.0645252193671615
CC[NH+]1CCC2(CC1)NC(=O)N(CCC(=O)NCC[NH3+])C2=O,C57849047_decoy,TRY1,Decoy,0,-7.72754,-6.22,-1.88,-6.607699994479423
CCC([NH3+])(CC)CN1C(=O)NC2(CC[NH+](CCO)CC2)C1=O,C57850318_decoy,TRY1,Decoy,0,-7.57261,-4.85,-1.17,-4.985757845822341
CC[C@@H]([NH3+])[C@@H](c1ccc(Cl)s1)N(CC(N)=O)CC(N)=O,C61804937_decoy,TRY1,Decoy,0,-8.3391,-3.65,-1.77,-5.118970489451122
C[C@H]([NH3+])[C@@H](c1ccc(Br)s1)N(CC(N)=O)CC(N)=O,C61805395_decoy,TRY1,Decoy,0,-7.95282,-4.47,-2.21,-5.338645295225267
[NH3+]CCN(CC[NH3+])c1ccc(S(=O)(=O)C(F)(F)F)cc1,C61806539_decoy,TRY1,Decoy,0,-8.71257,-5.08,-2.88,-5.698009825554632
NC(=O)C[NH+](CC(N)=O)C[C@H](O)c1ccc(C(N)=S)cc1,C61807161_decoy,TRY1,Decoy,0,-8.49686,-5.49,-1.21,-6.137573244104896
CC[NH2+]Cc1c(N(CC(N)=O)CC(N)=O)nc2sccn12,C61808285_decoy,TRY1,Decoy,0,-7.61441,-3.82,-1.14,-4.775325599116401
NC(=O)CN(CC(N)=O)c1cc(Br)ccc1C[NH3+],C61808290_decoy,TRY1,Decoy,0,-7.2711,-4.77,-1.92,-4.123204913455326
C=C(C)CS[C@@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684078_decoy,TRY1,Decoy,0,-7.97876,-5.64,-2.1,-5.118998255077357
Cc1ccc(CS[C@H]2NN[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)cc1,C63804968_decoy,TRY1,Decoy,0,-8.0023,-8.28,-1.53,-6.964479209614318
Nc1nnc(CCC[NH2+]C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)s1,C63856485_decoy,TRY1,Decoy,0,-8.16408,-7.3,-0.6,-6.9811938174163615
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)NCCCc2n[nH]c(N)c2C#N)C1,C48333303_decoy,TRY1,Decoy,0,-8.01652,-7.94,-1.37,-7.781203875961101
CCC[NH2+]CC(=O)Nc1sc2c(c1C(=O)Nc1cc(Cl)ccc1OC)CCC2,C04554282_decoy,TRY1,Decoy,0,-8.37011,-5.34,-1.96,-5.722793367655737
COc1cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)cc(Br)c1OCC(N)=O,C04954819_decoy,TRY1,Decoy,0,-8.44371,-4.85,-2.16,-5.67849754357547
Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl,C07092833_decoy,TRY1,Decoy,0,-7.54515,-7.46,-2.3,-6.481836259776999
Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl,C07092837_decoy,TRY1,Decoy,0,-8.34669,-7.13,-4.32,-6.097527578591445
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl,C07092838_decoy,TRY1,Decoy,0,-7.65664,-7.56,-3.52,-5.608438742046454
OCC[NH2+]C[C@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C02083336_decoy,TRY1,Decoy,0,-7.13965,-7.55,-2.43,-5.894507769513584
COc1cc(C[NH2+]C2C3CC4CC(C3)CC2C4)cc(Br)c1OCC(N)=O,C08469986_decoy,TRY1,Decoy,0,-9.52574,-6.7,-3.72,-7.678442617757178
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccc(-c3cc(Cl)cc(Cl)c3)o2)cc1,C09193971_decoy,TRY1,Decoy,0,-10.1969,-5.66,-2.87,-5.930149804972252
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH2+]C[C@@H](c2cccs2)c2c[nH]c3ccccc23)c1C,C09256528_decoy,TRY1,Decoy,0,-9.22686,-8.22,-2.23,-8.568297595032005
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccc(-c3ccc(Cl)cc3Cl)o2)cc1,C09356188_decoy,TRY1,Decoy,0,-9.27873,-6.18,-2.62,-5.4860118923420425
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccc(-c3cc(Cl)ccc3Cl)o2)cc1,C09530735_decoy,TRY1,Decoy,0,-10.1742,-5.94,-2.22,-5.675965672687413
CCC[NH+]1CCc2c(sc(NC(=O)CSc3ccc(Cl)cc3)c2C(N)=O)C1,C09630224_decoy,TRY1,Decoy,0,-9.92271,-5.96,-1.61,-6.165660805275431
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1ccccc1C(F)(F)F)NCC1(O)CCCCC1,C12058381_decoy,TRY1,Decoy,0,-7.95713,-7.88,-2.08,-6.068943471684492
OCCC[NH2+]C[C@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C09445790_decoy,TRY1,Decoy,0,-9.03989,-5.18,-0.99,-6.565141393825569
Cc1cc(C)c2c(c1)c(-c1ccccc1)c(-c1ccccc1)n2C[C@H](O)C[NH2+]CCCO,C05587498_decoy,TRY1,Decoy,0,-7.65414,-7.23,-2.16,-7.6998458392945315
Cc1cc(C)c2c(c1)c(-c1ccccc1)c(-c1ccccc1)n2C[C@@H](O)C[NH2+]CCCO,C05587500_decoy,TRY1,Decoy,0,-7.94541,-6.31,-2.22,-6.245740353848722
C[NH+](CCO)Cc1ccc(-c2cc3nccc(Nc4ccc5[nH]ccc5c4)c3s2)cc1,C13588187_decoy,TRY1,Decoy,0,-9.57661,-7.98,-1.14,-6.713873752302172
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(C(F)(F)F)cc4)c3)cc12,C14961724_decoy,TRY1,Decoy,0,-9.80965,-8.74,-2.98,-9.027315154683938
C/C(=N\NC(N)=S)[C@H](C[NH+](C)C)[C@H](c1ccccc1)[C@@H]1COc2ccccc2C1=O,C16958107_decoy,TRY1,Decoy,0,-8.92111,-6.57,-1.96,-8.17530978266291
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl,C07092836_decoy,TRY1,Decoy,0,-7.70531,-8.18,-3.06,-5.987921706724078
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc(Cl)cc(Cl)c1O)N2,C20702027_decoy,TRY1,Decoy,0,-9.36707,-7.04,-3.13,-6.671012628663759
NC(=O)C(CC[NH+]1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1,C22057167_decoy,TRY1,Decoy,0,-8.57148,-6.18,-2.89,-5.718725558649803
Clc1cccc(Nc2cncc(-c3cncc(NCCCN4CC[NH2+]CC4)c3)n2)c1,C22933855_decoy,TRY1,Decoy,0,-9.62736,-6.45,-1.99,-6.494520178164113
CC1(C)CC(NC[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)CC(C)(C)[NH2+]1,C24602388_decoy,TRY1,Decoy,0,-9.25413,-7.67,-2.03,-9.767960813832389
O=C(NCCN1CC[NH2+]CC1)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccc(Cl)cc1Cl,C26805733_decoy,TRY1,Decoy,0,-10.3934,-7.08,-2.89,-6.261262466167643
CC(C)(C)c1[nH+]nc(N/N=C/c2ccc(OCc3ccc(Cl)cc3)cc2)n(N)c1=O,C28114313_decoy,TRY1,Decoy,0,-8.10384,-7.17,-1.24,-6.631083661415186
Nc1c2c(-c3ccccc3)nc(NCC[NH+]3CCCCC3)nc2nn1Cc1ccccc1,C35576642_decoy,TRY1,Decoy,0,-8.69686,-7.57,-3.03,-6.80918434299286
COC(=O)c1cc(Br)cc(Br)c1NC(=O)CCCCC[NH3+],C37769887_decoy,TRY1,Decoy,0,-8.70525,-5.8,-3.74,-8.286909284165718
Oc1ccccc1[C@@H]1CN([C@@H](CNCl)c2ccc(Cc3ccccc3)cc2)CC[NH2+]1,C39531042_decoy,TRY1,Decoy,0,-7.80536,-8.37,-1.82,-6.0549745253818905
CS[C@@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(Cc3ccccc3)cc2)CCN1,C39531103_decoy,TRY1,Decoy,0,-6.98184,-5.11,-1.51,-4.745256690668878
CS[C@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(Cc3ccccc3)cc2)CCN1,C39531104_decoy,TRY1,Decoy,0,-9.09414,-6.71,-0.96,-7.285116813726069
CCCc1ccc([C@H](CNI)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39532668_decoy,TRY1,Decoy,0,-8.3894,-4.92,-1.33,-5.176061859887789
CC(C)Cc1ccc([C@H](CNBr)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39533341_decoy,TRY1,Decoy,0,-8.66699,-5.37,-1.17,-4.848047856998714
CSNC[C@@H](c1ccc(-c2ccccc2O)cc1)N1CC[NH2+][C@H](Cc2ccccc2)C1,C39533939_decoy,TRY1,Decoy,0,-8.67562,-7.39,-0.83,-8.939223112546228
CSNC[C@H](c1ccc(-c2ccccc2O)cc1)N1CC[NH2+][C@H](Cc2ccccc2)C1,C39533940_decoy,TRY1,Decoy,0,-9.2175,-5.53,-1.98,-5.751273689908497
Oc1ccccc1-c1ccc([C@H](CNCc2ccccc2)[NH+]2CCN[C@H](I)C2)cc1,C39534135_decoy,TRY1,Decoy,0,-9.09088,-4.72,-1.08,-5.4328849049356736
Oc1ccccc1-c1ccc([C@@H](CNCc2ccccc2)[NH+]2CCN[C@H](I)C2)cc1,C39534136_decoy,TRY1,Decoy,0,-8.70472,-6.27,-1.51,-5.5105426707882215
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631906_decoy,TRY1,Decoy,0,-8.63692,-6.31,-3.11,-6.728321157634436
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39656172_decoy,TRY1,Decoy,0,-8.82777,-7.58,-2.76,-7.218210273867839
OCCNCC[NH2+]Cc1cc(Br)ccc1OCc1c(F)cccc1Cl,C40720409_decoy,TRY1,Decoy,0,-9.55063,-5.39,-4.12,-7.205280263255997
C=CCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)NCCOC)[C@H](O)[C@H]1[C@@H]2C,C43548236_decoy,TRY1,Decoy,0,-9.17,-4.53,-3.42,-4.936694559381418
C=CCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)NCCOC)[C@H](O)[C@H]1[C@@H]2C,C43548241_decoy,TRY1,Decoy,0,-10.1466,-5.19,-2.59,-7.955639035646056
O=C1CCc2ccc(OCCCC[NH2+]CCNc3cccc(Cl)c3Cl)cc2N1,C44699419_decoy,TRY1,Decoy,0,-9.70061,-6.88,-2.32,-6.9893477082434
COc1ccc(Cl)cc1NC(=O)c1c(NC(=O)C[NH2+]Cc2ccccn2)sc2c1CCC2,C04109394_decoy,TRY1,Decoy,0,-9.15635,-7.47,-1.17,-6.613186808477958
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3C3=NC=CC3)cc12,C52569922_decoy,TRY1,Decoy,0,-10.2711,-9.08,-2.37,-10.27300878586254
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3ccccc3SCC#N)sc2[nH+]1,C14151940_decoy,TRY1,Decoy,0,-9.44813,-8.02,-1.39,-8.18327521719462
OCC[NH2+]CCCNCc1c(OCc2ccc(Cl)cc2Cl)ccc2ccccc12,C13732824_decoy,TRY1,Decoy,0,-8.39995,-5.4,-1.99,-5.4359852120018
O=C(CNc1ccccc1[NH+]1CCC(O)CC1)Nc1ccccc1Sc1ccccc1,C59807070_decoy,TRY1,Decoy,0,-7.47133,-5.82,-4.05,-5.368913016137006
CCNc1nc(Nc2ccc(NS(=O)(=O)c3c(C)cc(C)cc3C)cc2)cc(C)[nH+]1,C64802059_decoy,TRY1,Decoy,0,-7.52885,-7.49,-2.97,-6.834921541503517
CCNc1nc(Nc2ccc(NS(=O)(=O)c3cc(C)c(C)cc3C)cc2)cc(C)[nH+]1,C64802063_decoy,TRY1,Decoy,0,-7.7181,-7.22,-3.73,-6.15201676027232
CCCNC(=O)O[C@@H]1CC[C@]2(C)[C@H](CC[C@@H](O)[C@H]2CC(=O)NCc2ccc3c(c2)OCO3)[C@]1(C)CO,C04236687_decoy,TRY1,Decoy,0,-9.97878,-6.24,-4.57,-7.8172246057377714
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@H](O)[C@@H]1O,C04366778_decoy,TRY1,Decoy,0,-7.29001,-6.34,-1.03,-6.1037148469398375
O=C(NCc1ccc(/C=N\NC(=O)C(=O)Nc2ccccc2Br)o1)C(=O)Nc1ccccc1,C04470030_decoy,TRY1,Decoy,0,-7.27809,-8.46,-3.52,-7.834097216268432
C=CCn1c(CNc2cccc3ccccc23)nnc1S[C@H](C)C(=O)N/N=C/c1ccc(O)cc1O,C00695541_decoy,TRY1,Decoy,0,-10.159,-10.62,-1.93,-8.987699162271682
Cc1ccc(C(OC[C@@H]2O[C@@H](n3ncc(N)nc3=O)[C@@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1,C08740118_decoy,TRY1,Decoy,0,-7.9709,-8.3,-3.84,-7.518122854458318
Cc1ccc(Nc2nc(N)nc(COC(=O)CN3C(=O)N[C@]4(CCCc5ccccc54)C3=O)n2)cc1,C17042126_decoy,TRY1,Decoy,0,-8.46015,-9.31,-3.82,-7.691755777748845
C[C@H](Sc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C18516785_decoy,TRY1,Decoy,0,-9.36304,-5.22,-2.11,-6.00707793775335
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3ccccc3Cl)n2N)sc2c1CCCC2,C20528246_decoy,TRY1,Decoy,0,-11.3721,-9.93,-4.24,-9.463045562923826
CCCCN1C(=O)[NH2+]C([O-])=C(C2=C[C@@H](c3cc(OC)c(O)c(OC)c3)Sc3ccccc3N2)C1=O,C20899122_decoy,TRY1,Decoy,0,-9.28911,-6.69,-2.36,-6.13996128157365
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1nc2ccc(Br)cc2s1,C20906584_decoy,TRY1,Decoy,0,-11.1721,-9.22,-2.04,-8.681602351272346
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3cccc4ccccc34)n2N)sc2c1CCC2,C20912374_decoy,TRY1,Decoy,0,-10.3097,-8.99,-0.79,-7.4685639682967935
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1)Nc1nc2ccc(Br)cc2s1,C21078067_decoy,TRY1,Decoy,0,-9.76779,-9.97,-1.5,-8.866261308720885
COc1cccc(/C=N/Nc2nc(SCCC(=O)Nc3cccc(N4CCCC4=O)c3)n[nH]2)c1O,C21079975_decoy,TRY1,Decoy,0,-9.15408,-7.99,-2.83,-9.115460112423422
CCOc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C21080099_decoy,TRY1,Decoy,0,-9.64667,-7.69,-3.42,-8.134772298564373
COc1ccc(CNc2nnc(SCc3nc(N)nc(Nc4ccc(Cl)cc4)n3)s2)cc1,C24719807_decoy,TRY1,Decoy,0,-9.93765,-8.14,-3.08,-7.527219193979749
CCOC(=O)c1sc2nc(COC(=O)c3nc(Cl)c(Cl)c(N)c3Cl)nc(N)c2c1C,C24879699_decoy,TRY1,Decoy,0,-11.234,-6.92,-3.3,-6.540028451169332
COc1cc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccco2)C(=O)c2c(O)cccc2O)ccc1O,C36500684_decoy,TRY1,Decoy,0,-8.97896,-6.55,-1.8,-7.695280106095422
COc1cc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccco2)C(=O)c2cccc(O)c2O)ccc1O,C36500922_decoy,TRY1,Decoy,0,-9.0882,-6.04,-2.14,-6.536083167284561
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)CCc1ccc(OC)cc1,C36501119_decoy,TRY1,Decoy,0,-8.36193,-4.54,-3.75,-5.5952317468842585
CCCCCCN(C(=O)CC(C)C)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36508631_decoy,TRY1,Decoy,0,-8.42534,-8.32,-2.62,-9.315418012566806
CCCCCCN(C(=O)c1ccc([N+](=O)[O-])cc1)[C@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36521994_decoy,TRY1,Decoy,0,-8.08273,-4.66,-3.38,-5.988202770852604
CCCCCCN(C(=O)CC)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36522518_decoy,TRY1,Decoy,0,-9.08057,-8.26,-2.52,-8.014751890198156
CCCCC/C=C/C(=O)N(CCC)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36563206_decoy,TRY1,Decoy,0,-8.45149,-6.01,-1.45,-6.572814715543113
CCCC[C@@H](CC)C(=O)N(CCC)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36564322_decoy,TRY1,Decoy,0,-7.31137,-6.98,-3.59,-6.0168183623687606
C=C(C)C(=O)N([C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O)C(C)(C)C,C36591931_decoy,TRY1,Decoy,0,-6.52508,-6.27,-2.15,-5.965265798390718
CCOc1ccccc1NC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1cccc(C)c1,C39361730_decoy,TRY1,Decoy,0,-8.65619,-8.46,-2.86,-8.235726751150715
Cc1ccc(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)cc1Cl,C39362790_decoy,TRY1,Decoy,0,-9.9118,-6.2,-3.92,-6.67435118411931
Cc1ccc(C)c(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(Cl)cc2)c1,C39363060_decoy,TRY1,Decoy,0,-8.69068,-6.9,-1.68,-6.783181872219321
C=CCc1cccc(/C=N/NC(=O)c2cc(C(=O)N/N=C/c3cccc(CC=C)c3O)c(C)nc2C)c1O,C03209212_decoy,TRY1,Decoy,0,-10.7863,-9.62,-3.85,-9.621623135502402
COc1ccc(N2C[C@@H](C(=O)N[C@@H]3N[C@H](CC(=O)NCCc4c[nH]c5ccccc45)CS3)CC2=O)cc1,C39707790_decoy,TRY1,Decoy,0,-10.0032,-9.33,-1.29,-7.869883874038086
O=C(NNc1ncnc(NNC(=O)c2ccccc2Cl)c1[N+](=O)[O-])c1ccc(Br)cc1,C40657878_decoy,TRY1,Decoy,0,-9.35682,-8.58,-2.79,-7.294519538788511
NC(=O)c1c(Nc2nc(NC[C@H]3CCCO3)nc3c2cnn3-c2ccccc2)sc2c1CCCC2,C41025975_decoy,TRY1,Decoy,0,-11.3443,-7.23,-1.95,-7.189832716881807
COCCNC(=O)C[C@@H]1c2nc(Nc3cc(OC)ccc3OC)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553633_decoy,TRY1,Decoy,0,-9.93805,-7.5,-1.81,-7.167778607627082
C=CCOC(=O)[C@H]1O[C@H](OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)[C@@H](O)[C@@H](O)[C@@H]1O,C44019934_decoy,TRY1,Decoy,0,-7.0904,-8.28,-2.64,-5.9966409799380775
C=CCOC(=O)[C@@H]1O[C@H](OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)[C@@H](O)[C@H](O)[C@@H]1O,C44019944_decoy,TRY1,Decoy,0,-7.99105,-7.27,-2.46,-7.510378290484695
Cc1ccc(Nc2nc(N)nc(CS[C@H](C)c3nc4scc(-c5ccco5)c4c(=O)[nH]3)n2)cc1,C45618283_decoy,TRY1,Decoy,0,-9.29848,-6.21,-3.34,-6.000659433873897
CC(C)[C@H](NS(=O)(=O)c1ccccc1F)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C45851060_decoy,TRY1,Decoy,0,-8.67283,-6.31,-1.4,-5.409639640109729
CCOc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)ccc1OC(=O)c1ccc(Cl)cc1Cl,C20028465_decoy,TRY1,Decoy,0,-8.76004,-6.73,-2.01,-5.88844041054739
CCN(CC)c1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3Br)n2N)c(O)c1,C58991830_decoy,TRY1,Decoy,0,-10.2613,-7.49,-1.75,-7.571792942206809
O=C(CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1)NCc1cccc(C(F)(F)F)c1,C58997302_decoy,TRY1,Decoy,0,-8.49103,-8.25,-4.07,-8.124387304133474
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(OC(F)(F)F)cc3)n[nH]2)c1O,C58998258_decoy,TRY1,Decoy,0,-9.14757,-6.8,-4.89,-6.624706189372508
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCCCC)s3)n[nH]2)c1O,C59004853_decoy,TRY1,Decoy,0,-10.528,-7.43,-3.49,-9.52003817215848
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc([NH+](CC)CC)cc3)n[nH]2)cc1,C59005629_decoy,TRY1,Decoy,0,-9.16897,-7.09,-5.15,-6.544494065116625
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cccc(OC)c2O)n1,C59016908_decoy,TRY1,Decoy,0,-9.72484,-8.15,-2.75,-8.614608771704246
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C(F)(F)F)cc3)n[nH]2)c(O)c1,C59039139_decoy,TRY1,Decoy,0,-9.20352,-6.47,-1.0,-6.550758413330703
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3cc(Cl)cc(Cl)c3)n[nH]2)c(O)c1,C59039205_decoy,TRY1,Decoy,0,-9.76945,-6.25,-3.1,-8.102795034692484
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(N(CC)CC)cc2O)n1,C59039237_decoy,TRY1,Decoy,0,-10.6564,-7.02,-3.64,-7.259924420631032
CCCc1cc(=O)[nH]c(SCC(=O)Nc2nonc2NC(=O)CSc2nc(=O)cc(CCC)[nH]2)n1,C35163853_decoy,TRY1,Decoy,0,-9.5468,-7.43,-3.59,-7.584689479189299
CCOc1cc(/C=N/NC(=O)Nc2ccc(Cl)cc2)ccc1Oc1c(N)n(C)c(=O)n(C)c1=O,C59599065_decoy,TRY1,Decoy,0,-7.7096,-8.62,-3.09,-6.578451716918389
CC(C)C(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2ccc3ccc4cccc5ccc2c3c45)n1,C59879730_decoy,TRY1,Decoy,0,-9.87526,-7.58,-3.38,-7.328560075510689
CCOc1cc(/C=N/NC(=O)CNC(=O)c2ccc(C)cc2)ccc1OCC(N)=O,C04680400_decoy,TRY1,Decoy,0,-9.28526,-5.7,-1.17,-6.502405663425137
Cc1cccc(NCC[NH2+][C@@H](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C(=O)[O-])c1,C05258507_decoy,TRY1,Decoy,0,-5.65565,-7.21,-2.26,-5.183970663565847
CC(C)=CCC[C@H](C)CCN(O)C[C@@H](CO)O[C@@H](CO)n1cc(C)c(=O)[nH]c1=O,C06006311_decoy,TRY1,Decoy,0,-8.95091,-6.68,-3.43,-7.086270811518208
CCOc1ccccc1C(=O)NCC(=O)OCC(=O)Nc1sccc1C(N)=O,C07563453_decoy,TRY1,Decoy,0,-6.97472,-7.21,-2.13,-6.212163509971623
CCCCn1c(N)c(N(CCOC)CC(=O)Nc2cc(C)cc(C)c2)c(=O)[nH]c1=O,C10565282_decoy,TRY1,Decoy,0,-7.50281,-6.47,-2.78,-8.386280863531718
CCOC(=O)c1c(NC(=O)COC(=O)[C@@H](C)NC(N)=O)sc(C(C)=O)c1C,C03329405_decoy,TRY1,Decoy,0,-9.37633,-5.86,-3.4,-6.486830454059898
CCNc1ccc(S(=O)(=O)N(CC)CC)cc1NCC(=O)NC(=O)NC(C)(C)C,C15328563_decoy,TRY1,Decoy,0,-8.69856,-5.08,-2.23,-6.108940583345549
O=[N+]([O-])c1ccc([C@H](O)CNC(=S)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1,C13304322_decoy,TRY1,Decoy,0,-6.97616,-5.38,-2.81,-5.878039529366262
CCOc1ccc(Nc2nc(NCCCN3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C20289028_decoy,TRY1,Decoy,0,-8.4813,-6.81,-0.87,-6.474647824105688
CCOc1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccco3)n2N)cc1,C20528004_decoy,TRY1,Decoy,0,-8.55622,-7.18,-2.19,-6.572098255593327
CCOc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1,C21078160_decoy,TRY1,Decoy,0,-8.63492,-8.57,-3.22,-8.36080160712077
CCCCn1c(N)c(N(CC)CC(=O)NCCCC(=O)OCC)c(=O)[nH]c1=O,C21387632_decoy,TRY1,Decoy,0,-7.09733,-6.35,-3.11,-6.24804367721804
CCNc1ccc(S(=O)(=O)N(CC)CC)cc1NCC(=O)NC(=O)NC(C)C,C21699156_decoy,TRY1,Decoy,0,-8.02678,-6.42,-3.99,-8.560464609058359
O=C(CCCCCCC(=O)Nc1ccccc1)NO[C@@H]1O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]1O,C22066537_decoy,TRY1,Decoy,0,-5.13531,-7.09,-3.28,-5.654935040951261
CCOc1ccc(OCC)c(NC(=O)CNc2cc([N+](=O)[O-])ccc2NCCO)c1,C22729999_decoy,TRY1,Decoy,0,-7.2289,-7.02,-2.2,-6.520351014346
CCCCn1c(N)c(N(C)C(=S)NCCCN2CCOCC2)c(=O)[nH]c1=O,C25571825_decoy,TRY1,Decoy,0,-8.09089,-5.87,-2.79,-5.312845582479893
CCOC(=O)C1=C(CSc2nnc(CCC(N)=O)n2CC(C)C)NC(=O)NC1,C26225763_decoy,TRY1,Decoy,0,-7.93002,-6.42,-3.28,-7.340560591699957
Cc1ccc([C@@](O)(CCNC(=O)NCCNc2ccccc2[N+](=O)[O-])C(F)(F)F)o1,C26288923_decoy,TRY1,Decoy,0,-6.77432,-7.41,-3.34,-5.927613388247968
CCOC(=O)C=C(NNc1ccccc1[N+](=O)[O-])NNc1ccccc1[N+](=O)[O-],C35193475_decoy,TRY1,Decoy,0,-6.46889,-7.18,-1.42,-8.196900305194426
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)c1ccc([N+](=O)[O-])cc1,C36577969_decoy,TRY1,Decoy,0,-7.78321,-4.99,-1.48,-5.765478295236767
O=C(CCCCCCC(=O)Nc1ccccc1)NO[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]1O,C39937438_decoy,TRY1,Decoy,0,-4.55715,-7.19,-3.43,-5.295995935738657
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NCCCOC)c2N)cc1,C40757109_decoy,TRY1,Decoy,0,-7.61811,-5.31,-2.46,-5.29660035427539
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NCCOC)c2N)cc1,C40759466_decoy,TRY1,Decoy,0,-7.12428,-4.64,-3.97,-4.613478704807803
CCOC(CNc1nc(N)c([N+](=O)[O-])c(Nc2cccc3cccnc23)n1)OCC,C41334153_decoy,TRY1,Decoy,0,-6.50501,-7.16,-2.38,-7.397197463679404
CCCCn1c(N)c(N(C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c(=O)[nH]c1=O,C45780043_decoy,TRY1,Decoy,0,-6.84787,-6.37,-3.49,-5.434367408087868
CCOCCCNC(=S)NNC(=O)CN1C(=O)NC2(CCC(C)CC2)C1=O,C46585866_decoy,TRY1,Decoy,0,-8.67424,-6.57,-3.52,-7.42861343493839
CCOCCCNC(=S)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21,C46585936_decoy,TRY1,Decoy,0,-7.64309,-6.52,-4.13,-5.753749970960684
CCOC(=O)N[C@@H](CNC(=O)NNc1ccc(-n2cccn2)nn1)CC(C)C,C47054998_decoy,TRY1,Decoy,0,-7.59729,-6.3,-1.75,-6.155633398315693
CCCCn1c(N)c(N(C)C[C@@H](O)COc2ccc(OC)cc2)c(=O)[nH]c1=O,C11237970_decoy,TRY1,Decoy,0,-7.5211,-7.05,-2.5,-6.440034531441693
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCC(=O)NCCOC)cc1,C54739024_decoy,TRY1,Decoy,0,-7.8559,-5.91,-2.06,-5.542830139269865
O=[N+]([O-])c1ccc(NC(=S)NCCNC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1,C16213426_decoy,TRY1,Decoy,0,-7.48098,-4.95,-1.74,-5.4390475681181
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)NCc3ccco3)n[nH]2)c1O,C05899328_decoy,TRY1,Decoy,0,-8.95077,-7.5,-1.76,-7.248956079929898
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)NC(C)C)n[nH]2)c(O)c1,C59039187_decoy,TRY1,Decoy,0,-9.63981,-7.11,-2.16,-7.0321514054304375
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)NC3CCCC3)n[nH]2)c(O)c1,C59039188_decoy,TRY1,Decoy,0,-9.61077,-5.82,-2.19,-5.764255658253085
O=C(CCCCC[C@@H]1CCNC(=O)N1)NNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C59435079_decoy,TRY1,Decoy,0,-7.45316,-6.64,-3.97,-6.590673633572986
O=C(CCCCC(=O)NNc1ccccc1[N+](=O)[O-])NNc1ccccc1[N+](=O)[O-],C59459853_decoy,TRY1,Decoy,0,-7.00486,-7.81,-3.12,-9.019364029393886
CC(=O)OC[C@H]1O[C@@H](NC(=S)NN)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C59601367_decoy,TRY1,Decoy,0,-7.62104,-5.29,-0.74,-6.251355945526146
CC(=O)OC[C@H]1O[C@@H](NC(=S)NN)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C59601374_decoy,TRY1,Decoy,0,-6.38635,-5.88,-1.5,-7.992913815304067
CCCCNC(=O)CSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2O)n1,C59813258_decoy,TRY1,Decoy,0,-7.93349,-5.71,-3.81,-5.588884158566709
C=CCNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2ccc(O)c(OCC)c2)n1,C59820542_decoy,TRY1,Decoy,0,-9.50814,-6.71,-1.61,-8.21218789564859
C=CCn1cc(/C=N/Nc2nc(SCC(=O)NNc3ccc(Cl)cc3)n[nH]2)cn1,C59832448_decoy,TRY1,Decoy,0,-8.88885,-7.12,-3.59,-5.9683818536619375
CCCCNC(=O)CSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59888370_decoy,TRY1,Decoy,0,-9.06557,-6.67,-1.31,-6.517555200049601
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NCC(C)C)n[nH]1,C59888392_decoy,TRY1,Decoy,0,-9.21865,-7.22,-1.61,-7.846076414119357
CCCC/C(C)=N/Nc1nc(SCCC(=O)Nc2cccc(NC(C)=O)c2)n[nH]1,C59891180_decoy,TRY1,Decoy,0,-8.57317,-7.83,-3.8,-8.423916617336756
CCCC/C(C)=N/Nc1nc(SCCC(=O)Nc2ccc3c(c2)C(=O)NC3=O)n[nH]1,C59891289_decoy,TRY1,Decoy,0,-7.61396,-6.99,-3.32,-6.3606552834667145
CCCC/C(C)=N/Nc1nc(SCCC(=O)Nc2ccccc2NC(C)=O)n[nH]1,C59891295_decoy,TRY1,Decoy,0,-8.75573,-7.86,-3.28,-8.164895315482607
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)NC[C@@H]1CCCO1,C65146986_decoy,TRY1,Decoy,0,-8.10009,-7.04,-2.2,-6.189555640265689
CCCCn1c(N)c(N(CC)C(=O)CCCNC(=O)C(C)(C)C)c(=O)[nH]c1=O,C67179787_decoy,TRY1,Decoy,0,-7.42182,-4.72,-3.95,-4.85947103431241
CCOCCCNC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1c(C)noc1C,C67313042_decoy,TRY1,Decoy,0,-7.19364,-6.13,-3.7,-5.393232227475286
COc1cccc(OC)c1OC[C@@H](O)CNC(=O)NCCNc1ncccn1,C67603605_decoy,TRY1,Decoy,0,-7.19616,-4.81,-1.55,-5.074705904045663
CC1(C)CC(NC(=O)C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C00758002_decoy,TRY1,Decoy,0,-9.1213,-5.48,-2.7,-5.340004507768319
C=C1c2cccc(O)c2C(O)=C2C(=O)[C@]3(O)C(O)=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@H]12,C04019716_decoy,TRY1,Decoy,0,-7.32184,-7.26,-1.93,-5.456406137784643
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@](C)(O)[C@H]3[C@@H](O)[C@@H]12,C04574743_decoy,TRY1,Decoy,0,-9.43908,-5.91,-3.19,-4.498155487482111
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@@H](O)[C@@H]12,C04574746_decoy,TRY1,Decoy,0,-8.71803,-6.46,-5.24,-4.709081428550235
CC1=C(Sc2ccc(Br)cc2)[C@@H]([NH3+])Nc2nc(N)nc(N)c21,C01612726_decoy,TRY1,Decoy,0,-8.84964,-8.12,-0.52,-9.350467170535888
OC[C@H](O)C[NH2+]CCNc1c2ccccc2[nH+]c2cc(Cl)ccc12,C04748031_decoy,TRY1,Decoy,0,-7.52424,-6.1,-0.1,-4.870971918175659
Oc1ccc2[nH]cc(CC[NH2+]C[C@@]3(O)OC[C@@H](O)[C@@H](O)[C@@H]3O)c2c1,C05567530_decoy,TRY1,Decoy,0,-5.88862,-8.0,-2.69,-5.956953433053609
CC1(C)CC(NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C05762123_decoy,TRY1,Decoy,0,-7.51056,-4.79,-0.85,-4.474895956442418
NC(=O)C1CCN(C(=O)[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3Cn2cc(C[NH3+])nn2)CC1,C08299705_decoy,TRY1,Decoy,0,-8.44652,-6.82,-2.37,-5.562765092630918
Nc1nc2c(c(=O)[nH]1)N[C@H]([NH+]1CCCCC1)N2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08955224_decoy,TRY1,Decoy,0,-6.66651,-7.99,-3.56,-7.194290845179292
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@H]12,C11592624_decoy,TRY1,Decoy,0,-8.19163,-6.18,-2.78,-5.205662752619917
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@H]([NH+](C)C)[C@H]3[C@H](O)[C@@H]21,C11592656_decoy,TRY1,Decoy,0,-8.50013,-7.73,-4.3,-6.284238045216637
CC1(C)CC(NC(=O)C(=O)Nc2c[nH]c(=O)[nH]c2=O)CC(C)(C)[NH2+]1,C12322341_decoy,TRY1,Decoy,0,-7.06382,-6.34,-1.37,-5.810654070818484
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@@H]12,C08586064_decoy,TRY1,Decoy,0,-7.91658,-5.69,-1.89,-4.329960670814738
[NH3+][C@@H]1NC(=O)c2[nH+]c(N3CCCCC3)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2N1,C19720039_decoy,TRY1,Decoy,0,-9.90649,-6.36,-1.61,-7.382593629565643
C(=N/NC1=[NH+]CCN1)\c1cn2cc(/C=N/[NH+]=C3NCCN3)ccc2n1,C27433173_decoy,TRY1,Decoy,0,-8.42625,-6.65,-1.32,-5.871284376702474
Cc1c(C)n(C[C@H](O)C[NH2+]C(CO)(CO)CO)c2c(Cl)cccc12,C28296760_decoy,TRY1,Decoy,0,-7.77086,-6.45,-3.13,-5.79341665964573
CC1CCN(c2[nH+]c3c(n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)N[C@H]([NH3+])NC3=O)CC1,C33643222_decoy,TRY1,Decoy,0,-8.53769,-6.4,-0.92,-10.995389509351616
N[C@@H]1NC(=O)c2[nH+]c(N3CCCCC3)n([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2N1,C36281891_decoy,TRY1,Decoy,0,-7.69819,-8.72,-2.1,-10.178076951429608
C[NH+]1CCN(c2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C33923631_decoy,TRY1,Decoy,0,-8.04782,-5.04,-1.18,-4.3932414416424
CC(C)C[C@@H]([NH3+])C(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37034042_decoy,TRY1,Decoy,0,-6.50995,-4.74,-0.81,-4.725871055136402
O=C(Nc1cc2[nH]c(=O)[nH]c2cc1Br)[C@@H]1C[C@H](O)C[NH2+]1,C37034049_decoy,TRY1,Decoy,0,-7.10237,-5.55,-0.01,-4.453764483278088
C[C@]([NH3+])(C(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br)C1CC1,C37615457_decoy,TRY1,Decoy,0,-6.4843,-4.62,-2.06,-4.045130083399872
CCC[C@](C)([NH3+])C(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37622454_decoy,TRY1,Decoy,0,-6.53188,-4.31,-0.92,-4.3196219339497
[NH3+]CC(=O)NCC(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C37629580_decoy,TRY1,Decoy,0,-7.96214,-5.56,-1.03,-5.291368314001557
Nc1ccc2c(c1)=N[C@@H](c1ccccc1[C@@H]1N=c3cc(N)ccc3=[NH+]1)[NH+]=2,C39698145_decoy,TRY1,Decoy,0,-7.00145,-9.08,-0.85,-8.274083478584117
Nc1ccc2c(c1)=N[C@H](c1ccc([C@H]3N=c4cc(N)ccc4=[NH+]3)cc1)[NH+]=2,C39702014_decoy,TRY1,Decoy,0,-6.99127,-8.44,-0.31,-6.810321287388819
Nc1c(NNc2ccccc2)nc[nH+]c1Nc1ccc2c(c1)OCO2,C40684785_decoy,TRY1,Decoy,0,-6.85962,-6.52,-2.48,-5.737878851782253
C[NH+]1CCN(Nc2[nH+]cnc(Nc3ccc(Cl)cn3)c2N)CC1,C40756871_decoy,TRY1,Decoy,0,-7.76177,-4.94,-0.79,-5.261599215887282
C[NH+]1CCN(Nc2[nH+]cnc(N3CCN(c4cccc[nH+]4)CC3)c2N)CC1,C40757015_decoy,TRY1,Decoy,0,-8.33735,-5.12,-1.27,-5.423729022709043
Nc1cc(=O)[nH]c(S[C@@H](C[NH3+])c2ccccc2Br)n1,C43096470_decoy,TRY1,Decoy,0,-7.5423,-6.78,-4.38,-9.15540289200963
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Br)s1,C43284239_decoy,TRY1,Decoy,0,-9.34253,-6.32,-0.9,-7.076771946611293
Nc1cc(N)nc(S[C@H](C[NH3+])c2cc(Br)cs2)n1,C43291173_decoy,TRY1,Decoy,0,-8.48003,-6.63,-4.28,-8.030106645150582
NC(=O)C[C@H]([NH3+])c1cc(Br)cc(OC(F)(F)F)c1O,C44256173_decoy,TRY1,Decoy,0,-8.68184,-6.67,-3.57,-8.512650453911483
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1SCCCCCC[NH3+],C04533983_decoy,TRY1,Decoy,0,-7.64738,-4.53,-3.36,-5.299482131945055
COc1ccc([C@@H]([NH3+])[C@@H]([NH3+])c2ccc(OC)cc2OC)c(OC)c1,C44670695_decoy,TRY1,Decoy,0,-7.56965,-6.04,-3.09,-7.221903852719921
C[NH+](C)CC[NH+](C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC1CC[NH+](C)CC1,C20464983_decoy,TRY1,Decoy,0,-6.44476,-4.34,-3.02,-4.435605401426417
Nc1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627747_decoy,TRY1,Decoy,0,-6.90571,-8.14,-1.64,-5.99532363447954
[NH3+]C[C@H]1CC2=c3cc(C(=O)Nc4cccnc4)ccc3=[NH+][C@H]2C(=O)N1,C52637449_decoy,TRY1,Decoy,0,-9.64456,-8.22,-1.47,-7.496013765755014
NC1=C2C=CC=C[C@@H]2[NH+]=C(CSCC2=[NH+]C(N)=C3C=CC=C[C@@H]3N2)N1,C08394334_decoy,TRY1,Decoy,0,-9.95902,-7.66,,99.0
C[C@H]([NH3+])c1ccc(Sc2nc(N)cc(N)n2)c(Br)c1,C61700319_decoy,TRY1,Decoy,0,-9.59983,-6.44,-1.02,-8.165037890757693
C[C@H]([NH3+])c1ccc(Sc2nc(N)cc(=O)[nH]2)c(Br)c1,C61700331_decoy,TRY1,Decoy,0,-9.53108,-6.91,-1.06,-8.09333638139766
C[NH+]1c2ccc(N)cc2N[C@H]1c1ccc(C2[NH+]=c3ccccc3=[NH+]2)cc1,C63427056_decoy,TRY1,Decoy,0,-6.83518,-6.78,-2.03,-4.887562484098095
NN1[C@@H](c2ccc(F)cc2)NN[C@H]1SCC1[NH+]=c2ccccc2=[NH+]1,C63619690_decoy,TRY1,Decoy,0,-7.83545,-8.09,-0.73,-5.756061514456642
Clc1ccc2c(c1)=[NH+][C@H](SC[C@@H]1N[NH2+]NN1c1ccccc1)[NH+]=2,C63740008_decoy,TRY1,Decoy,0,-6.74342,-7.38,-1.28,-6.076021552081254
COc1ccc2c(c1)=[NH+][C@H](SC[C@@H]1N[NH2+]NN1c1ccccc1)[NH+]=2,C63743031_decoy,TRY1,Decoy,0,-8.48693,-5.02,-1.02,-5.313863145697388
FC(F)(F)c1cccc(N2N[NH2+]N[C@H]2CSC2[NH+]=c3ccccc3=[NH+]2)c1,C63956343_decoy,TRY1,Decoy,0,-6.83023,-7.89,-4.08,-6.219217935438651
Cc1cc(=O)[nH]c2cc(NC(=O)CS[C@@H]3N[NH2+]NN3C)ccc12,C64423417_decoy,TRY1,Decoy,0,-8.52075,-7.76,-4.02,-7.069661833765065
Cc1cc2c(c(-c3cc(N4CC[NH+](C)CC4)nc(N)n3)c1)O[C@H](C[NH3+])C2,C67641929_decoy,TRY1,Decoy,0,-9.4569,-6.81,-1.64,-7.353831694296819
CCn1cc[nH+]c1C[NH+]1CCC[C@@H](CNC(=O)C2([NH3+])CCCC2)C1,C67650705_decoy,TRY1,Decoy,0,-8.89431,-6.0,-1.31,-5.948256325305692
CC[NH+](CC)CCCN(Cc1cc2ccc(OC)cc2[nH]c1=O)C(=S)NCCCOC,C06193026_decoy,TRY1,Decoy,0,-9.08001,-6.06,-4.36,-7.151925428610776
CC[NH+](CC)CCN(Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C(=S)Nc1ccc(F)cc1,C06193388_decoy,TRY1,Decoy,0,-8.28993,-5.97,-2.08,-5.499426838107532
CCc1ccccc1NC(=S)N(CCC[NH+](C)C)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C06135454_decoy,TRY1,Decoy,0,-8.6463,-5.75,-5.78,-5.863364237632336
C[NH+](C)CCCNC(=S)N(Cc1ccc(F)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C06198530_decoy,TRY1,Decoy,0,-8.82187,-6.24,-1.41,-6.028270601750098
C[NH+](C)CCCNC(=S)N(Cc1cccs1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C06198554_decoy,TRY1,Decoy,0,-7.13256,-6.36,-2.25,-6.062480119827641
C[NH+](C)CCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCCc1ccccc1,C06198575_decoy,TRY1,Decoy,0,-8.1482,-7.64,-1.49,-7.091298074844219
CC(C)c1ccc(S(=O)(=O)[C@H](CNC(=O)C(=O)NCC[NH+](C)C)c2cccs2)cc1,C09104919_decoy,TRY1,Decoy,0,-8.32956,-6.47,-2.88,-6.950393522538023
CCOc1ccc2[nH]c(=O)c(CN(CC[NH+](CC)CC)C(=O)Nc3ccccc3F)cc2c1,C12708337_decoy,TRY1,Decoy,0,-8.75246,-7.37,-3.51,-7.3379919161699805
CC[NH+](CC)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=O)Nc1ccc(OC)cc1,C12710785_decoy,TRY1,Decoy,0,-9.54559,-7.61,-2.1,-8.325820975575395
COc1ccc2[nH]c(=O)c(C[NH+](CCO)[C@@H](c3nnnn3Cc3ccccc3)C(C)C)cc2c1,C13498671_decoy,TRY1,Decoy,0,-7.41497,-6.71,-2.71,-5.534022599255582
Cc1cc(C)c2cc(C[NH+](CCO)[C@@H](c3nnnn3CCc3ccccc3)C(C)C)c(=O)[nH]c2c1,C13499082_decoy,TRY1,Decoy,0,-7.57402,-7.9,-3.41,-6.37671666345671
CCC[C@@H](c1nnnn1C(C)(C)C)[NH+](CCCO)Cc1cc2cc(C)c(C)cc2[nH]c1=O,C13499506_decoy,TRY1,Decoy,0,-8.02976,-5.54,-2.32,-5.684532139657434
CCC[C@@H](c1nnnn1C[C@@H]1CCCO1)[NH+](CCCO)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C13499678_decoy,TRY1,Decoy,0,-8.4359,-6.04,-3.14,-5.528146114995339
CCOc1ccc2[nH]c(=O)c(C[NH+](CCCO)[C@H](c3nnnn3C3CCCC3)C(C)C)cc2c1,C13500578_decoy,TRY1,Decoy,0,-7.93881,-6.1,-1.82,-5.866681792388807
CC[NH+](CC)CCOC(=O)c1ccc(N/C=C2\C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1,C09355018_decoy,TRY1,Decoy,0,-7.60347,-6.42,-2.33,-5.16184309876787
COC(=O)c1c(S(=O)(=O)NCCC2=CCCCC2)sc2c1CC[NH+](CC[C@@H](C)O)C2,C14984248_decoy,TRY1,Decoy,0,-11.6473,-6.53,-1.76,-7.935280270104533
COc1cc(C[NH2+]C2CCC(n3cc(C(=O)NCC(C)C)nn3)CC2)cc(OC)c1OC,C14992632_decoy,TRY1,Decoy,0,-8.38978,-6.05,-3.59,-5.5641646959161175
COCCN(Cc1nc(C(=O)NCC[NH+]2CCCC2)cs1)C(=O)Nc1ccc(Cl)cc1,C16459105_decoy,TRY1,Decoy,0,-10.1062,-7.24,-1.8,-7.635394885716866
CC[NH+](CC)CCCN1C(=O)C(=O)/C(=C(/O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1ccc(Cl)cc1,C09008326_decoy,TRY1,Decoy,0,-8.20644,-4.59,-2.01,-5.948843296431675
CC[NH+](CC)CCCN1C(=O)C(=O)/C(=C(/O)c2c(C)[nH]c(C(=O)OC)c2C)[C@@H]1c1ccncc1,C09185101_decoy,TRY1,Decoy,0,-9.05657,-5.1,-1.7,-6.498628377810008
CC[NH+](CC)CCN1C(=O)C(=O)/C(=C(/O)c2ccc(OCC(C)C)cc2)[C@@H]1c1ccc(O)cc1,C09244169_decoy,TRY1,Decoy,0,-8.51956,-6.76,-0.71,-7.504814925385644
CCC(C)(C)n1nnnc1[C@H](C(C)C)[NH+](CCCO)Cc1cc2cc(C)ccc2nc1O,C08681746_decoy,TRY1,Decoy,0,-6.67628,-6.35,-3.13,-5.797933804369593
COc1ccccc1N1CCN([C@H](c2cccs2)[C@@H](C)NC(=O)C(=O)NCC[NH+](C)C)CC1,C20289599_decoy,TRY1,Decoy,0,-9.22621,-6.19,-1.99,-7.567085072025803
COc1cc(CN(Cc2ccco2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc(OC)c1OC,C21263114_decoy,TRY1,Decoy,0,-9.05007,-5.4,-4.45,-5.852032925409689
CC[NH+](CC)[C@@H](CNC(=O)CS[C@@H](C)C(=O)Nc1cc(C)on1)c1ccccc1Cl,C27578629_decoy,TRY1,Decoy,0,-9.36191,-7.15,-2.01,-8.66892644867517
C=CCOc1ccc(C[NH+](C)CC(=O)NN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)cc1,C28954398_decoy,TRY1,Decoy,0,-7.91769,-4.65,-2.69,-5.455917337113204
COc1ccc(-c2csc3nc(C[NH+](C)C[C@H](O)COC(C)C)[nH]c(=O)c23)cc1OC,C35745944_decoy,TRY1,Decoy,0,-8.85067,-6.53,-3.72,-6.780889672919972
C=CCOC(=O)c1sc2nc(C[NH+](Cc3ccco3)C[C@@H](O)C(C)C)[nH]c(=O)c2c1C,C35746661_decoy,TRY1,Decoy,0,-9.16094,-5.63,-3.52,-6.307765514677225
C=CCOC(=O)c1sc2nc(C[NH+](Cc3ccccc3)C[C@@H](O)COC)[nH]c(=O)c2c1C,C35747074_decoy,TRY1,Decoy,0,-9.4879,-6.68,-1.86,-8.617485915453859
C#CCOC[C@@H](O)C[NH+](Cc1ccccc1)Cc1nc2sc(C(=O)OC)c(C)c2c(=O)[nH]1,C35747125_decoy,TRY1,Decoy,0,-8.6646,-6.08,-3.26,-6.179971702236336
C#CCOC[C@@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1)C1CCCCC1,C35747447_decoy,TRY1,Decoy,0,-8.70399,-6.76,-1.68,-6.806451538233205
CCCC(=O)Nc1ccc([C@H]2OC(=O)N(Cc3ccc(F)cc3)[C@H]2C(=O)NCC[NH+](C)C)cc1,C35750543_decoy,TRY1,Decoy,0,-7.98408,-6.72,-1.95,-5.968288744831141
Cc1ccsc1C[NH+](CCc1c[nH]c2ccccc12)Cc1nc(C(=O)NC[C@@H]2CCCO2)co1,C36073607_decoy,TRY1,Decoy,0,-9.65919,-7.69,-2.14,-8.925183986485303
COCC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCC3)C[C@H](O)COCc1ccccc1,C36158818_decoy,TRY1,Decoy,0,-8.84275,-6.46,-1.92,-5.8786413883593776
COCC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCC3)C[C@H](O)COc1ccccc1C,C36159559_decoy,TRY1,Decoy,0,-8.75688,-6.0,-2.09,-6.065381056951301
O=c1[nH]c(C[NH+](Cc2ccco2)C[C@@H](O)COCc2ccco2)nc2sc3c(c12)CCC3,C36159589_decoy,TRY1,Decoy,0,-8.35129,-6.96,-1.43,-6.214346199621769
CCOC[C@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)C(C)C,C36205949_decoy,TRY1,Decoy,0,-8.84753,-5.54,-3.56,-5.99138690576555
CCC[NH+](Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1)C[C@H](O)COC(C)C,C36206317_decoy,TRY1,Decoy,0,-8.5663,-6.93,-1.81,-9.222038967588144
C=CCOC[C@H](O)C[NH+](CCOC)Cc1nc2scc(-c3ccccc3F)c2c(=O)[nH]1,C36207800_decoy,TRY1,Decoy,0,-9.1195,-6.37,-2.44,-8.748491832491114
CCC[C@@H](c1nnnn1C[C@H]1CCCO1)[NH+](CCCO)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C33937291_decoy,TRY1,Decoy,0,-7.77629,-6.39,-1.74,-6.076852347106272
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C36684453_decoy,TRY1,Decoy,0,-7.97284,-6.85,-2.18,-6.87716663444809
CCCSc1nnc(NC(=O)CS[C@H]2N=NC(N/N=C/c3ccc(Cl)cc3)=[NH+]2)s1,C39404352_decoy,TRY1,Decoy,0,-8.98714,-8.1,-2.54,-10.881615816865894
C=CCOC(=O)c1sc2nc(C[NH+](C[C@H](O)COCC(C)C)C3CC3)[nH]c(=O)c2c1C,C40404779_decoy,TRY1,Decoy,0,-9.52235,-4.66,-3.91,-6.049706551025506
COC(=O)c1sc2nc(C[NH+](CC(C)C)C[C@@H](O)COc3ccccc3)[nH]c(=O)c2c1C,C36207492_decoy,TRY1,Decoy,0,-7.34644,-7.06,-2.04,-6.524074692254758
CC[NH+](CC)CCOC(=O)c1ccc(N/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1,C09235776_decoy,TRY1,Decoy,0,-8.36687,-7.07,-2.33,-5.748884227185151
N#Cc1ccc(OC[C@@H](O)CN2CCC[NH+](C[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1,C22919099_decoy,TRY1,Decoy,0,-9.3507,-8.71,-2.2,-8.586473199498107
CC[NH+](CC)CCn1/c(=N/C(=O)c2ccccc2SCC(=O)NC(C)C)[nH]c2ccccc21,C60392159_decoy,TRY1,Decoy,0,-9.45155,-7.23,-2.68,-8.55957815763667
CCCCN1C(=O)NC(=O)/C(=C(/CC)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)OC)C1=O,C63425549_decoy,TRY1,Decoy,0,-7.39598,-6.0,-1.41,-6.417731409117377
CCOC(=O)C1=C(COC(=O)CC2=c3ccccc3=[NH+]C2)NC(=O)N[C@H]1c1ccc(OC)cc1,C64337921_decoy,TRY1,Decoy,0,-8.03889,-7.34,-2.46,-6.535879482244226
COc1ccc(NC(=O)[C@H]2N=N[C@@H](COCC(=O)NCCC3=c4cc(C)ccc4=[NH+]C3)S2)cc1,C64491472_decoy,TRY1,Decoy,0,-7.38389,-7.07,-2.06,-5.674039041879385
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=S)N[C@H]2C[C@@H]3C=C[C@H]2C3)cc1,C01048052_decoy,TRY1,Decoy,0,-9.00295,-6.4,-3.36,-6.370062116481765
CCOc1cc(NC(=S)NCCCOC)c(OCC)cc1NC(=O)c1ccc(C)cc1,C06089671_decoy,TRY1,Decoy,0,-7.59821,-5.28,-2.8,-5.304544101930785
CCc1ccc2[nH]c(=O)c(CN(CCCO)C(=S)Nc3ccccc3C(=O)OC)cc2c1,C06135045_decoy,TRY1,Decoy,0,-7.9304,-7.26,-2.3,-6.744833480578829
CCc1ccccc1NC(=S)N(CCCO)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C06135461_decoy,TRY1,Decoy,0,-8.00851,-6.99,-2.69,-6.01032949519028
CCOC(=O)C1=C(CSCC(=O)OCC(=O)Nc2ccc(C)c(C)c2)NC(=O)N[C@@H]1C,C09126613_decoy,TRY1,Decoy,0,-9.11138,-7.21,-2.74,-6.368321471219372
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)c1ccccc1NCc1ccco1,C09023291_decoy,TRY1,Decoy,0,-8.03996,-8.08,-2.87,-7.649123333577282
CCOCCOc1ccc(C(=O)NC(=S)NNC(=O)Cc2cccc3ccccc23)cc1,C09822042_decoy,TRY1,Decoy,0,-7.75791,-6.36,-1.7,-5.119976517425006
CCOCC(=O)NNC(=S)NC(=O)c1cc(Br)ccc1OCCC(C)C,C10286208_decoy,TRY1,Decoy,0,-8.39083,-6.49,-3.05,-6.702271320692507
CCCCCCNc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@@H](O)COc1ccc(C)c(C)c1,C10385400_decoy,TRY1,Decoy,0,-8.40461,-7.45,-3.4,-8.066943859544283
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=S)NC(=O)COc1ccccc1,C12502164_decoy,TRY1,Decoy,0,-8.08371,-8.23,-2.49,-6.679302995703242
CCOc1ccc(/C=C/C(=O)NC(=S)NNC(=O)COc2ccccc2[C@H](C)CC)cc1,C13621110_decoy,TRY1,Decoy,0,-10.0067,-7.09,-2.48,-8.751974735118022
O=C(CCCOc1ccc(Cl)cc1Cl)NC(=S)Nc1ccccc1C(=O)NC[C@H]1CCCO1,C14000521_decoy,TRY1,Decoy,0,-9.90557,-7.32,-2.3,-9.879545357662552
Cc1ccc(OCC(=O)NNC(=S)NC(=O)CCCC(=O)OCCCc2ccccc2)c(C)c1,C14016303_decoy,TRY1,Decoy,0,-9.15032,-7.37,-2.38,-6.468363799694484
CCCOC(=O)c1ccc(OCC(=O)NNC(=S)NC(=O)C(c2ccccc2)c2ccccc2)cc1,C14021934_decoy,TRY1,Decoy,0,-9.28168,-7.73,-3.46,-8.583019494640572
CCCOC(=O)c1ccc(OCC(=O)NNC(=S)NC(=O)/C=C/c2ccc(F)cc2)cc1,C14021995_decoy,TRY1,Decoy,0,-8.99065,-8.15,-3.07,-8.812918526969451
CC(C)CCOc1ccccc1C(=O)NC(=S)Nc1ccccc1C(=O)NC[C@H]1CCCO1,C14034281_decoy,TRY1,Decoy,0,-8.4146,-7.49,-1.82,-10.511990682501953
CCCOc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccc([C@H](C)CC)cc1,C14037150_decoy,TRY1,Decoy,0,-8.22555,-5.86,-4.11,-5.732236383715509
CCOc1ccc(NC(=S)/N=C(\NCCc2cccs2)Nc2nc(C)cc(C)n2)cc1,C14159053_decoy,TRY1,Decoy,0,-10.284,-5.22,-3.09,-6.580452982328144
CCCCN(C(=O)CCc1ccc(-c2ccccc2)o1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14623954_decoy,TRY1,Decoy,0,-8.82862,-5.83,-3.08,-7.717760413641066
CCCCN(C(=O)COc1ccc(C(C)(C)C)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14624218_decoy,TRY1,Decoy,0,-8.66132,-6.82,-2.04,-6.080727730340532
CCCCCN(C(=O)COc1ccc(Cl)cc1Cl)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697802_decoy,TRY1,Decoy,0,-8.89253,-6.16,-4.75,-6.764614917166592
COCCN(C(=O)CSC(c1ccccc1)c1ccccc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14721252_decoy,TRY1,Decoy,0,-8.36175,-6.75,-2.09,-7.779299291685469
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1,C18053870_decoy,TRY1,Decoy,0,-6.40019,-7.23,-1.75,-5.189671747466654
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1,C18071855_decoy,TRY1,Decoy,0,-9.49751,-6.34,-2.8,-6.611371504667544
CCCCn1c(N)c(N(CCC(C)C)C(=O)COc2ccc(C(C)C)cc2)c(=O)[nH]c1=O,C18118086_decoy,TRY1,Decoy,0,-8.51122,-7.54,-2.84,-9.964910677418066
CCCCc1ccc(CC(=O)N(Cc2ccco2)c2c(N)n(CCCC)c(=O)[nH]c2=O)cc1,C19623623_decoy,TRY1,Decoy,0,-8.72816,-7.37,-2.75,-7.023628790075307
CCN(CC)c1ccc(/C=N/Nc2nc(SCCC(=O)Nc3cc(Cl)ccc3Cl)n[nH]2)cc1,C21076339_decoy,TRY1,Decoy,0,-10.7256,-7.16,-3.68,-9.172592003657735
COc1cc(NC(=S)/N=C(/NCC(C)C)Nc2nc(C)cc(C)n2)cc(OC)c1OC,C14156245_decoy,TRY1,Decoy,0,-8.66255,-6.5,-4.08,-6.4544976253170825
CCNc1ccc(S(=O)(=O)N(CC)CC)cc1NCC(=O)Nc1ccccc1C(C)C,C21699146_decoy,TRY1,Decoy,0,-8.42626,-6.25,-3.99,-6.470000168196688
CCCCOc1ccc(C(=O)NCC(=O)Nc2nc(-c3c[nH]c(C(=O)OC)c3)cs2)cc1,C30986881_decoy,TRY1,Decoy,0,-10.3918,-8.41,-2.96,-8.010912059387888
CCCCC(=O)Nc1ccc(NC(=S)NC(=O)COc2ccc(Cl)cc2)cc1OC,C32115521_decoy,TRY1,Decoy,0,-8.92242,-7.17,-2.56,-7.701767337170278
CCCCNC(=O)Nc1cccc([C@H]2NC(=O)N(CCC)C(C)=C2C(=O)OCC(C)C)c1,C33375765_decoy,TRY1,Decoy,0,-8.88233,-6.48,-3.62,-6.62954695343613
CCCCCCN(C(=O)CO)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1cccc(O)c1,C36517705_decoy,TRY1,Decoy,0,-8.93487,-8.22,-4.03,-9.875748717938558
CCOc1cc(NC(=S)NC[C@H]2CCCO2)c(OCC)cc1NC(=O)c1ccc(F)cc1,C13544466_decoy,TRY1,Decoy,0,-7.84214,-6.42,-1.14,-6.563065054226024
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](CC(=O)NCCCN2CCOCC2)C(C)C)cc1,C20766201_decoy,TRY1,Decoy,0,-8.34083,-6.41,-1.81,-6.794627879050655
CCOc1cc(/C=C/C(=O)NCCc2ccc(S(N)(=O)=O)cc2)ccc1OCC(C)C,C09662027_decoy,TRY1,Decoy,0,-8.55381,-6.74,-2.42,-6.357903792217023
O=C(CNC(=O)CNC(=O)c1ccc(Cl)cc1Cl)NCCCCOc1ccccc1,C39536858_decoy,TRY1,Decoy,0,-9.07852,-7.95,-2.13,-9.82497995402801
CCCCCCOc1ccc([C@@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2CCCO)cc1,C39911568_decoy,TRY1,Decoy,0,-8.86452,-5.77,-2.57,-7.377931774700755
CCCCSc1nc2n(n1)[C@H](c1ccc(OCCC)c(OCC)c1)C(C(N)=O)=C(C)N2,C40986855_decoy,TRY1,Decoy,0,-8.94214,-6.41,-0.8,-8.085735774109768
COCCOc1ccc(C(F)(F)F)cc1NC(=O)CSc1nc(C)c(CC(N)=O)s1,C45698975_decoy,TRY1,Decoy,0,-8.40344,-6.84,-2.31,-6.579331088684898
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)c3ccc(OC)c(OC)c3)n[nH]2)c1O,C58998187_decoy,TRY1,Decoy,0,-11.4926,-8.1,-4.87,-8.349311944502666
CCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C(/CC)c2ccccc2)n1,C59020645_decoy,TRY1,Decoy,0,-9.02165,-7.18,-1.74,-6.814688866055093
CC[C@@H](C)c1ccccc1OCC(=O)NNC(=S)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1,C10450592_decoy,TRY1,Decoy,0,-8.76769,-8.39,-4.12,-6.899297626223477
CCOC(=O)c1cc(CC)sc1NC(=O)CNc1ccc(C(=O)NCC(C)C)c(Cl)c1,C59806731_decoy,TRY1,Decoy,0,-9.30049,-6.08,-3.64,-7.538754268982526
C=CCNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2ccc(COc3ccc(F)cc3)o2)n1,C59818168_decoy,TRY1,Decoy,0,-9.43881,-6.43,-3.12,-6.889987991837812
C=CCn1cc(/C=N/Nc2nc(SCC(=O)NCCc3ccccc3Cl)n[nH]2)cn1,C59831925_decoy,TRY1,Decoy,0,-9.70688,-7.49,-3.76,-7.477962248109199
CCC/C(C)=N/Nc1nc(SCC(=O)Nc2sc3c(c2C(=O)OCC)CCC3)n[nH]1,C59889932_decoy,TRY1,Decoy,0,-11.1935,-5.44,-1.39,-6.599587796843265
CCCC/C(C)=N/Nc1nc(SCC(=O)Nc2sc3c(c2C(=O)OC)CCC3)n[nH]1,C59891333_decoy,TRY1,Decoy,0,-11.295,-7.75,-3.5,-8.26556859328703
CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N/N=C(\C)CC(C)C)n2)sc2c1CCC2,C59891952_decoy,TRY1,Decoy,0,-11.3194,-6.8,-4.62,-7.276654993922746
Cc1ccc(C)c(NC(=O)CCC(=O)NNC(=O)C(C)(C)CCCOc2cc(C)ccc2C)c1,C66201420_decoy,TRY1,Decoy,0,-8.64943,-8.73,-1.19,-7.725167341851909
CCCC[NH+](CCCC)CCNC(=O)C1=C(C)C(=O)OC12CCN(S(=O)(=O)CC)CC2,C20581847_decoy,TRY1,Decoy,0,-8.78091,-4.82,-4.82,-5.739031575237098
C=CC[NH+](CC=C)[C@H](CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1)C(C)C,C23074872_decoy,TRY1,Decoy,0,-6.99796,-5.56,-1.62,-5.505649393584562
COCC[NH+](Cc1ccc(C)o1)Cc1ccc(C(O)(c2ccc(OC)cc2)c2ccc(OC)cc2)o1,C35745194_decoy,TRY1,Decoy,0,-9.3291,-7.63,-3.58,-8.070638558656878
C#CCOC[C@@H](O)C[NH+](Cc1ccco1)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(Cl)cc1,C35777700_decoy,TRY1,Decoy,0,-8.20169,-4.16,-2.74,-4.887284900874592
CC(C)COC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)noc1N1CCC(C)CC1)C[C@H]1CCCO1,C35781443_decoy,TRY1,Decoy,0,-8.53432,-5.05,-1.83,-6.48235728303702
C#CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(C)cc1)CC1CC1,C35782506_decoy,TRY1,Decoy,0,-8.02232,-6.71,-3.18,-7.729884466735628
CCc1nn(-c2ccccc2)c(Oc2ccccc2F)c1C[NH+](C[C@H](O)COC(C)C)C(C)C,C35782627_decoy,TRY1,Decoy,0,-6.6889,-6.12,-3.19,-6.742376976330232
C#CCOC[C@@H](O)C[NH+](CCC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1,C35784694_decoy,TRY1,Decoy,0,-7.07526,-6.2,-2.77,-7.56901684820443
Cc1ccc(Oc2c(C[NH+](CC3CC3)C[C@@H](O)COc3ccccc3)c(C)nn2-c2ccccc2)cc1,C35789046_decoy,TRY1,Decoy,0,-9.10294,-7.34,-1.84,-9.66246125455972
C#CCOC[C@H](O)C[NH+](Cc1c(-c2ccc(F)cc2)noc1N(CC)CC)CC1CC1,C36249749_decoy,TRY1,Decoy,0,-8.12703,-6.07,-3.39,-7.165221725075808
CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)noc1N(C)Cc1ccccc1)CC1CC1,C36249907_decoy,TRY1,Decoy,0,-7.77825,-6.72,-3.6,-10.691774887347414
CC(C)COC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1)C(C)C,C36301565_decoy,TRY1,Decoy,0,-7.95423,-6.93,-2.32,-8.00526444445709
CC(C)COC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1N(C)C)CC(C)C,C36301633_decoy,TRY1,Decoy,0,-7.16048,-6.73,-2.9,-7.177282500401481
COCC[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(OC)cc1)C[C@H](O)COC,C36302474_decoy,TRY1,Decoy,0,-6.60369,-5.82,-2.86,-6.302960936787281
CCC[C@H](O)C[NH+](CCOC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccccc1Cl,C36303481_decoy,TRY1,Decoy,0,-6.89709,-5.12,-3.55,-4.906575397830843
CCOC[C@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1F)CC(C)C,C36303996_decoy,TRY1,Decoy,0,-6.91938,-6.26,-2.47,-6.4590916945296
C#CCOC[C@@H](O)C[NH+](CCOC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1F,C36304048_decoy,TRY1,Decoy,0,-8.30107,-5.94,-1.71,-6.67178454226062
CCOC[C@@H](O)C[NH+](Cc1ccco1)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1F,C36304082_decoy,TRY1,Decoy,0,-8.00957,-5.03,-4.66,-5.396041096083778
C=CCC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1F)C[C@@H]1CCCO1,C36304225_decoy,TRY1,Decoy,0,-7.41061,-5.65,-2.27,-5.622017583804275
C=CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1Cl)C1CC1,C36305007_decoy,TRY1,Decoy,0,-8.77196,-6.79,-2.66,-7.691774134719516
CCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1Cl)CC1CC1,C36305066_decoy,TRY1,Decoy,0,-8.06187,-6.47,-5.38,-8.247262506696632
CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(Cl)cc1)C[C@@H]1CCCO1,C36305191_decoy,TRY1,Decoy,0,-8.78603,-6.94,-2.06,-10.40117993362289
COC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)CC(C)C,C36305718_decoy,TRY1,Decoy,0,-7.2759,-5.91,-4.46,-5.21128202198477
C#CCOC[C@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC,C36305770_decoy,TRY1,Decoy,0,-7.79742,-6.43,-1.77,-7.087028336273066
C=CCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1OC)C1CC1,C36305860_decoy,TRY1,Decoy,0,-7.40933,-7.05,-2.65,-7.453354358041323
C#CCOC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(OC)cc1)CC(C)C,C36305977_decoy,TRY1,Decoy,0,-8.44075,-6.57,-3.73,-7.886606165003067
CCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(OC)cc1)C[C@H](O)COC,C36306292_decoy,TRY1,Decoy,0,-7.72244,-6.96,-2.67,-9.187873226446523
C=CCC[C@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1F,C36306711_decoy,TRY1,Decoy,0,-8.00001,-6.69,-3.11,-8.497301126154623
CC(C)OC[C@@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1F)CC1CC1,C36306865_decoy,TRY1,Decoy,0,-7.91586,-6.71,-2.44,-6.976849114542283
C=CCC[C@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1,C36307447_decoy,TRY1,Decoy,0,-7.28395,-4.73,-2.56,-5.422208914063639
C=CCC[C@H](O)C[NH+](Cc1ccco1)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1,C36307508_decoy,TRY1,Decoy,0,-8.07191,-7.76,-2.91,-8.261116606607038
C=CCOC[C@H](O)C[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(F)cc1)C(C)C,C36307594_decoy,TRY1,Decoy,0,-7.97216,-6.67,-3.29,-7.477356770625357
CC(C)c1nn(-c2ccccc2)c(Oc2ccccc2F)c1C[NH+](C[C@H](O)COC(C)(C)C)C1CC1,C36307899_decoy,TRY1,Decoy,0,-8.17974,-6.19,-2.72,-8.001213870920466
Cc1nn(-c2ccccc2)c(Oc2ccccc2)c1C[NH+](C[C@H](O)COC(C)(C)C)C[C@H]1CCCO1,C36308612_decoy,TRY1,Decoy,0,-7.95882,-6.98,-1.93,-7.166575170859267
CCc1nn(-c2ccccc2)c(Oc2ccccc2OC)c1C[NH+](CCOC)CC(C)(C)O,C36308737_decoy,TRY1,Decoy,0,-6.11685,-5.17,-2.75,-6.348532083010249
CCCC[C@@H](O)C[NH+](CCOC)Cc1c(-c2ccccc2)nn(C)c1Oc1ccccc1F,C36313814_decoy,TRY1,Decoy,0,-7.33478,-6.04,-2.47,-7.487626346961615
C=CCC[C@@H](O)C[NH+](Cc1ccco1)Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(C)cc1,C36316012_decoy,TRY1,Decoy,0,-7.95456,-7.0,-2.85,-11.362812135628271
CCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(C)cc1)C[C@H](O)COc1ccccc1C,C36316054_decoy,TRY1,Decoy,0,-8.8518,-7.46,-1.77,-8.442942324808188
CC[C@H](C)[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1)C[C@H](O)COC(C)C,C36342071_decoy,TRY1,Decoy,0,-7.69309,-5.62,-1.1,-6.224436638515657
C=CCC[C@@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1cccc(F)c1)C[C@@H]1CCCO1,C36346405_decoy,TRY1,Decoy,0,-7.92054,-6.89,-2.81,-8.867611992423024
C#CCOC[C@@H](O)C[NH+](Cc1c(CC)nn(-c2ccccc2)c1Oc1ccc(C)cc1)C(C)C,C36346519_decoy,TRY1,Decoy,0,-8.27038,-4.53,-3.0,-5.936326757958484
COCC[NH+](Cc1c(C)nn(-c2ccc(F)cc2)c1Oc1ccccc1F)C[C@@H](O)COC(C)C,C36346564_decoy,TRY1,Decoy,0,-7.87109,-6.12,-2.97,-7.634832218266528
Cc1nn(-c2ccc(F)cc2)c(Oc2ccccc2F)c1C[NH+](C[C@@H](O)COCC(C)C)C(C)C,C36346582_decoy,TRY1,Decoy,0,-7.24338,-6.67,-3.92,-6.838316625865739
CCCOc1ccc(C[NH+](C[C@@H](O)COc2ccccc2C=O)[C@@H]2CCS(=O)(=O)C2)cc1,C40318772_decoy,TRY1,Decoy,0,-7.56167,-6.76,-2.99,-6.274797830537797
CCOc1cc(C=O)ccc1OC[C@@H](O)C[NH+](Cc1ccc(Cl)cc1)Cc1ccco1,C40320250_decoy,TRY1,Decoy,0,-8.4566,-7.61,-2.35,-8.626897880841495
CCOc1cc(C=O)ccc1OC[C@H](O)C[NH+](Cc1ccc(OC)cc1)Cc1ccco1,C40320322_decoy,TRY1,Decoy,0,-7.99636,-7.09,-4.28,-7.172672375834379
CCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3ccc(C)cc3)C(=O)N2CCCn2cc[nH+]c2)cc1OCC,C40341575_decoy,TRY1,Decoy,0,-8.20462,-6.01,-0.55,-6.205280403857901
C#CCOC[C@@H](O)C[NH+](CCC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(Cl)cc1,C40408018_decoy,TRY1,Decoy,0,-7.25053,-5.08,-3.59,-6.418998765505757
C#CCOC[C@H](O)C[NH+](CCC)Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(Cl)cc1,C40408022_decoy,TRY1,Decoy,0,-8.56788,-4.91,-3.71,-6.006299839728052
C#CCOC[C@H](O)C[NH+](Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(Cl)cc1)CC(C)C,C36341953_decoy,TRY1,Decoy,0,-7.06743,-5.07,-3.86,-5.255836883244064
CCCCN1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C05351825_decoy,TRY1,Decoy,0,-8.12041,-5.81,-1.19,-7.958092209249786
O=C([O-])c1c(C[NH+]2CCOCC2)c(O)c(O)c(O)c1C[NH+]1CCOCC1,C01603614_decoy,TRY1,Decoy,0,-7.12986,-5.53,-2.22,-4.947530024949682
CCCn1c(N)c(C(=O)C[NH+]2CCN(c3ccc(O)cc3)CC2)c(=O)[nH]c1=O,C06587019_decoy,TRY1,Decoy,0,-7.07702,-8.08,-2.92,-5.250090734490764
NC(=O)c1c(NC(=O)C(=O)N2CC[NH+](CCO)CC2)sc2c1CCC2,C06719729_decoy,TRY1,Decoy,0,-8.33846,-6.63,-1.47,-6.387166784873595
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCN(c2ccccc2O)CC1,C08309204_decoy,TRY1,Decoy,0,-8.507,-7.33,-1.69,-6.523901385335869
CCCCN1C(=O)[C@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C08994239_decoy,TRY1,Decoy,0,-7.72066,-5.2,-1.32,-5.5929352735561855
O=C1NC(=O)[C@@](CCCc2ccccc2)(C2CC[NH+](C[C@H](O)CO)CC2)N1,C12098596_decoy,TRY1,Decoy,0,-7.5656,-6.11,-1.51,-5.617595089620759
Cc1ccc2c(c1)c1c(n2C[C@@H](O)C[NH2+]C(CO)(CO)CO)C(=O)CCC1,C06393538_decoy,TRY1,Decoy,0,-7.49152,-6.93,-0.77,-8.038229077133119
COCCN1C(=O)[C@@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C09348379_decoy,TRY1,Decoy,0,-8.94265,-6.09,-3.53,-5.737151794159474
O=C(Nc1cccc(Cl)c1)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCC(O)CC3)[NH+]2C1,C15708741_decoy,TRY1,Decoy,0,-9.71223,-8.12,-1.83,-6.668513573019851
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3cc[nH+]cc3)c2N)cc1,C40687638_decoy,TRY1,Decoy,0,-7.44157,-8.2,-1.14,-8.522345028554154
Cc1ccccc1C(=O)NNc1ncnc(N(C)C2CC[NH+](C)CC2)c1N,C40784386_decoy,TRY1,Decoy,0,-7.34093,-6.18,-1.23,-5.176370366266625
CC[NH+]1CCC[C@H]1CNS(=O)(=O)c1cc(Br)cnc1NN,C41069989_decoy,TRY1,Decoy,0,-8.06288,-6.48,-3.46,-5.962198873499943
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)CC(C)C,C41333860_decoy,TRY1,Decoy,0,-8.04067,-6.42,-4.08,-6.767909797850654
C[NH+](C)CCCCNS(=O)(=O)c1cc(Br)cnc1NN,C41681767_decoy,TRY1,Decoy,0,-7.6441,-5.56,-2.97,-5.605019369090837
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1,C41725616_decoy,TRY1,Decoy,0,-9.21957,-5.86,-3.39,-5.675053839836686
CC[NH+]1CCN(c2ccc(NC(=O)C(=O)NCCCC(N)=O)c(C)c2)CC1,C42044500_decoy,TRY1,Decoy,0,-7.91081,-6.26,-1.86,-5.91282152831919
O=C(NCC[NH+]1CCCCC1)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1,C42893617_decoy,TRY1,Decoy,0,-7.98773,-6.73,-2.28,-5.891723948322015
C[NH+](C)C(C)(C)CNS(=O)(=O)c1cc(Br)cnc1NN,C43412228_decoy,TRY1,Decoy,0,-7.4823,-5.69,-3.92,-7.67952675581298
NC(=O)C[C@H]([NH3+])c1cc([N+](=O)[O-])ccc1Oc1ccc(C(F)(F)F)cc1,C44254047_decoy,TRY1,Decoy,0,-7.18853,-7.35,-4.84,-7.721466381756529
NC(=O)C[C@@H]([NH3+])c1ccc2oc(C(=O)c3ccc4c(c3)OCCO4)cc2c1,C44254739_decoy,TRY1,Decoy,0,-9.85418,-6.49,-1.6,-6.419122229212236
C[NH+]1CCCC[C@@H]1CNS(=O)(=O)c1cc(Br)cnc1NN,C44565273_decoy,TRY1,Decoy,0,-8.18818,-6.61,-3.16,-7.507499071842853
NNc1ncc(Br)cc1S(=O)(=O)N[C@H]1CC[NH+](C2CC2)C1,C44680600_decoy,TRY1,Decoy,0,-7.40145,-5.64,-2.53,-6.342866963448761
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccccc1,C47964377_decoy,TRY1,Decoy,0,-9.03807,-7.04,-3.4,-6.49090813285584
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccsc1,C47999012_decoy,TRY1,Decoy,0,-8.64664,-6.43,-2.55,-6.973211962200652
Cc1c(NC(=O)C(=O)NC[C@@H](c2cccs2)[NH+](C)C)cccc1C(N)=O,C48743411_decoy,TRY1,Decoy,0,-7.76676,-7.38,-2.17,-6.653200989082796
C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1cc(Br)cnc1NN,C49560657_decoy,TRY1,Decoy,0,-7.48172,-4.77,-3.19,-4.897553529867735
CCCC[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C36059962_decoy,TRY1,Decoy,0,-7.97419,-4.91,-3.28,-3.4810606862296622
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(OCC[NH3+])cc21,C49089603_decoy,TRY1,Decoy,0,-10.1411,-6.15,-1.41,-7.280980757951288
Cc1ccc(OC[C@H](O)Cn2c(NCC[NH3+])nc3c2c(=O)[nH]c(=O)n3C)cc1,C13810793_decoy,TRY1,Decoy,0,-8.52855,-6.23,-0.95,-8.307082563294028
CCCNC(=O)[C@H]1CCC[NH+](CCC(=O)Nc2sccc2C(N)=O)C1,C50997624_decoy,TRY1,Decoy,0,-8.37946,-6.29,-2.67,-7.221885318955128
CCCCNC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51061541_decoy,TRY1,Decoy,0,-7.5957,-5.34,-1.57,-4.788975370320837
CCCNC(=O)C[NH+]1CCC(NC(=O)C(C)(C)NC(=O)NCCC)CC1,C58131069_decoy,TRY1,Decoy,0,-7.26476,-6.14,-1.57,-6.222087230632312
CC[C@]1(C)NC(=O)N(NC(=O)CNc2ccccc2[NH+]2CCC(O)CC2)C1=O,C55887978_decoy,TRY1,Decoy,0,-6.84046,-6.12,-2.01,-5.076893768142947
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)NC(N)=O,C39792407_decoy,TRY1,Decoy,0,-8.94475,-5.29,-1.26,-6.233473146489353
N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OC[C@@H]1O[C@H](O)[C@H](O)[C@H](O)[C@H]1O,C63225512_decoy,TRY1,Decoy,0,-6.44892,-6.46,-1.3,-5.077930953276894
[NH3+][C@H]1CCCC[C@H]1N/C=C1/C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393249_decoy2,TRY1,Decoy,0,-9.69647,-6.86,,-7.416922136614082
O=C(NCCNC(=O)[C@@H]1C=c2ccccc2=[NH+]1)C(=O)Nc1cccc(O)c1,C63795575_decoy,TRY1,Decoy,0,-8.1738,-6.03,-3.75,-6.0590014800277325
O=C(CCCc1c[nH]c2ccccc12)NNC(=O)NCCCn1cc[nH+]c1,C64885487_decoy,TRY1,Decoy,0,-8.36605,-7.87,-3.24,-6.453841049420798
COc1ccc(C)cc1NCCC(=O)NNC(=O)NCCCn1cc[nH+]c1,C64885722_decoy,TRY1,Decoy,0,-8.47617,-6.44,-3.23,-7.611816249894655
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCCCn1cc[nH+]c1,C64886702_decoy,TRY1,Decoy,0,-7.61688,-4.66,-1.86,-5.174941814036747
CCn1c(CC2CCN(C(=O)CS[C@H]3N[NH2+]NN3C)CC2)n[nH]c1=O,C65404634_decoy,TRY1,Decoy,0,-7.80427,-7.05,-2.94,-8.308112631312166
CCC[NH+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1,C67393739_decoy,TRY1,Decoy,0,-9.50776,-6.6,-2.04,-6.422284665413968
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2sccc2C(N)=O)C1,C67438259_decoy,TRY1,Decoy,0,-8.02213,-5.95,-3.01,-5.598610582120869
CC(=O)Nc1cc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)ccc1F,C67539132_decoy,TRY1,Decoy,0,-8.25776,-7.33,-2.37,-6.344805082444785
CNC(=O)C[NH+]1CCC(NC(=O)Nc2ccc(NC(C)=O)cc2Cl)CC1,C67575673_decoy,TRY1,Decoy,0,-8.33328,-5.31,-0.88,-5.508294457537581
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCC(=O)NC2CCCCC2)CC1,C67630823_decoy,TRY1,Decoy,0,-9.57434,-5.82,-1.69,-7.145083328392248
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@@]2([NH2+][C@@H]3CCC(N)=O)C(=O)Nc3c2ccc(C)c3C)cc1,C02130563_decoy,TRY1,Decoy,0,-8.35788,-5.87,-1.41,-5.417138309279333
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3CCC(N)=O)C(=O)Nc3c2ccc(C)c3C)cc1,C02130564_decoy,TRY1,Decoy,0,-9.35669,-5.93,-1.29,-5.92051977736442
COc1ccc(CN2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@@]4(C(=O)Nc5c4ccc(C)c5C)[C@@H]3C2=O)cc1,C02130566_decoy,TRY1,Decoy,0,-8.60398,-5.77,-1.91,-5.810071196400118
COc1ccc(CN2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@]4(C(=O)Nc5c4ccc(C)c5C)[C@@H]3C2=O)cc1,C02130567_decoy,TRY1,Decoy,0,-9.17373,-7.02,-1.64,-7.241991665579768
CCOc1c(Cl)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1OC,C04488480_decoy,TRY1,Decoy,0,-7.17346,-5.68,-1.79,-5.564849875632032
C[NH+](Cc1nc2ccccc2c(=O)[nH]1)[C@H](C(=O)NC(N)=O)c1ccccc1,C06553363_decoy,TRY1,Decoy,0,-7.43089,-7.17,-2.64,-5.579273341897717
C[NH+](Cc1nc2ccccc2c(=O)[nH]1)[C@@H](C(=O)NC(N)=O)c1ccccc1,C06553364_decoy,TRY1,Decoy,0,-6.91801,-6.59,-3.96,-5.988635403522646
C[C@@H](O)c1ccc(-c2ccc(C[NH2+]CCNC(=O)c3nonc3N)o2)cc1,C07541033_decoy,TRY1,Decoy,0,-7.88943,-6.62,-2.26,-6.570772212578391
NS(=O)(=O)c1ccc(CC[NH2+]Cc2nc3ccsc3c(=O)[nH]2)cc1,C08134271_decoy,TRY1,Decoy,0,-9.24686,-7.06,-0.81,-5.574255035284008
C[C@H]([NH2+]C[C@@H](O)COc1ccc(C#N)cc1)c1ccc(S(N)(=O)=O)cc1,C09512764_decoy,TRY1,Decoy,0,-9.27057,-5.95,-2.95,-6.372254125259434
COc1cc(C[NH2+]CCOCCO)cc(Br)c1OCC(N)=O,C10435692_decoy,TRY1,Decoy,0,-7.77564,-5.17,-4.97,-6.9051224285153765
NC(=O)c1c(NC(=O)C[NH+]2CCC(C(N)=O)CC2)sc2c1CCCC2,C12804110_decoy,TRY1,Decoy,0,-10.6947,-5.91,-0.99,-6.3201664755724
NC(=O)c1c(NC(=O)C(=O)NCC[NH+]2CCCCC2)sc2c1CCC2,C13629169_decoy,TRY1,Decoy,0,-8.95831,-6.83,-2.62,-5.992593197573843
NC(=O)C1CC[NH+](CCC(=O)NN2C(=O)NC3(CCCCC3)C2=O)CC1,C24879720_decoy,TRY1,Decoy,0,-7.78993,-6.13,-1.32,-5.624075068471908
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCC(NC(=O)C2CC2)CC1,C30283931_decoy,TRY1,Decoy,0,-7.24498,-6.66,-0.31,-7.852816250317312
C[C@@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCC(NC(=O)C2CC2)CC1,C30283934_decoy,TRY1,Decoy,0,-7.78123,-6.4,-0.39,-9.58573683118113
NC(=O)C[NH+]1CCC(NC(=O)NCc2ccccc2OC(F)(F)F)CC1,C32802717_decoy,TRY1,Decoy,0,-8.34175,-7.01,-2.76,-6.750132820411693
Cn1cccc1C[NH2+][C@H]1[C@H](O)[C@@H]([NH+]2CCC(C([NH-])=O)CC2)[C@@H]2OC[C@H]1O2,C20463893_decoy,TRY1,Decoy,0,-6.9604,-6.87,-1.6,-5.133076306073285
CC(C)NC(=O)C[NH+](C)[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C15028717_decoy,TRY1,Decoy,0,-8.81057,-6.48,-2.98,-6.5987168729623615
C[NH2+][C@@H](C)C(=O)N[C@@H]1C=C(C(=O)N[C@@H](C(=O)OC)C(C)C)C[C@@H](O)[C@@H]1O,C39560953_decoy,TRY1,Decoy,0,-8.01522,-6.19,-1.33,-5.895809266558309
NS(=O)(=O)c1ccc(Cc2cnc(NC(=O)C3=[NH+]CCN3)s2)cc1,C36639382_decoy,TRY1,Decoy,0,-8.99431,-6.21,-2.06,-6.205109618537513
CCOc1c(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)cc1OC,C40744397_decoy,TRY1,Decoy,0,-8.53655,-6.52,-2.25,-6.725493563862676
Cc1occc1C(=O)NNC(=O)c1oc2c(c1C)/C(=N/NC(N)=[NH2+])CCC2,C40824923_decoy,TRY1,Decoy,0,-10.0763,-7.26,-1.37,-8.083577887748568
O=C(C[NH+](CC(=O)NC(=O)NC1CC1)C1CCCC1)NC(=O)NC1CC1,C47550299_decoy,TRY1,Decoy,0,-8.28494,-6.58,-1.27,-6.871508222025263
CC(C)[C@@H](C)[NH+](CC(=O)NC(=O)NC1CC1)CC(=O)NC(=O)NC1CC1,C47550481_decoy,TRY1,Decoy,0,-9.16722,-6.84,-4.65,-9.362016478857967
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1cccs1,C47963804_decoy,TRY1,Decoy,0,-8.33007,-6.02,-2.59,-6.575827989712527
C[NH+](CCCNC(=O)C(=O)Nc1sccc1C(N)=O)Cc1ccccc1,C47966625_decoy,TRY1,Decoy,0,-7.24448,-6.83,-1.01,-5.488767376282064
C=CC[NH+](CC=C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)C(C)C,C48000404_decoy,TRY1,Decoy,0,-8.8405,-6.17,-2.89,-6.523145854296381
NC(=O)CSc1ccccc1NC(=O)C[NH+]1CCC(CC(N)=O)CC1,C48026275_decoy,TRY1,Decoy,0,-7.51123,-6.67,-1.92,-7.197956289738222
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1)c1ccco1,C48732840_decoy,TRY1,Decoy,0,-9.47306,-5.73,-1.34,-7.351453567143059
C[NH+](C)Cc1ccccc1CNC(=O)C(=O)Nc1ccccc1CC(N)=O,C49254367_decoy,TRY1,Decoy,0,-8.49698,-5.8,-3.74,-5.564444617385786
NC(=O)c1ccsc1NC(=O)CC[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51045596_decoy,TRY1,Decoy,0,-8.31743,-6.68,-2.55,-7.705527103773156
NC(=O)c1ccsc1NC(=O)CC[NH+]1CCC[C@@H](C(=O)NC2CC2)C1,C51045597_decoy,TRY1,Decoy,0,-8.83973,-7.02,-0.99,-8.881230577434138
CC(C)[NH+](C)CCNS(=O)(=O)c1cc(Br)cnc1NN,C54108902_decoy,TRY1,Decoy,0,-7.56194,-5.79,-3.04,-5.625697077865143
NNc1ncc(Br)cc1S(=O)(=O)NCC[NH+]1CCCC1,C54108910_decoy,TRY1,Decoy,0,-7.2813,-5.91,-1.56,-6.224376702686649
NC(=O)c1ccsc1NC(=O)CC[NH+]1CCC(C(=O)NC2CC2)CC1,C55913677_decoy,TRY1,Decoy,0,-9.32298,-7.19,-3.22,-7.705504750060894
C[C@@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCC(C(=O)NC2CC2)CC1,C55914012_decoy,TRY1,Decoy,0,-7.59926,-6.07,-1.27,-9.216381500870764
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCC(C(=O)NC2CC2)CC1,C55914013_decoy,TRY1,Decoy,0,-6.89237,-6.6,0.32,-7.048348289297659
O=C(C[NH2+]CCCO)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-],C58866905_decoy,TRY1,Decoy,0,-5.46774,-6.02,-3.37,-4.509783461297551
C[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)CC(=O)NC1CC1,C61002019_decoy,TRY1,Decoy,0,-9.72278,-6.51,-1.06,-6.575466592030552
C[NH+](CCNS(=O)(=O)c1cc(Br)cnc1NN)C1CC1,C62010801_decoy,TRY1,Decoy,0,-8.00218,-5.79,-3.28,-5.564547244127103
Cc1cc(=O)[nH]c(NCCN2CN[C@H](c3ccccc3)[C@@H]2c2[nH]cc[nH+]2)n1,C65409737_decoy,TRY1,Decoy,0,-7.26261,-7.64,-2.44,-7.428792921526592
Cc1cc(=O)[nH]c(NCCN2CN[C@@H](c3ccccc3)[C@@H]2c2[nH]cc[nH+]2)n1,C65409739_decoy,TRY1,Decoy,0,-7.3908,-5.3,-3.08,-4.371101752717391
CCCCOc1c(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)cccc1OC,C66115425_decoy,TRY1,Decoy,0,-7.00922,-4.35,-0.94,-5.043831216118209
CCCCOc1c(C[NH+]2CCNC(=O)[C@H]2CC(=O)NN)cccc1OC,C66115426_decoy,TRY1,Decoy,0,-7.67986,-4.75,-1.72,-5.479761789732571
Cc1nn(CCO)c(C)c1C[NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1,C67189103_decoy,TRY1,Decoy,0,-7.11533,-4.99,-2.27,-3.9151522874299394
CC1CC[NH+](C[C@H](O)CNC(=O)NCCNC(=O)CC2CCCC2)CC1,C67640164_decoy,TRY1,Decoy,0,-8.69919,-6.03,-3.49,-5.655661203238124
COc1cc2nc(N3CC[NH+](C)CC3)nc(NNC(N)=O)c2cc1OC,C04619002_decoy,TRY1,Decoy,0,-8.55298,-6.18,-1.71,-6.128681839946703
C[C@@H]1CCc2cc(F)cc3c(=O)c(C(=O)NCC[NH2+]CCO)c(O)n1c23,C06007684_decoy,TRY1,Decoy,0,-8.14419,-7.18,-1.53,-7.070323410021524
C[C@H]1CCc2cc(F)cc3c(=O)c(C(=O)NCC[NH2+]CCO)c(O)n1c23,C06008083_decoy,TRY1,Decoy,0,-8.05315,-7.61,-1.3,-6.848824357237531
NC(=O)c1c(NC(=O)NCC[NH+]2CCOCC2)sc2c1CCCC2,C06758186_decoy,TRY1,Decoy,0,-9.7449,-5.31,-1.32,-6.375258060951693
NC(=O)c1ccsc1NC(=O)C[NH+]1CCN(c2ccc(O)cc2)CC1,C07987159_decoy,TRY1,Decoy,0,-8.71977,-6.78,-0.65,-5.797866004494623
COc1ccccc1/N=c1/nc(C[NH+]2CCC(C(N)=O)CC2)nc(N)[nH]1,C09334732_decoy,TRY1,Decoy,0,-7.48218,-6.0,-0.74,-5.081423942550533
COCCCN1C[C@H]([NH3+])c2cc(S(N)(=O)=O)sc2S1(=O)=O,C13558687_decoy,TRY1,Decoy,0,-9.54877,-4.19,-0.49,-4.73553377024788
C[C@@]12CN3C[C@@](c4ccccc4)(C[NH+](C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)CO)C2=O,C19327388_decoy,TRY1,Decoy,0,-7.82846,-5.72,-1.38,-5.665220479589735
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@@H]3[C@@H](O)[C@H](O)[C@@H](O)CO)C2=O,C19331345_decoy,TRY1,Decoy,0,-8.55626,-6.03,-1.02,-6.728779375302998
[NH3+][C@@H](CCC(=O)[O-])C(=O)/[NH+]=c1/ccc2c(C(F)(F)F)cc(O)oc-2c1,C35051110_decoy,TRY1,Decoy,0,-8.1277,-5.45,-2.73,-4.703878442730335
CNC(=O)NC(=O)[C@H](C)Oc1c(Br)cc(C[NH3+])cc1OC,C36814884_decoy,TRY1,Decoy,0,-8.57694,-5.01,-0.87,-7.254675864498068
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO)C2=O,C19323151_decoy,TRY1,Decoy,0,-8.02625,-5.56,-0.98,-6.420504770098187
CCC(=O)N[C@@H]1NN[C@H](CC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)S1,C39775234_decoy,TRY1,Decoy,0,-7.88947,-5.82,-1.11,-5.473029296183068
CCC(=O)N[C@H]1NN[C@H](CC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)S1,C39775236_decoy,TRY1,Decoy,0,-8.73667,-5.71,-3.6,-5.179381491864701
CCC(=O)N[C@H]1NN[C@@H](CC(=O)N/N=C/C2=c3ccccc3=[NH+]C2)S1,C39775240_decoy,TRY1,Decoy,0,-8.13761,-6.83,-4.16,-5.564105168773039
Cc1c(C(=O)N(CC#N)CC#N)oc2c1/C(=N/NC(N)=[NH2+])CC(C)(C)C2,C39855984_decoy,TRY1,Decoy,0,-8.7252,-7.68,-2.16,-6.129411327375518
C[NH+]1CCN(Nc2ncnc(NCc3ccc4c(c3)OCO4)c2N)CC1,C40686071_decoy,TRY1,Decoy,0,-7.75268,-5.97,-2.33,-5.199429839151118
COc1ccccc1C(=O)NNc1ncnc(N2CC[NH+](C)CC2)c1N,C40726347_decoy,TRY1,Decoy,0,-7.38612,-7.09,-2.93,-5.519572959213593
CN(c1ncnc(NNC(=O)c2ccncc2)c1N)C1CC[NH+](C)CC1,C40793855_decoy,TRY1,Decoy,0,-6.91654,-6.9,-1.31,-5.929473196524974
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccccc2CC(N)=O)C1,C41725665_decoy,TRY1,Decoy,0,-8.566,-7.24,-1.43,-12.673044454846336
CC(C)C[C@@H]([NH3+])c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C33871689_decoy,TRY1,Decoy,0,-7.55372,-6.07,-2.88,-5.313253599629376
NC(=O)C[C@@H]([NH3+])c1ccc2oc(C(=O)c3cccc([N+](=O)[O-])c3)cc2c1,C44254733_decoy,TRY1,Decoy,0,-9.03226,-7.91,-2.81,-7.189361568411198
NC(=O)C[C@H]([NH3+])c1ccc2oc(C(=O)c3cccc([N+](=O)[O-])c3)cc2c1,C44254736_decoy,TRY1,Decoy,0,-10.2562,-7.46,-2.24,-8.89000220810401
CC(C)[C@@H](CNC(=O)NNC(=O)C(=O)NC1CC1)[NH+]1CCCCCC1,C45534553_decoy,TRY1,Decoy,0,-8.65627,-4.96,-2.4,-5.692731523705716
CC1CC[NH+]([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)C(C)C)CC1,C46254852_decoy,TRY1,Decoy,0,-8.63875,-5.0,-1.05,-5.5304021332209725
C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)NNC(=O)C(=O)NC2CC2)C1,C46763171_decoy,TRY1,Decoy,0,-6.65593,-6.61,-1.8,-5.593834046623393
CNC(=O)NC(=O)C[NH+](CCC1=CCCCC1)CC(=O)NC(=O)NC,C47613499_decoy,TRY1,Decoy,0,-8.56818,-7.24,-1.43,-9.237561526061558
C[NH+](C)C1(CNC(=O)C(=O)Nc2sccc2C(N)=O)CCCCC1,C47963608_decoy,TRY1,Decoy,0,-8.87692,-5.61,-0.87,-5.693837737171256
C[C@@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2sccc2C(N)=O)C1,C47999237_decoy,TRY1,Decoy,0,-8.09237,-7.23,-1.46,-6.917045080791639
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2sccc2C(N)=O)C1,C47999238_decoy,TRY1,Decoy,0,-8.56593,-7.04,-3.21,-8.000426440466757
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)C(=O)Nc2sccc2C(N)=O)C1,C47999239_decoy,TRY1,Decoy,0,-8.59995,-7.02,-4.38,-8.465493099424089
CC(C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)[NH+]1CCCC1,C48038260_decoy,TRY1,Decoy,0,-9.84574,-5.83,-1.36,-7.473313247403906
Cc1c(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cccc1C(N)=O,C48732863_decoy,TRY1,Decoy,0,-8.40628,-7.25,-2.31,-10.404186901664032
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccco1,C48732869_decoy,TRY1,Decoy,0,-7.66061,-6.45,-3.32,-6.9233745793003285
Cn1c(=O)n(C)c2cc([C@H]([NH3+])COCC(N)=O)c(Br)cc21,C51952074_decoy,TRY1,Decoy,0,-7.31807,-5.89,-1.75,-6.039237462915071
Cn1c(=O)n(C)c2cc([C@@H]([NH3+])COCC(N)=O)c(Br)cc21,C51952075_decoy,TRY1,Decoy,0,-6.87307,-4.18,-1.19,-3.903741139505498
C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)NNC(=O)C(=O)NC2CC2)C1,C54726357_decoy,TRY1,Decoy,0,-7.62291,-6.15,-2.75,-5.718486177366122
C[NH+]1CCN(Cc2ccc(-c3nc(=O)cc(CN)[nH]3)cc2)C[C@@H]1CCO,C23379552_decoy,TRY1,Decoy,0,-7.57079,-6.47,-2.0,-6.70778799789975
NC(=O)CN(CC(N)=O)c1c(N)c[nH+]c2ccc(Br)cc12,C61807658_decoy,TRY1,Decoy,0,-8.03457,-5.25,-2.27,-5.011386294898537
NC1=C2C(=N[C@H](NCCCO)C3=C2CCN(Cc2ccccc2)C3)N=[NH+]1,C38574171_decoy,TRY1,Decoy,0,-9.41446,-8.01,0.01,-11.699130637219891
Cc1[nH]c2ccc(C(=O)NNC(=O)NCCCn3cc[nH+]c3)cc2c1C,C64886898_decoy,TRY1,Decoy,0,-7.92919,-6.31,-2.24,-5.130261635869141
NC(=O)[C@H]1CCC[NH+](CCNc2ncnc3sc4c(c23)CCNC4)C1,C65535841_decoy,TRY1,Decoy,0,-9.68662,-5.34,-1.61,-9.112070155983409
NC(=O)[C@@H]1CCC[NH+](CCNc2ncnc3sc4c(c23)CCNC4)C1,C65535844_decoy,TRY1,Decoy,0,-8.27691,-6.8,-2.94,-7.107726452174532
CC[C@@H](C)[NH+](C)CCNC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12,C66203501_decoy,TRY1,Decoy,0,-7.26102,-5.52,-2.67,-4.825836326114942
CC(C)[C@@H](C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)[NH+]1CCCC1,C67289865_decoy,TRY1,Decoy,0,-8.86457,-4.71,-3.45,-5.645888542682412
CC(C)[C@H](C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)[NH+]1CCCC1,C67289867_decoy,TRY1,Decoy,0,-8.88887,-4.53,-3.78,-5.427421946985997
C[C@@H]1CCC[NH+](C[C@@H](C)NC(=O)C(=O)Nc2sccc2C(N)=O)C1,C67397813_decoy,TRY1,Decoy,0,-8.8168,-5.45,-1.58,-7.034576204474352
CC(=O)NC[C@H]1CCC[NH+]([C@@H](C)C(=O)Nc2sccc2C(N)=O)C1,C67416060_decoy,TRY1,Decoy,0,-8.71387,-6.6,-2.04,-6.358789142668024
Cc1ccc(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cc1C(N)=O,C67491420_decoy,TRY1,Decoy,0,-8.24748,-5.87,-1.17,-4.929247770368443
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)CC1,C67613818_decoy,TRY1,Decoy,0,-8.52373,-6.66,-2.94,-6.095588298609483
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4CCC[C@@H]4O)ncnc32)[C@H](O)[C@@H]1O,C03794575_decoy,TRY1,Decoy,0,-7.62194,-5.55,-2.03,-4.759842624249443
Cc1ccc([N+](=O)[O-])cc1N[C@H]1O[C@H]([C@H](O)CO)[C@H](O)[C@@H]1O,C00362134_decoy,TRY1,Decoy,0,-5.89592,-6.11,-2.16,-4.772826599745049
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1Nc1ccc(Br)cc1,C03999642_decoy,TRY1,Decoy,0,-6.89491,-5.32,-1.94,-4.979211617988351
OCCNc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C04722773_decoy,TRY1,Decoy,0,-7.06398,-7.27,-2.24,-8.903535936748828
Oc1c([C@H](O)N2CCOCC2)cc([C@H](O)N2CCOCC2)c(O)c1O,C01688120_decoy,TRY1,Decoy,0,-8.98874,-6.12,-2.31,-7.070889124835732
CCOc1ccc(N[C@@]2(CO)OC[C@@H](O)[C@@H](O)[C@H]2O)cc1,C04773148_decoy,TRY1,Decoy,0,-4.53683,-4.39,-1.48,-3.918166519063084
Cc1ccc([N+](=O)[O-])cc1N[C@@H]1O[C@@H]([C@@H](O)CO)[C@@H](O)[C@H]1O,C01199628_decoy,TRY1,Decoy,0,-5.71746,-4.72,-4.5,-4.035004209840555
O=C[C@H](NC(=O)N(CCCl)N=O)[C@H](O)[C@@H](O)[C@H](O)CO,C05113328_decoy,TRY1,Decoy,0,-6.24692,-4.0,-1.65,-4.799839923704445
COC(=O)NC(=O)c1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O,C05807990_decoy,TRY1,Decoy,0,-6.03316,-7.4,-3.19,-6.657176981048922
CCN(CC)c1nc(N)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C06205288_decoy,TRY1,Decoy,0,-5.86896,-5.08,-1.48,-3.893015879464469
C[C@H](O)CNC(=O)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C06755724_decoy,TRY1,Decoy,0,-8.77036,-4.75,-3.02,-6.276506023836763
C[C@@H](O)CNC(=O)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C06755728_decoy,TRY1,Decoy,0,-9.02312,-5.72,-2.94,-5.854711096135463
CCCn1c(N/N=C2\C(=O)N=C(O)N=C2O)nc2c1[C@H](O)NC(=O)N2C,C09110935_decoy,TRY1,Decoy,0,-7.87409,-5.88,-1.18,-5.249836187249707
O=[N+]([O-])c1cccc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c1,C13424772_decoy,TRY1,Decoy,0,-5.66042,-5.49,-1.33,-4.657526519368185
Cc1ccc([N+](=O)[O-])cc1N[C@H]1O[C@@H]([C@@H](O)CO)[C@@H](O)[C@@H]1O,C13476091_decoy,TRY1,Decoy,0,-5.84288,-5.33,-2.52,-4.41460774842232
OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C14451064_decoy,TRY1,Decoy,0,-7.24177,-6.57,-1.58,-7.439397377319024
C=C(C(=O)OC)[C@H]1[C@@H](O)[C@H]2[C@](O)(CO)CC[C@H](O)[C@]2(C)C[C@@H]1O,C14642419_decoy,TRY1,Decoy,0,-7.5418,-5.54,-4.28,-5.125179968125284
C=CCn1c(O)c(/C(C)=N/NC(N)=S)c(=O)[nH]c1=S,C16848333_decoy,TRY1,Decoy,0,-7.98924,-6.59,-0.66,-9.189846841214038
CP(C)(=O)OC[C@@H]1O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@H](O)[C@@H]1O,C21983083_decoy,TRY1,Decoy,0,-6.23886,-8.04,-1.81,-8.212071810725577
CSc1nc(N[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(C=O)c(=O)[nH]1,C17175489_decoy,TRY1,Decoy,0,-6.58154,-5.37,-2.43,-4.720101883895419
C=CCO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21,C34533237_decoy,TRY1,Decoy,0,-5.44621,-6.76,-1.43,-6.937839746836586
NC(=O)CN1CCN(C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C34785772_decoy,TRY1,Decoy,0,-8.58973,-6.35,-1.21,-7.780167284039173
[NH3+][C@H](CSCC(=O)NC(=O)NCc1ccco1)C(=O)[O-],C35082968_decoy,TRY1,Decoy,0,-6.32824,-4.11,-2.18,-4.087497693810494
Nc1cc(S(N)(=O)=O)ccc1N1CCN(CCO)CC1,C35609592_decoy,TRY1,Decoy,0,-7.00085,-4.32,-2.35,-4.082760779063511
CC(=O)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C37246002_decoy,TRY1,Decoy,0,-5.7298,-5.46,-3.01,-4.344353067164367
CC1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](CO)CC[C@H]12,C37538749_decoy,TRY1,Decoy,0,-6.85419,-6.88,-2.89,-5.0064595147269815
NNc1nc2sccn2c1S(=O)(=O)Nc1cn[nH]c1,C37556307_decoy,TRY1,Decoy,0,-6.98269,-7.53,-1.46,-7.958424384881273
NC(=O)CCS(=O)(=O)CCSCC[C@H]([NH3+])C(=O)[O-],C37736325_decoy,TRY1,Decoy,0,-8.37971,-3.88,-3.99,-5.90393648933861
[NH3+][C@@H](CCSCC(=O)NC(=O)NCc1ccco1)C(=O)[O-],C37736397_decoy,TRY1,Decoy,0,-7.18108,-4.81,-4.14,-4.880074659028994
Cc1ccc(N[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]2O)cc1[N+](=O)[O-],C03900054_decoy,TRY1,Decoy,0,-4.14185,-5.07,-2.38,-3.5122560023995093
O=C(CBr)O[C@@H]([C@H](O)[C@H](O)CO)[C@@H](O)CO,C38648015_decoy,TRY1,Decoy,0,-7.35577,-3.72,-2.15,-4.982664486986134
CC1=C[C@@H]([C@H]2NN[C@@H](SCC(=O)Nc3cccc(C)n3)N2N)N=N1,C38752871_decoy,TRY1,Decoy,0,-8.98967,-6.82,-1.56,-6.044186381282483
CC1=C[C@@H]([C@@H]2NN[C@@H](SCC(=O)Nc3cccc(C)n3)N2N)N=N1,C38752877_decoy,TRY1,Decoy,0,-7.55256,-8.2,-1.8,-6.44499357467914
C[C@H](N[C@@H]1N=NC(=O)NC1=O)C(=O)N/N=C/c1ccc(O)cc1O,C38811066_decoy,TRY1,Decoy,0,-7.73084,-8.25,-2.85,-8.257685603898588
C[C@@H](N[C@@H]1N=NC(=O)NC1=O)C(=O)N/N=C/c1ccc(O)cc1O,C38811069_decoy,TRY1,Decoy,0,-7.82634,-9.1,-1.9,-8.632649663706479
Nc1ccc2c(c1)S[C@H](NC(=O)CSc1ncn[nH]1)N2,C39567628_decoy,TRY1,Decoy,0,-7.88554,-7.49,-1.24,-8.867410099791869
CSCC[C@H](NC(N)=O)C(=O)NCCNC(=O)C(C)C,C41599185_decoy,TRY1,Decoy,0,-7.95844,-5.11,-3.49,-7.07633536489497
C[C@@H](Cl)c1ccc(C(=O)N[C@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2O)o1,C41693383_decoy,TRY1,Decoy,0,-6.94885,-5.42,-2.09,-4.47913506768471
CC(C)(CCl)C(=O)N[C@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O,C41719419_decoy,TRY1,Decoy,0,-5.34836,-4.62,-1.59,-4.223488904431622
NNc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1cn[nH]c1,C42356729_decoy,TRY1,Decoy,0,-6.70832,-6.67,-1.47,-6.8252860174662136
CC(=O)N[C@@H]1[C@@H](O[C@@H]2[C@H](O)CCO[C@@H]2CO)O[C@@H](CO)[C@@H](O)[C@@H]1O,C44171494_decoy,TRY1,Decoy,0,-4.80241,-6.22,-2.52,-4.554503889268281
Cc1ncc(CO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C=O)c1O,C44608678_decoy,TRY1,Decoy,0,-6.32197,-5.82,-3.35,-4.405749522605649
CCC(CC)(C(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C)/C(N)=N/O,C44791659_decoy,TRY1,Decoy,0,-6.22915,-5.35,-2.98,-4.451122986877646
Cc1cc(Br)oc1C(=O)NC(C(N)=O)C(N)=O,C45063645_decoy,TRY1,Decoy,0,-7.08671,-6.86,-1.22,-7.956112956558382
Nc1nc(SCC(=O)NCC(=O)NCC(F)(F)F)n[nH]1,C48582374_decoy,TRY1,Decoy,0,-7.30609,-7.21,-0.67,-7.737652057283127
NC(=O)C(NC(=O)CS[C@@H]1CCS(=O)(=O)C1)C(N)=O,C48686969_decoy,TRY1,Decoy,0,-7.44023,-5.97,-2.05,-7.0924438430768575
O=[N+]([O-])c1ccc(O)c(/C=N\[C@@H]2[C@H](O)[C@H](O)[C@H](CO)O[C@@H]2O)c1,C35185488_decoy,TRY1,Decoy,0,-5.68877,-5.03,-0.82,-4.10875650975806
NNc1ccc(S(=O)(=O)NCc2cn[nH]c2)c([N+](=O)[O-])c1,C44410898_decoy,TRY1,Decoy,0,-6.33349,-7.02,-1.26,-11.407449924090873
Nc1cc(S(N)(=O)=O)ccc1Sc1n[nH]c(=O)n1C1CC1,C61593985_decoy,TRY1,Decoy,0,-8.36027,-4.82,-2.14,-4.729600811303063
C[C@@H](O)Cn1c(CO)cc(=O)c(O)c1CN(CCO)CCO,C62384061_decoy,TRY1,Decoy,0,-7.21889,-4.01,-4.22,-5.258075757423407
CO/N=C1\CN(c2[nH+]c3c(cc2F)c(=O)c(C(=O)[O-])cn3C2CC2)C[C@@H]1C[NH3+],C03938480_decoy,TRY1,Decoy,0,-7.90962,-6.61,-2.95,-5.221636319707879
CCOC1(OCC)[NH+]=C(N)[C@@]2(C#N)[C@@H](c3ccc(NC(C)=O)cc3)[C@@]12C#N,C04034674_decoy,TRY1,Decoy,0,-5.77596,-6.51,-1.8,-5.170977373104697
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@@H]1c1cccnc1)c1ccccc1,C04535177_decoy,TRY1,Decoy,0,-8.82357,-5.36,-1.38,-6.705232277641061
CCCn1c(N)c(C(=O)C[NH+](C)Cc2ccc3c(c2)OCO3)c(=O)[nH]c1=O,C07641086_decoy,TRY1,Decoy,0,-6.35405,-5.73,-1.47,-5.211907152876636
NC(=O)C1CCN(C(=O)[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3Cn2cc(CCO)nn2)CC1,C08299700_decoy,TRY1,Decoy,0,-8.42224,-7.28,-1.87,-6.177163501029693
C[C@H]1CN(c2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])C[C@H](C)O1,C09245272_decoy,TRY1,Decoy,0,-6.85823,-6.98,-1.64,-7.745918673133906
C[C@@]1(NC(=S)NCC[NH2+][C@@H]2CCS(=O)(=O)C2)CCS(=O)(=O)C1,C05677677_decoy,TRY1,Decoy,0,-8.86394,-5.57,-2.18,-5.732022141682819
COCCn1c(N)c(C(=O)C[NH+](C)CC(=O)N2CCCC2)c(=O)[nH]c1=O,C13010939_decoy,TRY1,Decoy,0,-6.38644,-5.66,-1.84,-4.4821053722351865
Cc1cc(C)n(CCNC(=O)c2ccc(C[NH+]3CCC[C@@H](O)C3)[nH]c2=O)n1,C14879113_decoy,TRY1,Decoy,0,-7.59623,-7.07,-3.36,-5.362192391705782
CCOC(=O)C1=C(C[NH+]2CCNC(=O)[C@@H]2CC(=O)OC)NC(=O)N[C@@H]1CC,C21576755_decoy,TRY1,Decoy,0,-7.98242,-5.41,-2.66,-5.363487580402709
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1cccnc1,C02520753_decoy,TRY1,Decoy,0,-8.39681,-7.27,-0.8,-7.550413142092653
[N-]=[N+]=[NH+][C@H](CBr)c1cn([C@@H]2C[C@H](O)[C@H](CO)O2)c(=O)[nH]c1=O,C05840916_decoy,TRY1,Decoy,0,-5.89686,-4.53,-2.63,-4.056086651733997
C[NH+]1[C@@H](CCC(=O)NCc2ccco2)CNC(=O)[C@@H]2[C@H]1CCN2Cc1ncc[nH]1,C22922583_decoy,TRY1,Decoy,0,-8.23848,-5.66,-1.71,-5.832782288166492
CC[NH+]1CCN(CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC)CC1,C23095789_decoy,TRY1,Decoy,0,-8.75468,-6.61,-1.49,-8.464910427056779
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2cccnc2)nnn1-c1nonc1N,C01821349_decoy,TRY1,Decoy,0,-7.59361,-7.07,-3.82,-7.726525209933759
CC[NH2+][C@H]1CN(CCCOC)S(=O)(=O)c2sc(S(N)(=O)=O)cc21,C03953037_decoy,TRY1,Decoy,0,-8.55468,-6.3,-1.8,-7.052068156585732
Cc1csc(NC(=O)CSc2[nH]c(=O)cc(N)[n+]2-c2ccc(F)cc2)n1,C37868928_decoy,TRY1,Decoy,0,-8.57463,-7.68,-3.72,-6.600532986380268
CC[NH2+][C@@H]1CN(CCCOC)S(=O)(=O)c2sc(S(N)(=O)=O)cc21,C01530900_decoy,TRY1,Decoy,0,-10.2635,-4.89,-1.51,-6.373105820576891
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601537_decoy,TRY1,Decoy,0,-8.23514,-4.79,-3.44,-6.085953190627216
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601895_decoy,TRY1,Decoy,0,-7.95697,-6.12,-3.95,-5.752300143810589
Cc1cc(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)nn1C,C39602029_decoy,TRY1,Decoy,0,-8.17835,-4.7,-0.91,-5.259564815868553
CC1(C)O[C@H]2[C@@H](O1)[C@@H](CNC(=O)CCCCC[NH3+])O[C@@H]1OC(C)(C)O[C@@H]12,C39934136_decoy,TRY1,Decoy,0,-8.42493,-5.64,-1.4,-6.225443251029643
C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCCO2)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C46170949_decoy,TRY1,Decoy,0,-7.86207,-7.8,-3.03,-7.00619585262891
Cc1csc(NC(=O)C2CC[NH+](CC(=O)NC(=O)NC3CC3)CC2)n1,C47264069_decoy,TRY1,Decoy,0,-8.46195,-5.93,-4.16,-5.459316516250802
CC(=O)NCCNC(=O)C(=O)Nc1cc(Cl)ccc1N1CC[NH+](C)CC1,C48736721_decoy,TRY1,Decoy,0,-7.96329,-6.1,-1.12,-5.57081456653038
C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccco1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C49974362_decoy,TRY1,Decoy,0,-6.97234,-7.47,-1.74,-5.58224989973313
C=CCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(NC(=O)c2scnc2C)CC1,C51099531_decoy,TRY1,Decoy,0,-8.19104,-6.89,-1.41,-5.39361655870791
CCOCCCNC(=O)C1CC[NH+]([C@@H](C)C(=O)NC(=O)NCCOC)CC1,C51738431_decoy,TRY1,Decoy,0,-8.08528,-4.21,-2.88,-5.144650545239096
C[C@H]1CCC[C@@](CNC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)([NH+](C)C)C1,C52588306_decoy,TRY1,Decoy,0,-7.84042,-5.26,-3.44,-5.292197281138257
C[C@@H]1CCC[C@](CNC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)([NH+](C)C)C1,C52588308_decoy,TRY1,Decoy,0,-8.34296,-4.56,-2.09,-4.9730686246707405
COCCn1c(N)c(C(=O)C[NH+](C)[C@H](C)c2ccc(C)cc2)c(=O)[nH]c1=O,C52907669_decoy,TRY1,Decoy,0,-7.36946,-6.43,-2.72,-6.337707632422456
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1,C56946414_decoy,TRY1,Decoy,0,-8.08583,-6.53,-2.09,-5.662800519394188
C[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C[NH+]1CCCCC1,C57043205_decoy,TRY1,Decoy,0,-8.4834,-6.68,-1.35,-5.745060796034011
CC(C)[NH+](CCNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1)C(C)C,C12141349_decoy,TRY1,Decoy,0,-7.53191,-5.66,-2.87,-4.8530260417809306
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCCn1cc[nH+]c1,C60408093_decoy,TRY1,Decoy,0,-7.83715,-6.5,-2.49,-6.568521839096476
CN(C)c1[nH+]cccc1CNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2,C62111411_decoy,TRY1,Decoy,0,-8.474,-7.83,-1.47,-5.970180594356128
CCOc1ccc(NC(=O)C(=O)NC2CC[NH+](CC(=O)NC)CC2)c(C)c1,C52681498_decoy,TRY1,Decoy,0,-8.99239,-6.2,-4.07,-6.018239264802355
NC(=O)CS[C@@H]1Nc2nccnc2C(=O)N1CCC1=c2ccccc2=[NH+]C1,C63541304_decoy,TRY1,Decoy,0,-7.52958,-7.75,-2.75,-7.245058075462581
O=C1NC(=O)N(CCC2=CCCCC2)C(=O)/C1=C/NCCN1CC[NH2+]CC1,C22808810_decoy,TRY1,Decoy,0,-8.65975,-7.19,-0.77,-5.92145471760935
C[NH+](C)CCNS(=O)(=O)C1=CN=C([C@H]2NN[C@@H](c3ccc(F)cc3)O2)C1,C64492116_decoy,TRY1,Decoy,0,-7.48314,-6.17,-2.67,-5.333453567589219
Cc1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)cnn1-c1ccc(F)cc1,C64886159_decoy,TRY1,Decoy,0,-7.0289,-7.66,-1.76,-5.290626696339704
CSc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)c1,C64886504_decoy,TRY1,Decoy,0,-6.59185,-6.12,-5.45,-5.553842902474294
C[C@H](C(=O)NC(=O)NC[C@@H]1CCCO1)[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51044816_decoy,TRY1,Decoy,0,-7.54431,-5.58,-2.47,-4.950813418261193
CC[C@H](C)[NH+](C)CCNC(=O)NNC(=O)c1ccc(S(C)(=O)=O)cc1,C66196940_decoy,TRY1,Decoy,0,-7.93667,-5.16,-1.39,-5.675288058781827
CC(C)[C@H]1C(=O)NCC[NH+]1CCC(=O)NN1C(=O)NC2(CCCCC2)C1=O,C66499876_decoy,TRY1,Decoy,0,-8.86718,-7.19,-2.81,-7.595115750494532
NC(=O)c1ccsc1NC(=O)C[NH+]1CCCC[C@@H]1C(=O)N1CCOCC1,C66893502_decoy,TRY1,Decoy,0,-8.22014,-6.46,0.06,-5.853316955267304
CC(C)[NH+]1CCC(NC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)CC1,C66982353_decoy,TRY1,Decoy,0,-7.66724,-6.51,-1.68,-5.180941519894131
CCC[NH+]1CC[C@H](CNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)C1,C66998192_decoy,TRY1,Decoy,0,-7.89584,-6.02,-2.32,-5.384074069984075
CC[C@H](C)[NH+](C)CCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1F,C67118872_decoy,TRY1,Decoy,0,-9.33729,-6.43,-3.56,-5.849405523287911
C[C@H]1CN(C2CC[NH+](CC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)CC2)CCO1,C67400103_decoy,TRY1,Decoy,0,-7.48759,-7.48,-1.07,-6.571124910775131
OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C04097706_decoy,TRY1,Decoy,0,-9.68871,-8.96,-1.93,-8.109460593768201
OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O,C04097731_decoy,TRY1,Decoy,0,-8.74783,-9.07,-2.21,-7.900840727966518
C=C([NH3+])[C@H](C#N)C(=O)COC(=O)C[C@H](NC(N)=O)c1ccc(Cl)cc1,C06503092_decoy,TRY1,Decoy,0,-8.86638,-6.23,-3.12,-7.86732858376964
CCOC(=O)c1c(NC(=O)C[NH2+]C[C@@H]2CCCO2)sc(C(N)=O)c1C,C06578829_decoy,TRY1,Decoy,0,-10.0171,-5.78,-0.41,-9.697856010219658
C[C@@H](C(=O)Nc1sccc1C(N)=O)[NH+]1CCN(c2ccccc2O)CC1,C08309202_decoy,TRY1,Decoy,0,-7.99215,-7.92,-1.65,-5.55377388233418
[NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09659987_decoy,TRY1,Decoy,0,-7.83973,-6.44,-1.06,-7.726112253907318
OC[C@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,C13551787_decoy,TRY1,Decoy,0,-7.98386,-8.55,-1.79,-7.537032916083819
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@@H]1O,C14757514_decoy,TRY1,Decoy,0,-9.22236,-8.86,-1.42,-8.241562806996342
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NC3CC3)C[NH+]12,C15707430_decoy,TRY1,Decoy,0,-8.75913,-5.46,-1.48,-6.554870144085938
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NC3CC3)C[NH+]12)NC1CC1,C15708334_decoy,TRY1,Decoy,0,-7.47406,-5.08,-1.58,-4.875212827686143
NC(=O)c1ccsc1NC(=O)CN1CC[NH+](CC(=O)NC2CC2)CC1,C22804731_decoy,TRY1,Decoy,0,-8.66235,-6.72,-2.97,-7.015607636901055
NC(=O)C1CC[NH+](CC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)CC1,C23751734_decoy,TRY1,Decoy,0,-8.21489,-7.28,-1.37,-6.31407007222354
Nc1nc(N)nc(C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)n1,C14158244_decoy,TRY1,Decoy,0,-8.8047,-8.51,-0.4,-10.96267925548639
OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@H]1O,C25782753_decoy,TRY1,Decoy,0,-7.98885,-8.4,-1.52,-7.702147660668055
OC[C@@H]1O[C@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O,C34048081_decoy,TRY1,Decoy,0,-9.75199,-8.76,-1.69,-8.493708831240955
CC(C)NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C15028715_decoy,TRY1,Decoy,0,-8.10579,-5.7,-1.81,-6.812214231528438
C=CCNC(=O)C[NH+]1CCN(CC(=O)Nc2sccc2C(N)=O)CC1,C23248541_decoy,TRY1,Decoy,0,-7.21514,-4.91,-2.8,-7.732879247106016
NC(=O)c1c(NC(=O)C[NH+]2CCN(CCO)CC2)sc2c1CCCC2,C40287575_decoy,TRY1,Decoy,0,-9.36602,-6.67,-1.57,-6.417413426283841
Cc1ccc(C(=O)NNc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1,C40784235_decoy,TRY1,Decoy,0,-7.12025,-5.26,-2.45,-4.939878217638405
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OCC[NH3+])c21,C40846005_decoy,TRY1,Decoy,0,-9.29606,-4.97,-2.11,-5.369432404166059
NNc1ncc(Br)cc1S(=O)(=O)N[C@@H]1C[NH+]2CCC1CC2,C41069970_decoy,TRY1,Decoy,0,-7.93154,-6.0,-1.62,-5.536121884813654
Cc1c(NC(=O)C(=O)NCCC[NH+](C)CC(F)(F)F)cccc1C(N)=O,C41922664_decoy,TRY1,Decoy,0,-7.82992,-6.83,-2.42,-6.314029771258656
O=C(NCC[NH+]1CCCCC1)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C42893621_decoy,TRY1,Decoy,0,-7.3549,-6.61,-1.96,-5.843410301535223
O=C(NCC1([NH+]2CCCCC2)CCCCC1)NNC(=O)C(=O)NC1CC1,C43112211_decoy,TRY1,Decoy,0,-8.66391,-4.94,-2.0,-5.38071720371556
O=C(NCC1([NH+]2CCSCC2)CCCC1)NNC(=O)C(=O)NC1CC1,C47009146_decoy,TRY1,Decoy,0,-9.26335,-4.44,-2.73,-5.08560049917255
CCNC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NCC)C1CCC(C)CC1,C47551329_decoy,TRY1,Decoy,0,-7.91174,-6.86,-1.99,-7.391156714321536
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1cccs1,C47963803_decoy,TRY1,Decoy,0,-9.62442,-6.19,-1.9,-8.52724164530871
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)CC(C)C,C47970754_decoy,TRY1,Decoy,0,-8.57733,-6.31,-2.16,-6.102178818354319
CC1CC[NH+]([C@@H](CNC(=O)C(=O)Nc2sccc2C(N)=O)C(C)C)CC1,C47998643_decoy,TRY1,Decoy,0,-9.0451,-7.4,-2.73,-6.470888123333903
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccsc1,C47999013_decoy,TRY1,Decoy,0,-8.40789,-5.88,-3.39,-5.577911201205689
C[NH+](CCCNC(=O)C(=O)Nc1sccc1C(N)=O)CC(F)(F)F,C48001500_decoy,TRY1,Decoy,0,-8.5277,-6.15,-1.79,-6.784898839413067
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(CCC[NH3+])cc21,C49088183_decoy,TRY1,Decoy,0,-11.0955,-5.83,-2.7,-7.428099085323119
C[C@H](CC[NH+](C)C)NS(=O)(=O)c1cc(Br)cnc1NN,C49560658_decoy,TRY1,Decoy,0,-7.60029,-5.57,-4.07,-6.8075349105794
NNc1ncc(Br)cc1S(=O)(=O)N[C@H]1CC[NH+]2CCC[C@H]12,C49570833_decoy,TRY1,Decoy,0,-7.2591,-6.1,-2.38,-5.221571658642539
COc1ccc(N2C(=O)/C(=C/N[C@H]3CCCC[C@@H]3[NH3+])C(=O)NC2=S)cc1,C20329250_decoy,TRY1,Decoy,0,-8.40468,-5.55,-1.3,-4.51004970794711
CCCNC(=O)[C@@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51000900_decoy,TRY1,Decoy,0,-6.72052,-5.4,-3.58,-4.727637404102814
CCCNC(=O)[C@H]1CCC[NH+](CC(=O)c2c(N)n(CC)c(=O)[nH]c2=O)C1,C51000904_decoy,TRY1,Decoy,0,-7.0197,-6.34,-2.01,-7.439891158499046
CCCNC(=O)C[NH+](CCC)CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C53366742_decoy,TRY1,Decoy,0,-7.1047,-5.95,-3.06,-5.383613828021423
O=C(NNC(=O)C(=O)NC1CC1)NC1CC[NH+](CC2CCCCC2)CC1,C62529201_decoy,TRY1,Decoy,0,-7.09871,-5.24,-0.96,-4.864433343669205
C[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)NC(N)=O,C39792405_decoy,TRY1,Decoy,0,-7.28815,-6.82,-1.97,-6.447522867537562
CC(C)Cn1c(N)c(C(=O)C[NH+](CC(N)=O)C2CCCC2)c(=O)[nH]c1=O,C63504349_decoy,TRY1,Decoy,0,-7.51052,-5.78,-2.89,-5.770263532950598
[NH3+][C@@H]1CCCC[C@H]1N/C=C1/C(=O)NC(=O)N(CCc2ccc(F)cc2)C1=O,C20393246_decoy2,TRY1,Decoy,0,-9.84173,-6.85,,-6.582719985127387
CC(C)CC(=O)N[C@H](C(=O)NNC(=O)NCCCn1cc[nH+]c1)C(C)C,C64885859_decoy,TRY1,Decoy,0,-7.71345,-5.08,-1.75,-5.870343819779626
CNC(=O)C[NH+]1CCC(NC(=O)NNC(=O)Cc2ccccc2F)CC1,C66908919_decoy,TRY1,Decoy,0,-7.38268,-6.88,-1.41,-5.992415192040884
C[C@@H]1C[C@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2sccc2C(N)=O)C1,C67438255_decoy,TRY1,Decoy,0,-8.25887,-6.62,-1.66,-5.744914536240597
CC1=C(C(=O)NCCSc2ccccn2)[C@@H](c2[nH]c[nH+]c2C)NC(=O)N1,C67459297_decoy,TRY1,Decoy,0,-8.17541,-4.52,-3.31,-5.50291935103195
COC(=O)[C@H](NC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(OC(F)(F)F)cc2)C1)C(C)C,C04151698_decoy,TRY1,Decoy,0,-8.65626,-4.13,-3.71,-5.107366326763463
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(OC)c1O,C04349701_decoy,TRY1,Decoy,0,-9.2692,-8.67,-3.1,-8.40953246508924
CC(=O)Nc1ccc(Nc2ccc(NCCO)c3c2C(=O)c2c(O)ccc(O)c2C3=O)cc1,C04830678_decoy,TRY1,Decoy,0,-7.5788,-8.09,-0.91,-6.744321534937011
COc1ccc(-c2oc3cc(O)c(OC)c(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05812924_decoy,TRY1,Decoy,0,-8.75662,-6.03,-1.29,-5.800148379996715
O=C1NCCCC[C@H]1[NH2+][C@H]1CC(=O)N(c2ccc(N3C(=O)C[C@@H]([NH2+][C@@H]4CCCCNC4=O)C3=O)cc2)C1=O,C08414398_decoy,TRY1,Decoy,0,-10.2505,-7.29,-1.93,-6.841013796121168
COc1cc(-c2cc(=O)c3c(O)c(OC)c(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3o2)ccc1O,C12419118_decoy,TRY1,Decoy,0,-8.86767,-8.0,-3.78,-7.653970989469832
COc1cc(-c2cc(=O)c3c(O)c(OC)c(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3o2)ccc1O,C12419127_decoy,TRY1,Decoy,0,-8.22232,-7.12,-2.09,-5.958900306071072
COCCNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1,C12467204_decoy,TRY1,Decoy,0,-6.05007,-5.5,-3.08,-4.860406269149652
CC(=O)OC[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O,C13424738_decoy,TRY1,Decoy,0,-7.57943,-8.87,-2.81,-8.031316493713616
CN(C)c1ccc(/C=N/N(C)c2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,C16186357_decoy,TRY1,Decoy,0,-7.95647,-8.5,-2.55,-8.354742479227598
Cc1ccc2nc(NC(=O)/C(=N/NC(=S)NN)C3C(=O)NC(=S)NC3=O)sc2c1,C16957891_decoy,TRY1,Decoy,0,-10.5002,-6.12,-1.31,-7.688817224791776
Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](CO[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C22064092_decoy,TRY1,Decoy,0,-5.01963,-7.77,-3.52,-5.034208662140085
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C22064096_decoy,TRY1,Decoy,0,-5.95869,-7.75,-1.95,-4.903708936155016
Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C22064101_decoy,TRY1,Decoy,0,-6.92398,-8.91,-1.74,-5.784422104668957
Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,C22064104_decoy,TRY1,Decoy,0,-6.20635,-8.5,-5.08,-5.2141211393559015
C[C@@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22064932_decoy,TRY1,Decoy,0,-5.52037,-7.13,-2.42,-4.9529773205481
C[C@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22064936_decoy,TRY1,Decoy,0,-5.61159,-7.55,-2.55,-6.521474805452721
C[C@@H]1O[C@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22064939_decoy,TRY1,Decoy,0,-5.26459,-5.78,-1.45,-4.546171037574388
C[C@H]1O[C@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H](CO)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C22064942_decoy,TRY1,Decoy,0,-5.91102,-5.62,-3.51,-4.52697209780527
O=C(c1ccc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O)[C@H](O)Cc1ccc(O)c(O)c1,C31168395_decoy,TRY1,Decoy,0,-7.89569,-8.35,-2.45,-6.575222876964099
CC(C)C[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCCOCC1,C32239413_decoy,TRY1,Decoy,0,-9.92801,-4.94,-4.33,-5.802601990171668
C[C@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C34902565_decoy,TRY1,Decoy,0,-5.70558,-6.57,-5.35,-5.242339859537474
C[C@@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc([N+](=O)[O-])cc3)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C34902571_decoy,TRY1,Decoy,0,-5.72601,-6.55,-2.93,-4.911986066790926
O=C1NCCCC[C@H]1[NH2+][C@H]1CC(=O)N(c2ccc(N3C(=O)C[C@H]([NH2+][C@@H]4CCCCNC4=O)C3=O)cc2)C1=O,C17166648_decoy,TRY1,Decoy,0,-8.87987,-7.34,-3.45,-6.1140075927581865
Nc1nc(SCc2cc([N+](=O)[O-])ccc2O)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1,C35395381_decoy,TRY1,Decoy,0,-6.5628,-5.96,-2.8,-5.228542039293987
Nc1nc(SCc2cc([N+](=O)[O-])ccc2O)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C35395387_decoy,TRY1,Decoy,0,-7.18109,-7.24,-1.85,-5.9754465996873245
CC(C)[NH2+]C[C@@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)c2ccccc12,C35644608_decoy,TRY1,Decoy,0,-5.57708,-6.79,-2.7,-5.18269236760127
CC(C)=CCc1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O,C35780543_decoy,TRY1,Decoy,0,-9.11177,-5.96,-3.06,-5.899582176812929
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586643_decoy,TRY1,Decoy,0,-6.21157,-5.32,-2.34,-5.923083156554417
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)C(C)(C)C,C36586644_decoy,TRY1,Decoy,0,-5.47308,-5.57,-2.22,-4.993177684168742
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)C(C)(C)C,C36586913_decoy,TRY1,Decoy,0,-5.67606,-5.98,-1.49,-5.130422409830075
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(O)cc2)c1N,C12474117_decoy,TRY1,Decoy,0,-7.5704,-7.89,-1.27,-8.394402791183737
[NH3+][C@@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@H]1C(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C38999181_decoy,TRY1,Decoy,0,-11.4715,-7.72,-1.63,-6.67679825808247
[NH3+][C@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@H]1C(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C38999186_decoy,TRY1,Decoy,0,-9.53565,-8.1,-1.9,-6.400791549851983
[NH3+][C@@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@@H]1C(=O)Nc1nnc(SCc2ccccc2Cl)s1,C39007259_decoy,TRY1,Decoy,0,-9.72984,-8.02,-1.56,-6.12421850490041
CC[C@@H](C)[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCC1,C39988453_decoy,TRY1,Decoy,0,-10.5596,-5.5,-3.26,-6.827365034051823
CC[C@H](C)[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCC1,C39988454_decoy,TRY1,Decoy,0,-9.26888,-5.09,-2.47,-6.105078647003358
CC[C@@H](C)[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCC1,C39988455_decoy,TRY1,Decoy,0,-9.59607,-3.94,-2.47,-5.945004939087728
CC[C@H](C)[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])[C@@H](C)CC)CCOCC1,C39988456_decoy,TRY1,Decoy,0,-7.83872,-5.32,-2.94,-5.699630902683221
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCC1,C39988464_decoy,TRY1,Decoy,0,-9.08164,-5.37,-2.63,-6.031496661680253
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])CC(C)C)CCOCC1,C39988465_decoy,TRY1,Decoy,0,-6.43689,-4.36,-2.42,-5.223248851471615
CC(C)C[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCC1,C39988466_decoy,TRY1,Decoy,0,-8.98981,-4.15,-3.14,-5.560828689149452
O=C(N/N=C(\[C@@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C40151299_decoy,TRY1,Decoy,0,-9.39077,-7.41,-1.96,-6.887905553652772
O=C(N/N=C(\[C@@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@@H](O)[C@H](O)CO)c1ccccc1Cl,C40151331_decoy,TRY1,Decoy,0,-9.84507,-8.1,-2.95,-8.557386030536678
Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1NNC(=O)c1ccc(Cl)cc1Cl,C40784432_decoy,TRY1,Decoy,0,-9.85697,-7.09,-2.5,-6.122745035055362
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1NNC(=O)c1ccc(Cl)cc1Cl,C40784513_decoy,TRY1,Decoy,0,-10.7145,-6.24,-2.39,-7.073639264982649
NC(=O)c1c(Nc2nc(N3CCC(C(N)=O)CC3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301764_decoy,TRY1,Decoy,0,-8.56681,-7.87,-2.69,-6.3511478283695615
OC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O)[C@H](Oc3c[nH]c4cc(Cl)ccc34)O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C43179120_decoy,TRY1,Decoy,0,-5.69266,-6.6,-1.66,-5.418677665590174
CC1=C(CC[C@@H](C)O[C@H]2O[C@@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@H]2O)C(C)(C)CCC1,C49601486_decoy,TRY1,Decoy,0,-6.1248,-8.15,-3.94,-5.449249692843226
CC1=C(C(=O)N/N=C/c2ccc(O)c(O)c2)[C@H](C)C(C(=O)N/N=C/c2ccc(O)c(O)c2)=N1,C63770259_decoy,TRY1,Decoy,0,-9.78933,-8.62,-1.88,-9.608604326263867
CC[NH+]1CCc2c(sc(NC(=O)c3ccc(Br)s3)c2C(N)=O)C1,C04087204_decoy,TRY1,Decoy,0,-9.30159,-6.23,-0.88,-5.715195450938293
COc1cc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(OC)cc1Cl,C04525828_decoy,TRY1,Decoy,0,-8.11762,-6.5,-4.45,-5.772356472157454
CCc1nnc(NC(=O)c2sc3nc4c(cc3c2N)C[NH+](C(C)C)CC4)s1,C04708266_decoy,TRY1,Decoy,0,-8.74164,-5.08,-1.24,-5.35500558176727
Nc1nc(Sc2nc(C[NH+]3CCCCC3)nc3sc4c(c23)CCCC4)n[nH]1,C06502942_decoy,TRY1,Decoy,0,-10.0223,-5.42,-0.78,-5.4065795172565885
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)Cc1ccc(Cl)s1,C08473859_decoy,TRY1,Decoy,0,-11.108,-7.17,-1.66,-8.723596780154688
COc1cc2c(cc1NC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)oc1ccccc12,C09183839_decoy,TRY1,Decoy,0,-8.57501,-7.19,-1.19,-5.59733142878286
Cc1cc(Br)c(NC(=O)C[NH+]2CCCC[C@@H]2C(N)=O)c(Br)c1,C09365481_decoy,TRY1,Decoy,0,-7.66129,-4.95,-1.55,-4.908446837558617
CCC[NH+]1CCc2c(sc(NC(=O)Cc3ccc(Cl)s3)c2C(N)=O)C1,C10061550_decoy,TRY1,Decoy,0,-8.76673,-5.36,-2.25,-5.655823640957363
OC[C@@H](O)Cn1cc(C[NH+]2CCC(O)(c3ccccc3F)CC2)c2ccccc21,C12363548_decoy,TRY1,Decoy,0,-8.973,-5.92,-1.59,-5.993165213228649
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@H]([C@H](C)O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C12885011_decoy,TRY1,Decoy,0,-9.63001,-6.13,-1.14,-6.025734195603776
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)Cc1ccc(Br)cc1,C12994823_decoy,TRY1,Decoy,0,-7.95201,-5.98,-0.77,-5.219877103813492
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@@](O)(C[NH3+])C2,C27318037_decoy,TRY1,Decoy,0,-10.3223,-8.43,-4.57,-6.922876424646025
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(C=Cc4ccccc43)CC1)[C@](O)(C[NH3+])C2,C27319044_decoy,TRY1,Decoy,0,-7.52607,-7.96,-1.49,-6.32596631168795
CC(C)c1cccc(C2=CCN(C(=O)[C@H]3[NH2+]CC4(CC4)C[C@@H]3C(=O)NO)CC2)c1,C29037880_decoy,TRY1,Decoy,0,-8.03307,-6.76,-1.46,-5.8334378674863
COc1cc2cc3c(N)c(C(=O)Nc4nc(C)cs4)sc3[nH+]c2cc1OC,C35313108_decoy,TRY1,Decoy,0,-9.65921,-5.74,-1.35,-6.05966100289184
COc1c(Br)cc(Cl)cc1S(=O)(=O)NC[C@H]([NH3+])CC(C)C,C36299127_decoy,TRY1,Decoy,0,-9.38674,-5.41,-2.23,-5.65515357720018
O=C(c1ccccc1)N1N[C@@H](c2cccnc2)N[C@H]1[NH2+]CC1=CC2=CC=N[C@@H]2C=C1,C38576865_decoy,TRY1,Decoy,0,-7.87567,-8.14,-0.69,-9.67353501421364
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C=C(c2cc(Cl)cc(Cl)c2)NN1,C39007154_decoy,TRY1,Decoy,0,-8.67253,-6.24,-1.62,-5.807715731194053
COCCNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228461_decoy,TRY1,Decoy,0,-7.9652,-5.35,-0.98,-4.824469604744405
Nc1c(Nc2ccc(Cl)c(Cl)c2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40704266_decoy,TRY1,Decoy,0,-8.4142,-5.49,-2.44,-4.433838611290747
Cc1ccc2cccc(Oc3ncnc(Nc4cccc5[nH+]c(C)ccc45)c3N)c2n1,C40752411_decoy,TRY1,Decoy,0,-8.75454,-7.32,-1.49,-6.19269998706709
Nc1c(Nc2ccc(F)c(Cl)c2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40797635_decoy,TRY1,Decoy,0,-8.26501,-7.59,-0.83,-6.239806967211441
CC1(C)C[C@H]2C[C@](C)(C[NH+]2Cc2ccc(C(=O)NC3CCC(O)CC3)c(=O)[nH]2)C1,C14955653_decoy,TRY1,Decoy,0,-8.95287,-6.36,-2.54,-4.920484077295383
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC1CC[NH+](C2CC2)CC1,C45410341_decoy,TRY1,Decoy,0,-8.42911,-5.49,-0.99,-5.941320600917745
COc1ccc2[nH]cc(C3=CC[NH+]([C@@H](C)C(=O)NC(=O)NC(C)(C)C)CC3)c2c1,C47257380_decoy,TRY1,Decoy,0,-7.87662,-5.97,-2.03,-5.590702421675086
[NH2+]=C1/C(=C/c2ccc(O)c(O)c2)C(=O)N=C2SC(CCC3CCCCC3)=NN12,C20461127_decoy,TRY1,Decoy,0,-9.40574,-6.56,-1.46,-5.982290067275108
COc1ccc2[nH]cc(C3=CC[NH+]([C@@H](C)C(=O)NC(=O)NCC(C)C)CC3)c2c1,C53073734_decoy,TRY1,Decoy,0,-8.16895,-7.48,-2.28,-6.759904268008929
Cc1nc2sc([C@@H](c3ccccc3Cl)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04341160_decoy,TRY1,Decoy,0,-7.04834,-5.93,-1.06,-5.497145871783576
Cc1nc2sc([C@H](c3ccccc3Cl)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04341161_decoy,TRY1,Decoy,0,-8.38415,-6.57,-1.29,-6.190179327117585
Cc1nc2sc([C@@H](c3ccc(F)c(F)c3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04341162_decoy,TRY1,Decoy,0,-7.05243,-6.89,-2.2,-5.882449455326663
Cc1nc2sc([C@H](c3ccc(F)c(F)c3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04341164_decoy,TRY1,Decoy,0,-9.46522,-5.56,-2.26,-5.650363223355373
Cc1nc2sc([C@@H](c3ccc(Cl)cc3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04120758_decoy,TRY1,Decoy,0,-8.32598,-5.25,-0.98,-5.214307433986579
Cc1nc2sc([C@H](c3ccc(Cl)cc3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04120759_decoy,TRY1,Decoy,0,-8.10426,-5.34,-2.13,-5.324319274606367
Cc1nc2sc([C@@H](c3cccc(Cl)c3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C04120950_decoy,TRY1,Decoy,0,-8.84378,-5.65,-1.71,-5.465854926773885
CC(C)[C@H](C[NH+](C)C)NS(=O)(=O)c1cc(Cl)cc(N)c1Br,C61882351_decoy,TRY1,Decoy,0,-7.38956,-4.88,-3.36,-4.928086045971032
CNC1=C(C(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2cccs2)[C@H](C)NS1,C63127494_decoy,TRY1,Decoy,0,-7.53845,-7.36,-1.69,-5.653541013496626
CC1=C(C(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)[C@@H](c2c(F)cccc2Cl)NO1,C63160888_decoy,TRY1,Decoy,0,-7.34644,-6.55,-1.86,-5.901956613359585
CC(=O)N[C@H]1Nc2ccc(C(=O)NCCC3=c4cc(F)ccc4=[NH+]C3)cc2S1,C63280976_decoy,TRY1,Decoy,0,-8.44571,-8.16,-1.8,-6.166757198157455
C=C1C=C([O-])N2C(=NC(NCCC3=c4ccccc4=[NH+]C3)=[NH+][C@H]2c2ccccc2)N1,C63315524_decoy,TRY1,Decoy,0,-8.05869,-5.9,-1.33,-4.871883369343602
CCCCN1C(=S)NC(=O)[C@@H]([C@H]2NCCC3=c4cc(OC)ccc4=[NH+][C@@H]32)[C@@H]1O,C63375937_decoy,TRY1,Decoy,0,-7.39848,-5.51,-1.87,-4.708103047481511
O=C(C[C@@H]1CS[C@H](NC(=O)c2ccco2)N1)NCCC1=c2ccccc2=[NH+]C1,C63686726_decoy,TRY1,Decoy,0,-8.75594,-8.08,-2.22,-7.272950396517454
CC[C@@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(C)ccc4=[NH+]C3)C2)S1,C63941229_decoy,TRY1,Decoy,0,-8.12428,-5.84,-1.71,-4.959018753922707
CC[C@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(C)ccc4=[NH+]C3)C2)S1,C63941231_decoy,TRY1,Decoy,0,-8.92083,-6.14,-2.46,-6.369657353329842
C[C@@H]1CCC2=C3C(=O)N=C([C@H](C)S[C@@H]4N[NH+]=C(N)N4C4CC4)N=C3S[C@@H]2C1,C64064888_decoy,TRY1,Decoy,0,-10.0813,-7.57,-1.64,-6.531407933529123
C[C@H]1CCC2=C3C(=O)N=C([C@H](C)S[C@@H]4N[NH+]=C(N)N4C4CC4)N=C3S[C@@H]2C1,C64064890_decoy,TRY1,Decoy,0,-10.878,-5.88,-1.46,-6.796641116836172
C[NH+](C)CCOc1cccc(CNC(=O)NC[C@]2(O)CCCc3ccccc32)c1,C66924865_decoy,TRY1,Decoy,0,-9.27942,-7.78,-2.36,-7.623008651792317
Cc1ccc([C@@H](CNC(=O)C2CCC3(CC2)NC(=O)NC3=O)[NH+]2CCCC2)cc1,C67271501_decoy,TRY1,Decoy,0,-9.5454,-8.18,-0.78,-6.848503204811894
CC(C)CC[NH+]1Cc2cccc(NC(=O)C3CCC4(CC3)NC(=O)NC4=O)c2C1,C67277183_decoy,TRY1,Decoy,0,-8.51154,-0.45,-2.08,-3.729015613813564
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@@H](C)c2ccc(Br)cc2)CC1,C67582594_decoy,TRY1,Decoy,0,-9.78169,-5.82,-1.35,-6.433664717500858
CC1CC[NH+](C[C@@H](O)CNC(=O)N[C@H](C)c2ccc(Br)cc2)CC1,C67582598_decoy,TRY1,Decoy,0,-8.96843,-7.28,-1.16,-8.686524992623065
C[NH+]1CCc2nc3sc(C(=O)Nc4ccc(OC(F)(F)F)cc4)c(N)c3c(-c3cccs3)c2C1,C04403751_decoy,TRY1,Decoy,0,-7.76049,-6.32,-2.05,-5.18333884104301
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCNC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)[C@@]2(C)O,C00709395_decoy,TRY1,Decoy,0,-8.78846,-6.97,-4.06,-7.055747141562295
CCCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C08791422_decoy,TRY1,Decoy,0,-9.19392,-7.59,-1.99,-8.927690008188359
C[C@]12CC[C@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/CCc3ccc(F)cc3)[C@]1(O)CC[C@H]2C1=CC(=O)OC1,C09041374_decoy,TRY1,Decoy,0,-10.3158,-7.32,-1.51,-6.324877734146546
CCCOc1c(Cl)cc(/C=N/NC(=O)c2[nH+]c(Cl)c(Cl)c(N)c2Cl)cc1OCC,C09467360_decoy,TRY1,Decoy,0,-11.6535,-5.2,-4.16,-7.191405784828883
CC[NH+]1CCC[C@@H]1CNC(=O)[C@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccc(C)c(C)c1,C09836190_decoy,TRY1,Decoy,0,-8.52558,-5.1,-1.63,-5.214638805408536
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(CCNC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)[C@]2(C)O,C09969675_decoy,TRY1,Decoy,0,-7.7995,-8.04,-3.36,-5.897985158129485
CCc1cc2c(=O)c(-c3nc(C)cs3)c(N)oc2c([C@H](c2ccccc2)[NH+]2CCCCC2)c1O,C11867331_decoy,TRY1,Decoy,0,-8.36318,-5.65,-2.05,-5.26480000540088
O=C1[C@@H]2[C@H](Cc3ccc(O)cc3)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C12881350_decoy,TRY1,Decoy,0,-8.75906,-7.47,-3.11,-8.437411932202282
Cc1ccc2c(c1)[C@]1([NH2+][C@H](Cc3ccc(O)cc3)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C12881513_decoy,TRY1,Decoy,0,-8.24397,-8.83,-2.96,-7.983754990049643
C=CCNc1nc(NCC=C)nc(N2CCC([NH2+][C@@H]3CC4c5ccccc5C3c3ccccc34)CC2)n1,C13650757_decoy,TRY1,Decoy,0,-10.8286,-8.77,-1.83,-11.819898324785497
CC(C)c1ccc(Nc2nc(N)nc(C[NH+]3CCN(C(c4ccccc4)c4ccccc4)CC3)n2)cc1,C19944396_decoy,TRY1,Decoy,0,-8.47535,-6.26,-4.86,-6.010978036429828
Cc1ccc2c(c1)S(=O)(=O)N=C(C[NH+]1CCC(Nc3ccc4[nH]c(C(C)(C)C)cc4c3)CC1)N2,C24897439_decoy,TRY1,Decoy,0,-8.89408,-8.54,-1.33,-6.339552501039066
Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o/c2=[NH+]\Nc2ccc(Br)cc2)cc1O,C27834606_decoy,TRY1,Decoy,0,-7.90561,-7.78,-2.11,-7.296340661232437
C[NH+](C)CCNC(=O)[C@@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccc(Cl)cc1,C03670442_decoy,TRY1,Decoy,0,-7.91541,-5.01,-1.85,-5.386881185065434
CN(C)c1ccc([C@@H]2NC(SCC(=O)N3c4ccccc4CCc4ccccc43)=NC(N)=[NH+]2)cc1,C39448861_decoy,TRY1,Decoy,0,-10.9041,-6.42,-1.54,-7.1567090976603325
CCOc1ccc([C@H]2NC(SCC(=O)N3c4ccccc4CCc4ccccc43)=NC(N)=[NH+]2)cc1,C39448864_decoy,TRY1,Decoy,0,-11.2075,-8.62,-1.84,-7.291015690719252
O=S(=O)(c1ccccc1)c1cc(-c2ccccc2O)ccc1N1CC[NH2+][C@H](c2ccccc2O)C1,C39530314_decoy,TRY1,Decoy,0,-9.19517,-6.03,-3.15,-6.437398716960306
O=S(=O)(c1ccccc1)c1cc(-c2ccccc2O)ccc1N1CC[NH2+][C@@H](c2ccccc2O)C1,C39530316_decoy,TRY1,Decoy,0,-9.39815,-8.54,-2.03,-8.208823962463859
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39631246_decoy,TRY1,Decoy,0,-9.03416,-5.96,-4.39,-5.697723655727774
Cc1ccc(Oc2ncccc2C(=O)N2C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1,C39631851_decoy,TRY1,Decoy,0,-10.3554,-8.44,-3.41,-10.318439279069326
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1Cl,C39631979_decoy,TRY1,Decoy,0,-9.89965,-5.45,-4.82,-5.750801561452423
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)c1F,C39655435_decoy,TRY1,Decoy,0,-8.03699,-5.79,-1.2,-4.748872713309661
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)c2c1,C39655997_decoy,TRY1,Decoy,0,-10.0773,-8.81,-1.22,-8.039346464666744
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cc(F)ccc4C)CC34CC[NH2+]CC4)c2c1,C39656062_decoy,TRY1,Decoy,0,-7.79459,-7.13,-2.91,-5.964297169136102
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4cc(F)ccc4C)CC34CC[NH2+]CC4)c2c1,C39656065_decoy,TRY1,Decoy,0,-10.2801,-5.93,-1.71,-5.979358323148263
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39656149_decoy,TRY1,Decoy,0,-10.6382,-7.38,-1.27,-7.764248443700006
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39674016_decoy,TRY1,Decoy,0,-9.6304,-9.55,-4.57,-8.225678464061128
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39674054_decoy,TRY1,Decoy,0,-9.74397,-9.7,-1.87,-7.765792755998882
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39674125_decoy,TRY1,Decoy,0,-8.34332,-8.7,-2.22,-6.555604624890861
CC1(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)CCCCC1,C39676435_decoy,TRY1,Decoy,0,-11.0896,-7.13,-1.44,-7.020394380427209
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)c1F,C39676442_decoy,TRY1,Decoy,0,-9.67004,-8.51,-2.59,-7.099537138809771
O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2,C39676498_decoy,TRY1,Decoy,0,-10.868,-8.31,-0.81,-12.615168360213028
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39676501_decoy,TRY1,Decoy,0,-8.30112,-8.12,-1.43,-7.24830210084184
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4cc(Cl)cc(Cl)c4)CC34CC[NH2+]CC4)c[nH]c12,C39684099_decoy,TRY1,Decoy,0,-9.66787,-8.63,-1.12,-7.655225900303705
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)cc1F,C39684135_decoy,TRY1,Decoy,0,-7.53894,-9.16,-2.21,-7.215411450984645
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)c[nH]c12,C39684149_decoy,TRY1,Decoy,0,-10.0368,-9.08,-2.89,-7.671491850114306
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4cc(Cl)ccc4F)CC34CC[NH2+]CC4)c[nH]c12,C39684179_decoy,TRY1,Decoy,0,-8.91999,-9.01,-1.47,-7.627753493498233
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)c(C)c1,C39684220_decoy,TRY1,Decoy,0,-9.72836,-9.02,-1.9,-7.44759457480835
Nc1c(/N=N/c2cccc(/C=C/C3[NH+]=c4ccccc4=[NH+]3)c2)cc(S(=O)(=O)[O-])c2ccccc12,C39738095_decoy,TRY1,Decoy,0,-7.13793,-9.03,-3.65,-5.83505353954376
Cc1ccc2cccc(Nc3ncnc(N4CC[NH+](Cc5ccc6c(c5)OCO6)CC4)c3N)c2n1,C40758740_decoy,TRY1,Decoy,0,-8.89933,-8.37,-3.47,-6.310168156574441
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/Nc1ccc([N+](=O)[O-])cc1)CCC2,C40814805_decoy,TRY1,Decoy,0,-8.38923,-6.58,-1.64,-5.105630079143088
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4csc5ccccc45)CC34CC[NH2+]CC4)c2c1,C44707857_decoy,TRY1,Decoy,0,-9.76529,-6.29,-1.16,-6.530392116138613
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C44714368_decoy,TRY1,Decoy,0,-8.88621,-8.52,-2.87,-7.820316334290813
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)c1F,C44714523_decoy,TRY1,Decoy,0,-8.66524,-8.51,-2.41,-7.670703816663611
COc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C39695718_decoy,TRY1,Decoy,0,-8.29524,-7.38,-2.06,-6.7434647243834895
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(C(F)(F)F)cc4)CC34CC[NH2+]CC4)[nH]c2c1,C44737079_decoy,TRY1,Decoy,0,-7.70586,-9.29,-3.06,-6.418846101649256
Cc1ccc(S(=O)(=O)N/[NH+]=c2\oc3c(O)cc(C(C)(C)C)cc3cc2C(=O)Nc2ccc(F)cc2)cc1,C59170679_decoy,TRY1,Decoy,0,-9.21938,-10.3,-1.68,-9.731209336666048
COc1cccc2cc(C(=O)Nc3ccc(F)cc3)/c(=[NH+]/c3sc4c(c3C(N)=O)CCCC4)oc12,C17130865_decoy2,TRY1,Decoy,0,-11.1759,-8.23,,-10.31406768698944
Cc1ccc(S(=O)(=O)N[C@H]2Nc3c(C)cc(NC(=O)[C@@H]4C=c5ccccc5=[NH+]4)cc3S2)cc1,C64623285_decoy,TRY1,Decoy,0,-8.78201,-8.81,-2.85,-6.223332824782914
CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)ccc1OCC(N)=O,C00814142_decoy,TRY1,Decoy,0,-7.13524,-6.8,-0.82,-7.091475700162389
CCn1cc(NC(=S)Nc2sc3c(c2C(=O)OC)CC[C@@H](C)C3)c(C(N)=O)n1,C02856920_decoy,TRY1,Decoy,0,-8.88227,-6.82,-1.56,-6.687923037255229
COc1ccc(/C=C/C(=O)N[C@H](C)C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1,C08825305_decoy,TRY1,Decoy,0,-9.4355,-8.23,-2.09,-7.651396260328759
NC(=O)c1ccsc1NC(=O)COC(=O)c1ccccc1N/C=C/C(=O)C(F)(F)F,C09127139_decoy,TRY1,Decoy,0,-7.65532,-6.32,-3.74,-6.92798223465061
CCCCn1c(N)c(N(C)C(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)c(=O)[nH]c1=O,C09513142_decoy,TRY1,Decoy,0,-6.25967,-6.14,-1.01,-4.673231023940927
O=C(COC(=O)c1ccccc1NCCO)NCC(=O)Nc1ccc(F)c(F)c1F,C09162901_decoy,TRY1,Decoy,0,-8.79406,-7.75,-3.99,-10.362690670983437
CC(C)Cn1c(N)c(C(=O)CSc2nnc(-c3c[nH]c4ccccc34)o2)c(=O)[nH]c1=O,C09803489_decoy,TRY1,Decoy,0,-7.21672,-8.59,-2.23,-6.298177017240748
O=C(CNC(=O)c1ccco1)NCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1,C10735851_decoy,TRY1,Decoy,0,-9.13233,-6.53,-2.81,-6.8165729919179725
C[C@H](Sc1nnc(-c2ccco2)n1N)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C11671086_decoy,TRY1,Decoy,0,-8.49305,-7.94,-4.1,-7.4694790497849155
CC(C)[C@@H](OC(=O)C[C@@H]1Sc2ccc(C(F)(F)F)cc2NC1=O)C(=O)NC(N)=O,C12426429_decoy,TRY1,Decoy,0,-9.48534,-6.15,-1.01,-6.839808943664452
COc1cc(C(=O)NC(=S)Nc2sc(C)c(C)c2C(N)=O)cc(OC)c1OC,C12497429_decoy,TRY1,Decoy,0,-10.287,-5.75,-3.04,-6.628648633948794
NC(=O)Cn1c(CSc2nnc(Cc3ccccc3F)n2N)nc2ccccc2c1=O,C14074851_decoy,TRY1,Decoy,0,-8.14473,-6.69,-4.38,-6.626018610149637
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CCNC(=O)c2ccco2)c(=O)[nH]c1=O,C14652689_decoy,TRY1,Decoy,0,-8.32907,-7.32,-1.9,-7.745381795731752
C/C(CC(=O)Nc1ccc(I)cc1)=N\NC(=O)C(=O)NCCO,C14922686_decoy,TRY1,Decoy,0,-8.05486,-5.61,-3.28,-5.504417966148232
CN(CCCc1n[nH]c(N)c1C#N)c1ccc(S(=O)(=O)NC(C)(C)C)cc1[N+](=O)[O-],C15113703_decoy,TRY1,Decoy,0,-7.68678,-7.5,-1.68,-6.9865977565948185
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)C[C@@H](NC(N)=O)c2ccc(Cl)cc2)c1C,C15342567_decoy,TRY1,Decoy,0,-9.1677,-7.71,-1.14,-6.577920658210186
CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1,C16320875_decoy,TRY1,Decoy,0,-7.01075,-5.9,-3.34,-5.253448853605598
O=[N+]([O-])c1ccc(N[C@@H]2[C@@H](OCc3ccccc3)O[C@H](CO)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1,C19926186_decoy,TRY1,Decoy,0,-5.06248,-6.41,-2.09,-4.317145861509856
O=C(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1N1CCOCC1)Nc1ccc(OC(F)(F)F)cc1,C20464813_decoy,TRY1,Decoy,0,-7.82941,-7.29,-1.56,-5.522052924706903
Cc1ccc(C)c(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)c1,C20827782_decoy,TRY1,Decoy,0,-8.69875,-8.81,-2.7,-9.190159155639918
O=C(CSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1ccc2c(c1)OCCO2,C20906336_decoy,TRY1,Decoy,0,-9.63744,-9.8,-2.27,-8.146669169945092
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)NCc2ccc3c(c2)OCO3)n1N,C20911499_decoy,TRY1,Decoy,0,-9.90685,-8.68,-3.38,-6.989361734354139
Cc1ccc(F)cc1NC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20920621_decoy,TRY1,Decoy,0,-9.50315,-7.85,-1.77,-9.579248143352512
Cc1cc(F)ccc1NC(=O)CSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20920989_decoy,TRY1,Decoy,0,-9.98017,-8.27,-2.03,-7.767340070003408
Cc1ccccc1NC(=O)CCSc1nnc(N/N=C/c2cnn(C(C)C)c2)n1N,C20921216_decoy,TRY1,Decoy,0,-8.60622,-7.84,-1.58,-6.839457280235801
COc1cccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(C#N)c3)n[nH]2)c1O,C21079819_decoy,TRY1,Decoy,0,-9.32822,-7.26,-3.23,-6.784166000090983
NS(=O)(=O)c1ccc(NCCC(=O)Nc2ccc3c(c2)OC(F)(F)O3)c([N+](=O)[O-])c1,C21709056_decoy,TRY1,Decoy,0,-8.03383,-8.28,-2.15,-6.037982219864087
CCc1[nH]c(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)c(C)c1C(=O)OC,C22312470_decoy,TRY1,Decoy,0,-8.64522,-7.27,-4.05,-7.181290307345591
CCCCn1c(N)c(N(CC)CC(=O)Nc2ccsc2C(=O)OC)c(=O)[nH]c1=O,C24956334_decoy,TRY1,Decoy,0,-6.68836,-6.25,-3.27,-7.569309591539352
CCCn1c(S[C@H](C)c2nc(N)nc(N(C)C)n2)nc2cc(S(N)(=O)=O)ccc21,C25032504_decoy,TRY1,Decoy,0,-9.17056,-7.37,-2.36,-8.55661247803503
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc(O)cc1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C33717655_decoy,TRY1,Decoy,0,-7.81497,-5.58,-3.0,-5.716480109806046
O=[N+]([O-])c1ccc(N[C@H]2[C@H](OCc3ccccc3)O[C@@H](CO)[C@@H](O)[C@H]2O)c([N+](=O)[O-])c1,C35240696_decoy,TRY1,Decoy,0,-6.77007,-6.88,-2.0,-5.343066868143991
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccnc1,C36505715_decoy,TRY1,Decoy,0,-7.65836,-4.78,-1.56,-5.4902068949715295
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccnc1,C36505716_decoy,TRY1,Decoy,0,-7.53626,-5.73,-0.81,-6.43040238808537
NC(=O)Cc1csc(NC(=O)Cc2csc(NC(=O)/C=C/c3ccccc3)n2)n1,C38739515_decoy,TRY1,Decoy,0,-9.76659,-6.95,-2.64,-7.473440150451296
CCc1nc(SCC(=O)N[C@H]2SC(c3ccccc3)=C[C@H]2C(N)=O)[nH]c(=O)c1C#N,C38789700_decoy,TRY1,Decoy,0,-8.77666,-7.53,-1.9,-6.98740957685975
CCOc1cc(C(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c([N+](=O)[O-])cc1OC,C39558904_decoy,TRY1,Decoy,0,-8.00253,-8.08,-2.4,-7.131550751435786
COc1cc(=O)oc(/C=C/C=C/[C@H](O)[C@@H](O)/C(C)=C/[C@@]2(C)O[C@@H](C)[C@@](C)(O)[C@@H]2O)c1C,C39559958_decoy,TRY1,Decoy,0,-9.50137,-7.12,-1.53,-6.49736165917369
CCC[NH+]1[C@@H](SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)NN[C@@H]1c1ccncc1,C39704612_decoy,TRY1,Decoy,0,-8.53477,-7.65,-3.46,-6.46145072277362
Cc1c(C(=O)NCCCN2CCOCC2)oc2c1/C(=N/NC(N)=S)CC(C)(C)C2,C39856079_decoy,TRY1,Decoy,0,-10.0757,-5.77,-3.33,-7.19778771735789
CCOc1ccccc1Cn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)nc2ccccc21,C39915868_decoy,TRY1,Decoy,0,-6.74839,-5.39,-1.9,-5.63149353642987
Cc1ccccc1OCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39915966_decoy,TRY1,Decoy,0,-5.57604,-8.03,-1.24,-5.866333675300375
CCO[C@@H](C1=C[C@@H]2C(c3ccc(O)cc3)=NN(c3ccccc3)[C@H]2N=C1)[C@H](O)[C@@H](O)CO,C40394890_decoy,TRY1,Decoy,0,-10.2973,-7.79,-1.77,-8.90980031696206
COc1cccc(NC(=S)NNC(=S)Nc2cccc(OC)c2OC)c1OC,C59114893_decoy,TRY1,Decoy,0,-8.75843,-4.94,-3.01,-5.722722806039271
Nn1c(N/N=C/c2cccc(Br)c2)nnc1SCC(=O)Nc1nccs1,C20292221_decoy,TRY1,Decoy,0,-10.5392,-8.34,-3.93,-7.921413256201204
NC(=O)CSc1nnc(NC(=O)CSc2nc(-c3cccc([N+](=O)[O-])c3)n[nH]2)s1,C59788745_decoy,TRY1,Decoy,0,-8.42586,-7.29,-0.85,-6.658606704902172
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(F)cc3)n2)cc1,C59814193_decoy,TRY1,Decoy,0,-9.12993,-9.53,-3.78,-8.597477860834827
C=CCn1nc(C)c(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3C)n2N)c1C,C59829830_decoy,TRY1,Decoy,0,-9.14722,-8.13,-3.03,-7.367068942310226
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3SC)n2N)cn1,C59830172_decoy,TRY1,Decoy,0,-9.27107,-7.2,-4.26,-6.753696666128481
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)O[C@H](C)C(=O)NC(N)=O,C60385196_decoy,TRY1,Decoy,0,-8.42757,-6.58,-2.12,-6.720292858399848
COc1ccc(N2C(=O)[C@@H]3[C@H]([C@@H](C)O)[NH2+][C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C04083625_decoy,TRY1,Decoy,0,-7.68056,-6.73,-1.82,-5.841502478900443
CCNc1nc(SCC(=O)NC(=O)NC)nc2sc3c(c12)CC[NH+](C)C3,C04335569_decoy,TRY1,Decoy,0,-7.74242,-6.14,-1.49,-6.053262961325038
CC[C@@H](C)N1C(=O)[C@@H]2[C@@H]([C@@H](C)O)[NH2+][C@]3(C(=O)Nc4c(Cl)cc(C)cc43)[C@@H]2C1=O,C05345653_decoy,TRY1,Decoy,0,-7.82571,-6.56,-1.94,-5.422407918039601
CC[C@H](C)N1C(=O)[C@@H]2[C@@H]([C@@H](C)O)[NH2+][C@]3(C(=O)Nc4c(Cl)cc(C)cc43)[C@@H]2C1=O,C05345654_decoy,TRY1,Decoy,0,-7.58598,-6.3,-1.56,-5.187153013081683
O=C1C[C@@H](c2ccccc2)[NH2+]CCCCN2C[C@@H](CN1)[C@@H]([C@H](O)c1ccccc1)C2=O,C05662666_decoy,TRY1,Decoy,0,-7.97064,-5.2,-2.84,-5.38682033885458
CC[C@@H](C)N1C(=O)[C@H]2[C@@H]([C@@H](C)O)[NH2+][C@@]3(C(=O)Nc4c(Cl)cc(C)cc43)[C@@H]2C1=O,C09042769_decoy,TRY1,Decoy,0,-8.43094,-5.43,-0.84,-5.213697271351065
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)c2n[nH]c3c2CCc2ccccc2-3)CC1,C09728146_decoy,TRY1,Decoy,0,-8.72735,-6.04,-3.54,-5.223215994373383
Cn1cc([C@@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(O)ccc2O3)c2ccccc21,C12329159_decoy,TRY1,Decoy,0,-8.77724,-5.69,-3.69,-4.764205585344828
Cn1cc([C@@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(O)ccc2O3)c2ccccc21,C12329165_decoy,TRY1,Decoy,0,-9.42919,-6.65,-2.0,-4.976040817650652
Cn1cc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(O)ccc2O3)c2ccccc21,C12329167_decoy,TRY1,Decoy,0,-9.16623,-6.54,-2.7,-5.207555700583353
Oc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@H](O)c3ccc4c(c3)OCCO4)CC1)O2,C12329350_decoy,TRY1,Decoy,0,-9.72285,-6.18,-2.33,-5.3972798214854025
Oc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@@H](O)c3ccc4c(c3)OCCO4)CC1)O2,C12329354_decoy,TRY1,Decoy,0,-9.7412,-6.51,-1.71,-5.514312471890589
Oc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@H](O)c3ccc4c(c3)OCCO4)CC1)O2,C12329360_decoy,TRY1,Decoy,0,-9.82638,-6.13,-2.42,-4.843735570284531
Oc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@@H](O)c3ccc4c(c3)OCCO4)CC1)O2,C12329363_decoy,TRY1,Decoy,0,-8.48183,-6.19,-0.95,-4.754583076354391
O=C(NO)[C@H]1CC2(CC2)C[NH2+][C@@H]1C(=O)N1CC=C(c2cccc(C3CC3)c2)CC1,C29037882_decoy,TRY1,Decoy,0,-7.76479,-5.84,-2.6,-5.143730294569403
Cc1cc(C2=CCN(C(=O)[C@H]3[NH2+]CC4(CC4)C[C@@H]3C(=O)NO)CC2)cc(C)c1C#N,C29037898_decoy,TRY1,Decoy,0,-9.25635,-8.77,-2.31,-6.599790847682362
Cc1cc(C)cc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)NCCc2[nH+]c[nH]c23)c1,C24986896_decoy1,TRY1,Decoy,0,-9.06679,-5.73,,-5.128322949908797
Cc1cc(C)cc(C(=O)NCCC(=O)N2CCC3(CC2)[NH2+]CCc2nc[nH]c23)c1,C08771965_decoy,TRY1,Decoy,0,-9.29366,-6.79,-1.51,-6.252843677326293
Cn1c([C@H]2Oc3nc(-c4ccccc4)cc(-c4ccccc4)c3[C@H]2[NH3+])n[nH]c1=S,C39290053_decoy,TRY1,Decoy,0,-7.22327,-7.93,-1.82,-6.359612703543716
Cc1cc(=O)c(C(=O)N2CCC(N3C[C@H](c4cccc(Cl)c4)N[NH2+]3)CC2)c[nH]1,C39478812_decoy,TRY1,Decoy,0,-8.44199,-5.76,-1.02,-4.950946776257537
CCC(=O)N1C[C@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1,C39684121_decoy,TRY1,Decoy,0,-8.49012,-6.43,-2.34,-5.191823491435219
C[C@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)S[C@@H]1NN=C(SCC(N)=O)S1,C39733843_decoy,TRY1,Decoy,0,-7.98031,-5.57,-2.13,-5.199874917212466
C[C@H](S[C@@H]1NN=C(SCC(N)=O)S1)C(=O)C1=c2ccccc2=[NH+][C@@H]1C,C39733845_decoy,TRY1,Decoy,0,-8.0489,-7.23,-2.45,-6.748051023564884
Cc1ccsc1C[NH+](C)[C@@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1,C42474044_decoy,TRY1,Decoy,0,-8.1353,-6.7,-5.36,-2.32454492914666
CC1CCN(C(=O)C[C@@H]2[C@H](O)CC[C@H]3[C@]2(C)CC[C@H]2O[C@H](C[NH3+])OC[C@@]32C)CC1,C43554105_decoy,TRY1,Decoy,0,-9.26505,-6.35,-2.11,-5.6201897402445615
C[C@]1(NNC(=O)NCc2ccccc2C[NH+]2CCCCC2)CCS(=O)(=O)C1,C45193070_decoy,TRY1,Decoy,0,-7.80834,-7.37,-0.88,-6.765023590691327
Cc1n[nH]c2cnc(-c3cncc(OC[C@@H]([NH3+])Cc4c(F)cccc4F)c3)cc12,C45287908_decoy,TRY1,Decoy,0,-10.5659,-5.85,-2.67,-6.096572608811513
CC[C@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)[NH+]1CCc2ccccc2C1,C46310683_decoy,TRY1,Decoy,0,-8.74389,-7.2,-4.55,-5.979697744557466
Cn1cc(/C=C2\Oc3cccc(O)c3C2=O)c2c(N3CCC(C[NH3+])CC3)ccnc21,C49111646_decoy,TRY1,Decoy,0,-7.66371,-7.33,-2.84,-5.086893892309066
CC[NH+]1CCN(c2ccc(Cl)cc2NC(=O)N2CCO[C@@H](C(N)=O)C2)CC1,C51585524_decoy,TRY1,Decoy,0,-8.05645,-6.45,-1.26,-5.431757428109509
C#Cc1cccc(NC(=O)CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)c1,C59855102_decoy,TRY1,Decoy,0,-9.88769,-7.08,-2.29,-6.466715653396726
C[NH+]1CCN(C(=O)Nc2ccc(F)cc2C(=O)Nc2ccc3[nH]ccc3c2)CC1,C61718239_decoy,TRY1,Decoy,0,-6.80234,-6.1,-2.7,-4.264966278814035
CCOc1ccccc1C(=O)NCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C20588926_decoy,TRY1,Decoy,0,-8.86059,-7.85,-1.71,-6.7896254197494725
O=C(NCCC(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12)c1ccc(Cl)cc1,C20622198_decoy,TRY1,Decoy,0,-9.46476,-8.14,-1.21,-7.651314059273069
NC(=O)C1CCN(C(=O)CCNC(=O)N2CCC3=c4ccccc4=[NH+][C@H]3C2)CC1,C63271479_decoy,TRY1,Decoy,0,-8.32725,-6.36,-0.86,-5.81218011399058
COc1ccc2c(c1)=[NH+][C@H](C(=O)NCCC(=O)N[C@@H]1Nc3ccccc3S1)C=2,C63295817_decoy,TRY1,Decoy,0,-8.42379,-8.24,-1.74,-9.398148962788945
O=c1c([C@H]2[NH2+]CCC3=c4ccccc4=[NH+][C@@H]32)c([O-])[nH]c(=S)n1Cc1ccc(F)cc1,C63362903_decoy,TRY1,Decoy,0,-6.07538,-7.52,-1.75,-4.471346572291323
CC1=CC(=O)N2[C@H](N1)NC(NCCC1=c3ccccc3=[NH+]C1)=N[C@@H]2c1cccnc1,C63633436_decoy,TRY1,Decoy,0,-8.74162,-7.93,-1.2,-7.49013047565584
O=C1[C@H]([C@@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@H](S)N1Cc1ccc(F)cc1,C63896911_decoy,TRY1,Decoy,0,-7.81283,-6.12,-1.31,-5.0173084282294
O=C1[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)[C@H](O)N[C@H](S)N1Cc1ccc(F)cc1,C63896913_decoy,TRY1,Decoy,0,-8.1147,-6.68,-1.74,-4.893819023219456
COc1ccccc1N1C(=O)[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@H]1O,C63985100_decoy,TRY1,Decoy,0,-7.31694,-8.9,-0.99,-8.025664487972355
COc1ccccc1N1C(=O)[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@H]1O,C63985102_decoy,TRY1,Decoy,0,-7.58919,-6.84,-0.19,-8.036727452471947
COc1ccccc1N1C(=O)[C@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@@H]1O,C63985103_decoy,TRY1,Decoy,0,-7.16596,-8.01,-1.66,-5.251797503388308
C[C@H](c1ccccc1)N1C(=O)[C@@H]([C@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)C(O)=N[C@@H]1O,C64197308_decoy,TRY1,Decoy,0,-7.43471,-8.81,-2.04,-7.418384420952968
Cc1ccc([C@@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)[NH+]2CCCC2)cc1,C64237080_decoy,TRY1,Decoy,0,-8.23169,-6.25,-2.29,-5.577645122631305
Cc1cc(C)cc(C(=O)N[C@H](C)C(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)c1,C24986896_decoy2,TRY1,Decoy,0,-9.46098,-5.76,,-5.189550827023583
Cc1ccc2c(c1)NC(=O)[C@H]1C(C(=O)NCC[NH+]3CCc4ccccc4C3)=NNN21,C65238285_decoy,TRY1,Decoy,0,-7.07538,-8.28,-1.0,-5.9367907750209294
Cc1cc(C)c(NC(=O)CNC(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c(C)c1,C54041276_decoy,TRY1,Decoy,0,-7.40949,-7.09,-2.06,-6.49976359029117
C[C@@H]1CCC[NH+](Cc2cs/c(=N\S(=O)(=O)c3cc(C(N)=O)n(C)c3)[nH]2)C1,C66249369_decoy,TRY1,Decoy,0,-8.21871,-5.39,-0.82,-4.94510591317618
CC1CC[NH+](C[C@@H](O)CNC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)CC1,C67546156_decoy,TRY1,Decoy,0,-9.12312,-7.24,-3.14,-6.285725815488539
COc1ccc(/N=C2\S[C@H]3[C@H]([C@@H](O)[C@H](O)C[C@@H]3C(N)=O)N2Cc2ccc(N(C)C)cc2)cc1,C08253748_decoy,TRY1,Decoy,0,-10.1909,-5.32,-1.41,-6.576420869324268
C[C@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)Nc1cc2[nH]c(=O)[nH]c2cc1Br,C09633039_decoy,TRY1,Decoy,0,-9.12614,-7.17,-2.6,-6.625251182742331
CCCn1c(N)c(C(=O)COC(=O)CNC(=O)c2sc3ccccc3c2Cl)c(=O)[nH]c1=O,C09634460_decoy,TRY1,Decoy,0,-7.99275,-7.66,-2.96,-6.685114905047975
O=C(NNC(=O)c1cc2ccccc2[nH]c1=O)c1ccccc1NS(=O)(=O)c1cccs1,C10891972_decoy,TRY1,Decoy,0,-9.4227,-7.88,-1.71,-7.212368819472182
CCOC(=O)C1=C(CSc2nnc(C(F)(F)F)n2N)NC(=O)N[C@H]1c1ccc(Cl)cc1,C11236421_decoy,TRY1,Decoy,0,-7.28271,-6.36,-2.28,-5.544549300384499
N#Cc1c(CCCCCNc2cnn(-c3ccc(C(F)(F)F)cn3)c(=O)c2Cl)n[nH]c1N,C15114443_decoy,TRY1,Decoy,0,-8.61828,-6.64,-1.15,-5.926223581109688
CCc1sc(C(=O)NNC(=O)CNC(=O)CNC(=O)c2ccc(Cl)cc2Cl)cc1C,C15468544_decoy,TRY1,Decoy,0,-10.2439,-6.94,-2.26,-7.52897205385486
CC(C)(C)c1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3sc4c(c3C(N)=O)CCC4)C2=O)cc1,C03453390_decoy,TRY1,Decoy,0,-9.65289,-7.69,-1.33,-6.255855411496171
CCOc1ccc(-n2c(SCc3nc(N)nc(N)n3)nc3sc4c(c3c2=O)CCC4)cc1,C17664061_decoy,TRY1,Decoy,0,-9.68887,-7.28,-1.81,-7.454638627210321
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)NNC(=S)NCC(C)C)c3N2)cc1,C02794401_decoy,TRY1,Decoy,0,-9.07525,-6.87,-0.94,-6.251900038645826
COc1ccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)NNC(=S)NCC(C)C)c3N2)cc1,C02794399_decoy,TRY1,Decoy,0,-8.98232,-7.83,-1.88,-7.980208026581043
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)NNC(=S)NCC(C)C)c3N2)cc1,C02794400_decoy,TRY1,Decoy,0,-9.06345,-7.63,-2.2,-8.19476508142208
N#Cc1c(NC(=O)CCSc2n[nH]c(N/N=C/c3cccc(O)c3)n2)sc2c1CCCC2,C20906714_decoy,TRY1,Decoy,0,-10.5106,-9.52,-1.58,-10.956397284624243
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)Nc2ccc(C(F)(F)F)cc2)n1N,C20912133_decoy,TRY1,Decoy,0,-8.86733,-7.01,-1.77,-5.692561787740047
C/C(=N\Nc1nnc(SCC(=O)Nc2sc3c(c2C#N)CCCC3)n1N)c1cccs1,C21325403_decoy,TRY1,Decoy,0,-10.2285,-9.69,-2.62,-10.32276433298562
NC(=O)N[C@H](CC(=O)OCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(Cl)cc1,C21467736_decoy,TRY1,Decoy,0,-10.0123,-7.32,-2.48,-7.260043286320783
CCOc1ccc(NC(=S)NNC(=O)c2cnn3c2N[C@@H](c2ccccc2)C[C@@H]3C(F)F)cc1,C02794798_decoy,TRY1,Decoy,0,-8.2761,-8.85,-2.03,-7.659634107143057
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CSc2nnc(-c3ccccc3Cl)n2N)C1=O,C24138381_decoy,TRY1,Decoy,0,-7.61459,-8.18,-3.14,-6.717008637778882
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)CSc2nnc(-c3ccccc3Cl)n2N)C1=O,C24138385_decoy,TRY1,Decoy,0,-8.34727,-8.6,-3.83,-7.588838826019233
O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)NNC(=O)c1cc(-c2ccccc2)n[nH]1,C25406199_decoy,TRY1,Decoy,0,-7.07533,-6.82,-3.73,-5.193659794453205
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)c(=O)[nH]c1=O,C25899773_decoy,TRY1,Decoy,0,-7.54803,-6.09,-3.12,-5.950741044084634
C[C@H](NC(=O)/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)c1ccc(S(N)(=O)=O)cc1,C27325080_decoy,TRY1,Decoy,0,-11.0786,-6.6,-4.1,-6.616436894878581
CCCN(CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1nc2cc(Cl)ccc2c(=O)[nH]1,C12569629_decoy,TRY1,Decoy,0,-8.98223,-7.67,-2.04,-8.019805436500471
CCCCCC(=O)N(C)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36536641_decoy,TRY1,Decoy,0,-8.96783,-8.54,-2.97,-8.820752897139872
CCCCCC(=O)N(C)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36536642_decoy,TRY1,Decoy,0,-7.88353,-5.94,-0.88,-6.17891572633116
CCCn1c(S[C@H](C)C(=O)NC(=O)NC2CCCCC2)nc2cc(S(N)(=O)=O)ccc21,C23223782_decoy,TRY1,Decoy,0,-10.0688,-8.45,-3.99,-7.48667395868135
COc1ccc(NC(=O)C(=O)NN/C(C)=C\C(=O)Nc2ccc(Cl)c(Cl)c2)c(OC)c1,C08386087_decoy,TRY1,Decoy,0,-9.79575,-7.43,-3.0,-6.987508615923661
NN1C(SCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)=NN[C@@H]1[C@H]1N=NC2=C1CCC2,C39012172_decoy,TRY1,Decoy,0,-8.15706,-6.57,-2.67,-5.391081560739407
NN1C(SCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)=NN[C@@H]1[C@@H]1N=NC2=C1CCC2,C39012174_decoy,TRY1,Decoy,0,-7.82422,-8.36,-3.87,-6.825097573804356
NN1C(SCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)=NN[C@H]1[C@@H]1N=NC2=C1CCC2,C39012175_decoy,TRY1,Decoy,0,-7.65937,-8.91,-3.17,-6.654449178551933
O=C(CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccccc1)Nc1ccc(F)cc1F,C39361544_decoy,TRY1,Decoy,0,-8.15247,-8.37,-2.68,-7.312718366577197
CCOc1ccc(NC(=O)CSC2=NN[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2cccc(C)c2)cc1,C39361732_decoy,TRY1,Decoy,0,-9.62718,-7.8,-1.44,-7.739295049967518
O=C(CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1)Nc1ccc(F)cc1,C39362772_decoy,TRY1,Decoy,0,-6.79703,-8.41,-1.46,-7.093152270995706
NC(=O)c1cc(-c2csc(NC(=O)C3CCN(c4ncc(C(F)(F)F)cc4Cl)CC3)n2)c[nH]1,C39554907_decoy,TRY1,Decoy,0,-10.0445,-7.69,-2.23,-7.2950371711063
O=C(/C=C/c1ccc(OC(F)F)cc1OC(F)F)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39559542_decoy,TRY1,Decoy,0,-8.2378,-8.16,-2.59,-7.037873930330297
O=C(NCCc1c[nH]c2ccccc12)C(=O)N[C@H]1c2ccccc2O[C@@H]1C(=O)Nc1cccc(F)c1,C39708903_decoy,TRY1,Decoy,0,-9.25641,-6.76,-2.25,-6.6496075470014215
C=CCn1c(SCC(=O)Nc2ccccc2O)nnc1[C@@H](CO)NC(=O)c1ccccc1F,C39758165_decoy,TRY1,Decoy,0,-8.59207,-6.5,-2.57,-6.133478458278165
COc1ccc(Nc2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2cc(Cl)ccc2OC)CC(=O)N3)cc1,C40399961_decoy,TRY1,Decoy,0,-8.41187,-6.3,-3.31,-5.392632801424454
O=C(N/N=C/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)C(O)(c1ccccc1)c1ccccc1,C03209676_decoy,TRY1,Decoy,0,-9.84607,-6.95,-4.33,-8.206349816025366
Cc1cc(Cl)c2c(c1)[C@]1(N[C@@H](CCC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C15959700_decoy,TRY1,Decoy,0,-8.94991,-5.61,-2.04,-6.454713795596713
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](CCC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C15959702_decoy,TRY1,Decoy,0,-8.24434,-7.0,-1.79,-5.827825026569813
Cc1cc(Cl)cc2c1NC(=O)[C@]21N[C@H](CCC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C15969836_decoy,TRY1,Decoy,0,-10.9881,-8.5,-2.86,-9.936919501348472
O=C1C[C@@H](C(=O)Nc2cccc(OC(F)(F)F)c2)c2c(nc(Nc3ccc(F)cc3)[nH]c2=O)N1,C54202218_decoy,TRY1,Decoy,0,-8.09953,-7.15,-1.03,-5.953057634237021
O=C1C[C@H](C(=O)Nc2cccc(OC(F)(F)F)c2)c2c(nc(Nc3ccc(F)cc3)[nH]c2=O)N1,C54202219_decoy,TRY1,Decoy,0,-7.80235,-9.21,-2.97,-8.018470230143095
COc1ccc(NC(=O)[C@H]2CC(=O)Nc3nc(Nc4ccc(Cl)cc4)[nH]c(=O)c32)c(OC)c1,C54202253_decoy,TRY1,Decoy,0,-8.23952,-5.78,-1.11,-5.176011673455622
COc1ccc(OC)c(NC(=O)[C@@H]2CC(=O)Nc3nc(Nc4cccc(Cl)c4)[nH]c(=O)c32)c1,C54202280_decoy,TRY1,Decoy,0,-9.58781,-6.03,-2.94,-6.167899653540188
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)cc3Br)n[nH]2)ccc1O,C58995024_decoy,TRY1,Decoy,0,-9.75277,-8.28,-4.29,-7.309275882969728
O=C(CCCC(=O)NN/C=C1\C(=O)C=Cc2ccccc21)NN/C=C1\C(=O)C=Cc2ccccc21,C04962671_decoy,TRY1,Decoy,0,-9.64273,-7.53,-2.37,-7.45805386406625
CCCCOC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C59293252_decoy,TRY1,Decoy,0,-6.98081,-6.48,-1.99,-6.147316141057574
C/C(=N\Nc1nc(SCCC(=O)Nc2cccc(N3CCCC3=O)c2)n[nH]1)c1ccccc1O,C59830631_decoy,TRY1,Decoy,0,-8.93799,-9.71,-2.92,-8.63562416147295
CC[NH+](CC)Cc1c(O)c(C[NH+](CC)CC)c2oc(-c3ccccc3)cc(=O)c2c1O,C01156039_decoy,TRY1,Decoy,0,-7.971,-5.58,-2.84,-5.466056975063929
CC1(C)CC([NH2+]C[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)CC(C)(C)[NH2+]1,C07010011_decoy,TRY1,Decoy,0,-8.06948,-7.58,-1.77,-7.023081379789083
CC(=O)c1ccc(NC(=O)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2CCSCC2)cc1,C08635964_decoy,TRY1,Decoy,0,-9.53858,-6.87,-0.72,-5.813834311370617
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H]([NH2+]C3CC3)C[C@@H](c3ccc(F)cc3)[NH+]21,C08636019_decoy,TRY1,Decoy,0,-8.72782,-6.03,-0.23,-5.532440825868395
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@@H]([NH+]3CC[C@@H](O)C3)C[C@@H](c3ccc(C(F)(F)F)cc3)[NH+]21,C08636026_decoy,TRY1,Decoy,0,-9.65392,-8.0,-0.98,-6.223463709362629
COc1ccc(-c2coc3c(C[NH+]4CCC[C@H](C)C4)c(O)c(C[NH+]4CCC[C@@H](C)C4)c(O)c3c2=O)cc1,C09034085_decoy,TRY1,Decoy,0,-9.53669,-8.22,-2.31,-7.8588431958351395
N#CC(C(=O)C[NH+]1CCCN(c2ccc(C(F)(F)F)c[nH+]2)CC1)=C1Nc2ccccc2N1,C09813162_decoy,TRY1,Decoy,0,-7.6511,-8.95,-0.93,-7.007024020283388
COc1ccc(-c2coc3c(C[NH+]4CCC[C@@H](C)C4)c(O)c(C[NH+]4CCC[C@@H](C)C4)c(O)c3c2=O)cc1,C11867941_decoy,TRY1,Decoy,0,-9.4903,-8.48,-2.68,-8.11517303078593
O=C(Nc1ccc(N2CCN(c3[nH+]cccc3C(F)(F)F)CC2)[nH+]c1)Nc1ccc(F)cc1F,C12369347_decoy,TRY1,Decoy,0,-6.73746,-6.18,-2.27,-4.697035317795815
CC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(Br)cc2Br)o1,C13735446_decoy,TRY1,Decoy,0,-8.65373,-4.08,-4.37,-4.955489625327904
[NH3+]CC[C@@H](c1ccc(Cl)cc1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C19936596_decoy,TRY1,Decoy,0,-9.11745,-5.65,-2.74,-5.693476063142696
O[C@H](COc1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1)C[NH+]1CCc2ccccc2C1,C20452199_decoy,TRY1,Decoy,0,-8.66539,-7.91,-3.61,-6.670835541440953
CCCOc1c(Br)cc(Br)cc1C[NH2+]CC1CC[NH2+]CC1,C20967879_decoy,TRY1,Decoy,0,-8.60443,-6.14,-1.78,-9.14215574525857
CC[NH+]1CCC[C@@H]1CN(Cc1ccccc1F)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21264309_decoy,TRY1,Decoy,0,-8.27963,-5.61,-2.77,-5.828941908103158
CC[NH+]1CCC[C@H]1CN(Cc1ccccc1F)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21264313_decoy,TRY1,Decoy,0,-9.14108,-5.54,-1.37,-6.5242827857153065
C[NH2+]CCCN(C)c1cccc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)[nH+]1,C28639311_decoy,TRY1,Decoy,0,-9.68702,-5.32,-2.44,-5.595277234801138
Cc1ccc([C@H]([NH3+])CC(C)C)c(N2CCN(C(=O)[C@@H](C)Cc3ccc(Cl)cc3Cl)CC2)[nH+]1,C28826799_decoy,TRY1,Decoy,0,-9.53425,-5.72,-1.32,-6.568695965446772
COc1ccc2c(C)cc(N[C@H]3CC[C@H]([NH2+]Cc4cn(C)c5cccnc45)C3)[nH+]c2c1,C28951158_decoy,TRY1,Decoy,0,-9.72985,-7.37,-3.94,-7.862032777034866
CC[NH+](CC)CCNC(=S)Nc1ccc2nc(N3CC[NH+](C)CC3)cc(C)c2c1,C20153746_decoy,TRY1,Decoy,0,-7.92494,-5.57,-1.66,-5.0281013507371535
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCc2cn3cc(C)ccc3[nH+]2)C2(CC[NH2+]CC2)C1,C39670375_decoy,TRY1,Decoy,0,-7.61894,-5.78,-3.6,-5.680989339189081
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)c2ccccc2Cl)CC12CC[NH2+]CC2,C39674589_decoy,TRY1,Decoy,0,-8.4474,-6.19,-2.48,-6.095403915659173
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2)CC12CC[NH2+]CC2,C39674696_decoy,TRY1,Decoy,0,-9.22444,-8.83,-3.33,-7.738596129640619
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@H]3C)C3(CC[NH2+]CC3)C2)cc1F,C39674727_decoy,TRY1,Decoy,0,-8.63312,-8.57,-2.67,-7.833815611659044
CCCC[NH+]1CCC(CNC(=O)[C@H]2CN(C(=O)C[C@@H](C)CC)CC23CC[NH2+]CC3)CC1,C39683586_decoy,TRY1,Decoy,0,-9.24624,-5.66,-3.72,-6.552914618197227
C[NH+](C)CCNC(=O)CC[C@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]CC1CCCCC1,C20464608_decoy,TRY1,Decoy,0,-9.32715,-6.25,-3.25,-6.700024731249428
CCOc1cc(C[NH2+]CC2CC[NH2+]CC2)cc(Cl)c1OCc1ccc(F)cc1Cl,C40720525_decoy,TRY1,Decoy,0,-8.8484,-6.72,-1.95,-5.707619041090144
CSc1cccc(NC(=O)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3CN2CC[NH+](C)CC2)c1,C43527231_decoy,TRY1,Decoy,0,-10.9444,-7.45,-0.65,-8.123279756391076
C[NH+](C)CCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]CC1CCCCC1,C43547744_decoy,TRY1,Decoy,0,-10.1449,-7.0,-1.71,-7.614365076947651
Cc1ccc([O-])c(Cn2c(NC3CC[NH+](CCC(C)C)CC3)[nH+]c3c(C)cccc32)[nH+]1,C28710370_decoy,TRY1,Decoy,0,-8.51829,-7.0,-1.53,-7.880801844479087
C[NH+](Cc1ccc(Cl)cc1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362050_decoy,TRY1,Decoy,0,-9.21494,-4.82,-0.6,-5.441924279806573
C[NH+](Cc1cccc(Br)c1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362057_decoy,TRY1,Decoy,0,-8.24738,-4.38,-3.05,-4.623824244636416
C[NH+](Cc1ccccc1Br)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362063_decoy,TRY1,Decoy,0,-7.85655,-5.16,-2.23,-6.425647112393024
CC(C)[NH+](Cc1cccs1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362239_decoy,TRY1,Decoy,0,-8.45677,-4.05,-1.45,-5.120796989596426
CC(C)[NH+](Cc1cccs1)[C@H](C[NH3+])c1cc(Br)c(Br)o1,C50362241_decoy,TRY1,Decoy,0,-9.89533,-5.56,-0.66,-8.094201820977085
C[NH+](Cc1cc(Br)cs1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362270_decoy,TRY1,Decoy,0,-9.91523,-3.89,-3.1,-5.493709441392004
[NH3+][C@H](COc1cc(-c2ccc3cnccc3c2)cnc1Cl)CC1=c2ccccc2=[NH+]C1,C52627938_decoy,TRY1,Decoy,0,-9.02673,-6.02,-1.82,-5.655395130008683
Oc1ccc(Br)c(C2[NH+](Cc3ccccc3O)CC[NH+]2Cc2ccccc2O)c1,C19333548_decoy,TRY1,Decoy,0,-8.08103,-5.53,-1.29,-5.544495106639625
Cc1ccc(C2=[NH+]C3=C[C@H](C(=O)NC[C@H]4C=c5cc(Cl)ccc5=[NH+]4)NN3C(C(F)(F)F)=C2)cc1,C63111115_decoy,TRY1,Decoy,0,-8.09122,-8.43,-1.82,-7.839871157487828
COc1ccc2c(c1)=C(CC[NH2+]C[C@H]1C(=O)O[C@@H]3CC4=CCC[C@@H](C)[C@@]4(C)[C@@H](O)[C@@H]31)C[NH+]=2,C63225288_decoy,TRY1,Decoy,0,-8.74055,-7.69,-2.8,-6.858174611349589
CC(C)(C)OC(=O)[C@@H]1c2nc3ccccc3nc2N(CCC2=c3ccccc3=[NH+]C2)[C@@H]1[NH3+],C63411640_decoy,TRY1,Decoy,0,-7.46208,-5.96,-3.5,-5.354959143086878
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](NCc4ccccc4Cl)N3N2)[C@@H](C)N=N1,C63494620_decoy,TRY1,Decoy,0,-9.02892,-7.56,-2.26,-9.850146252765814
Cc1cccc([C@@H]2NC3=c4ccccc4=[NH+][C@H](NCCC4=c5ccccc5=[NH+]C4)N3N2)c1,C63494692_decoy,TRY1,Decoy,0,-8.66943,-8.77,-1.15,-10.252427534260358
CCOC(=O)C1=C(CSC2[NH+]=c3ccccc3=[NH+]2)NC(=O)N[C@@H]1c1cc(C)ccc1C,C63515319_decoy,TRY1,Decoy,0,-8.41319,-7.37,-2.85,-8.427984233716398
CCOC(=O)C1=C(CSC2[NH+]=c3ccccc3=[NH+]2)NC(=O)N[C@H]1c1cc(C)ccc1C,C63515320_decoy,TRY1,Decoy,0,-8.51904,-7.47,-1.11,-7.123228612389613
Cc1ccc2[nH]c(N3CCC(C(=O)NCCC4=c5cc(Cl)ccc5=[NH+]C4)CC3)[nH+]c2c1,C63694601_decoy,TRY1,Decoy,0,-9.66676,-6.72,-0.89,-5.802055076817676
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@@H](SCc2c(Cl)cccc2Cl)O1,C64428655_decoy,TRY1,Decoy,0,-8.05757,-8.02,-2.27,-7.237568091759178
O=C(CC1=c2ccccc2=[NH+]C1)NCCN1c2[nH+]cccc2N[C@@H]1CCc1ccccc1,C64491036_decoy,TRY1,Decoy,0,-8.74303,-6.45,-2.18,-6.820240366507039
Cc1ccc2c(c1)=C(CCNC(=O)C1CC[NH+]([C@H]3Nc4ccccc4N(C)C3=O)CC1)C[NH+]=2,C64491438_decoy,TRY1,Decoy,0,-7.87776,-8.3,-1.45,-5.893806397500081
Cc1ccc(C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)cc1N1NNc2ccc[nH+]c21,C64492128_decoy,TRY1,Decoy,0,-10.1282,-8.78,-1.76,-6.894433336456002
O=C(C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1)NCCC1=c2ccccc2=[NH+]C1,C64697866_decoy,TRY1,Decoy,0,-7.98306,-8.48,-2.01,-6.947393316610062
C[NH2+][C@@H](CC(C)C)C(=O)N[C@H]1C[C@@](O)(C(=O)N[C@H](CC(C)C)C(N)=O)C[C@@H](O)[C@@H]1O,C03840176_decoy,TRY1,Decoy,0,-9.12969,-4.23,-3.42,-5.207045554893064
CCOC(=O)c1[nH]c2cc3c(cc2c1NC(=O)C[NH+]1CCC(C(N)=O)CC1)OCO3,C02247265_decoy,TRY1,Decoy,0,-7.77005,-5.93,-1.22,-4.919370825463927
C[NH2+][C@@H](CC(C)C)C(=O)N[C@@H]1C=C(C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O)C[C@@H](O)[C@@H]1O,C04200820_decoy,TRY1,Decoy,0,-9.10044,-6.63,-2.29,-6.39572599758706
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2Cn1cc(-c2cccc(N)c2)nn1,C08254382_decoy,TRY1,Decoy,0,-8.70171,-8.38,-1.32,-7.792169588233431
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@H]1C[C@@H]2Cn1cc(-c2cccc(N)c2)nn1,C08254384_decoy,TRY1,Decoy,0,-9.19259,-7.72,-1.58,-7.246678759790246
C[NH+](C)CCNS(=O)(=O)c1ccc(NCCc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])c1,C09127518_decoy,TRY1,Decoy,0,-8.21823,-6.22,-2.6,-6.847676971281444
CC[NH+](CC(=O)NNC(=O)Cc1nc(C)cs1)CC(=O)Nc1ccc(NC(C)=O)cc1,C14922513_decoy,TRY1,Decoy,0,-8.86669,-5.5,-1.73,-6.237710419357567
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1cccc(OC)c1O,C19926780_decoy,TRY1,Decoy,0,-8.56304,-7.22,-0.69,-7.531205152532965
COc1cc(NC(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2[NH+]2CCC(C)CC2)cc(OC)c1,C20466018_decoy,TRY1,Decoy,0,-7.99662,-5.68,-1.99,-5.235874318674129
NS(=O)(=O)c1ccc(C[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1,C21265712_decoy,TRY1,Decoy,0,-6.78372,-6.37,-4.33,-5.537427181509281
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)CC(=O)NN1C(=O)N[C@@](CC)(c2ccccc2)C1=O,C24212154_decoy,TRY1,Decoy,0,-7.71995,-7.28,-2.81,-6.251577518364403
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)CC(=O)NN1C(=O)N[C@](CC)(c2ccccc2)C1=O,C24212161_decoy,TRY1,Decoy,0,-7.89252,-7.37,-1.79,-8.075557548363168
NNC(=O)c1ccc(OC[C@@H](O)CN2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)cc1,C26531210_decoy,TRY1,Decoy,0,-9.21567,-8.01,-3.44,-6.410353891055682
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)[C@H]([NH3+])CCC(N)=O)C2,C27323831_decoy,TRY1,Decoy,0,-9.10132,-8.79,-1.47,-8.589770609732748
CC[NH+](CC(=O)Nc1ccc2c(c1)OCCO2)CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C27349664_decoy,TRY1,Decoy,0,-7.87589,-7.42,-1.7,-6.042674761543805
C=CCNC(=O)C[NH+]1CCN([C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1,C27559301_decoy,TRY1,Decoy,0,-10.2336,-6.07,-1.04,-8.518374766924456
C=CCNC(=O)C[NH+]1CCN([C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1,C27559303_decoy,TRY1,Decoy,0,-10.2185,-7.01,-2.06,-6.711558975354499
CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1C,C32976380_decoy,TRY1,Decoy,0,-8.26139,-5.2,-1.4,-4.933871277131676
CCCn1c(N)c(C(=O)C[NH+](C)CC(=O)Nc2ccc(F)cc2)c(=O)[nH]c1=O,C06784953_decoy,TRY1,Decoy,0,-6.49729,-7.24,-2.07,-7.263095409106341
Cc1cc(C)nc(N/C(=N/C(=O)CS[C@@H]2N[NH+]=C(N)N2)NCCc2c[nH]c3ccc(F)cc23)n1,C39355719_decoy,TRY1,Decoy,0,-10.402,-8.91,-0.92,-9.481496905302183
C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)C1,C41791921_decoy,TRY1,Decoy,0,-8.32577,-7.73,-1.54,-6.674760503724551
C=CC[NH+](CC=C)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)C(C)C,C41856183_decoy,TRY1,Decoy,0,-7.2652,-5.86,-3.99,-5.376617317335638
C=CC[NH+](CC=C)[C@@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)C(C)C,C41856185_decoy,TRY1,Decoy,0,-8.42406,-5.62,-2.61,-5.915374205540525
COC(=O)[C@H](CCC/N=C(\N)N[N+](=O)[O-])NC(=O)c1coc([C@@H]2CCC[NH2+]C2)n1,C43216302_decoy,TRY1,Decoy,0,-7.94226,-6.81,-1.34,-7.1880150577231925
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)co1,C43217240_decoy,TRY1,Decoy,0,-8.87171,-8.33,-2.84,-8.763808092584027
Cc1ccccc1[C@@H]1[NH2+][C@](CO)(C(=O)[O-])[C@@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@H]21,C33913961_decoy,TRY1,Decoy,0,-7.50538,-7.67,-1.67,-6.124639416572269
Nc1c(C(=O)CN2CC[NH+](CC(=O)Nc3ccccc3C(F)(F)F)CC2)c(=O)[nH]c(=O)n1C1CC1,C45606260_decoy,TRY1,Decoy,0,-7.64593,-7.29,-1.35,-6.118341460661673
C[NH+](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C46556898_decoy,TRY1,Decoy,0,-7.13887,-6.39,-3.54,-5.414181720053736
O=C(NCC[NH+]1CCN(c2ccc(F)cc2)CC1)NNC(=O)C(=O)NC1CC1,C46866491_decoy,TRY1,Decoy,0,-8.09951,-7.08,-3.06,-5.942226265525678
CC(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)C)Cc1ccco1,C47549038_decoy,TRY1,Decoy,0,-6.68726,-5.94,-3.82,-5.375900948496702
NC(=O)c1ccsc1NC(=O)C(=O)NCc1ccccc1C[NH+]1CCCC1,C47967429_decoy,TRY1,Decoy,0,-8.15922,-5.69,-2.08,-6.024796911971984
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1)c1cccs1,C48743382_decoy,TRY1,Decoy,0,-10.6585,-6.35,-3.62,-7.883609488857748
NC(=O)c1cc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)ccc1F,C48767886_decoy,TRY1,Decoy,0,-8.31845,-7.33,-1.77,-6.609338259879043
CCC[C@H](C)NC(=O)[C@@H]1CCC[NH+](CCC(=O)Nc2sccc2C(N)=O)C1,C51052613_decoy,TRY1,Decoy,0,-8.00205,-6.54,-0.67,-6.789287955209908
CCCC[NH+](CC(N)=O)CC(=O)Nc1ccccc1C(=O)NCc1ccco1,C45805342_decoy,TRY1,Decoy,0,-6.60384,-6.1,-1.46,-6.958613177363669
NS(=O)(=O)c1ccc(CCNC(=O)NCc2ccc[nH+]c2N2CCOCC2)cc1,C58715772_decoy,TRY1,Decoy,0,-8.98763,-7.26,-2.75,-6.038617671728301
O=C(NCCCO)C1=CN([C@H]2CCCN(C[C@@H]3C=c4ccccc4=[NH+]3)C2)NN1,C64622241_decoy,TRY1,Decoy,0,-8.44275,-6.6,-2.91,-5.881998172440023
O=C(NCCCO)C1=CN([C@H]2CCCN(C[C@H]3C=c4ccccc4=[NH+]3)C2)NN1,C64622242_decoy,TRY1,Decoy,0,-8.03818,-7.26,-2.11,-7.167249250890374
O=C(NCCCn1cc[nH+]c1)NNC(=O)c1cc(-c2cccc(Cl)c2)[nH]n1,C64886101_decoy,TRY1,Decoy,0,-8.11098,-6.46,-1.84,-5.799061347560829
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)NCCCn1cc[nH+]c1,C64886362_decoy,TRY1,Decoy,0,-9.44894,-6.62,-1.87,-6.703702266780003
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)NCCCn1cc[nH+]c1,C64886400_decoy,TRY1,Decoy,0,-8.46427,-8.21,-1.71,-6.831734013396837
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CC[NH+](C(C)C)C2)nc1,C65519965_decoy,TRY1,Decoy,0,-8.60503,-5.9,-3.02,-5.665609230751348
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)Nc1ccc(NC(=O)CC[NH+](C)C)cc1,C65746731_decoy,TRY1,Decoy,0,-7.34576,-6.43,-2.25,-5.559292888648187
COc1cccc(C[NH+]2CCNC(=O)[C@@H]2CC(=O)NN)c1OC[C@H]1CCCO1,C66115438_decoy,TRY1,Decoy,0,-6.79941,-5.39,-3.35,-6.610408882000775
COCCOc1ccc2ccccc2c1C[NH+]1CCNC(=O)[C@H]1CC(=O)NN,C66115486_decoy,TRY1,Decoy,0,-7.62472,-7.0,-1.66,-7.994633950409582
COc1cc(C[NH2+]CC(C)(C)NS(C)(=O)=O)cc(Cl)c1OCC(N)=O,C67005895_decoy,TRY1,Decoy,0,-8.22486,-5.98,-3.77,-5.46741817217884
CC1CC[NH+](C[C@@H](O)CNC(=O)NCCCNC(=O)c2ccccc2F)CC1,C67634733_decoy,TRY1,Decoy,0,-8.55054,-6.53,-1.93,-5.9403931029252375
Nc1cccc(S(=O)(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c1,C05616292_decoy,TRY1,Decoy,0,-7.48697,-6.21,-3.95,-6.934468479387225
Nc1cccc(S(=O)(=O)N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1,C05616295_decoy,TRY1,Decoy,0,-7.55768,-7.59,-2.86,-7.3699264160336115
COc1cc([C@@H]2C(C#N)=C(N)Oc3c2oc(CO)cc3=O)ccc1OCC(N)=O,C08747908_decoy,TRY1,Decoy,0,-7.31322,-6.06,-2.25,-5.3079855748143645
CCC(CC)NC(=O)COC(=O)c1cc([C@@H](O)[C@H](O)[C@H](O)CO)oc1C,C09479598_decoy,TRY1,Decoy,0,-8.5302,-6.49,-3.11,-7.51111247537259
Nc1nc(SCC(=O)Nc2nccs2)[nH]c(=O)c1NC(=O)c1cccs1,C02712471_decoy,TRY1,Decoy,0,-9.09614,-6.41,-1.72,-6.748467580669569
CCCCn1c(N)c(N(CCC(C)C)CC(=O)NC(=O)NC)c(=O)[nH]c1=O,C10485511_decoy,TRY1,Decoy,0,-8.2149,-6.55,-4.83,-7.48508851150113
Nc1nc(SCC(=O)Nc2nccs2)[nH]c(=O)c1NC(=O)c1ccc(Br)o1,C12033657_decoy,TRY1,Decoy,0,-7.73906,-6.43,-1.05,-6.661464116097721
CCC(CC)NC(=O)COC(=O)c1cc([C@H](O)[C@H](O)[C@@H](O)CO)oc1C,C12612886_decoy,TRY1,Decoy,0,-8.40236,-4.79,-1.2,-5.675519590437422
COc1ccc(C(=O)NNC(=O)CSc2nc3c(N)ncnc3[nH]2)cc1,C12640571_decoy,TRY1,Decoy,0,-8.3604,-7.7,-2.34,-7.398913849114145
C[C@H](OC(=O)c1ccc(Cl)c(N)c1)C(=O)Nc1sccc1C(N)=O,C15693411_decoy,TRY1,Decoy,0,-8.67418,-5.48,-1.95,-7.350196111150343
CCOC(=O)NC(=S)Nc1cc2nc[nH]c2cc1NC(=S)NC(=O)OCC,C19912354_decoy,TRY1,Decoy,0,-9.5456,-7.21,-2.21,-8.939313254073065
Cc1cc([N+](=O)[O-])c(NC[C@@H](O)[C@@H](O)[C@@H](O)CO)cc1Br,C19926309_decoy,TRY1,Decoy,0,-7.43105,-6.6,-1.27,-6.9701787952777625
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(CCN2CCOCC2)C(=O)c2snc(C(N)=O)c2N)cc1,C19941053_decoy,TRY1,Decoy,0,-10.1859,-5.1,-2.73,-6.822272087454468
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1ccccc1Br,C25396416_decoy,TRY1,Decoy,0,-7.17427,-6.76,-0.91,-8.727024348160663
C[C@H](NC(=O)CSCc1nc(N)nc(N)n1)c1ccc(Cl)cc1Cl,C28259775_decoy,TRY1,Decoy,0,-8.68989,-7.17,-1.32,-7.329175631755877
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)NC2CCCC2)c1,C29642303_decoy,TRY1,Decoy,0,-8.81284,-5.03,-2.25,-5.092976705662635
COc1cc(C(=O)O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc(O)c1OC,C31159278_decoy,TRY1,Decoy,0,-5.83929,-6.53,-2.77,-5.292080957957994
NC(=O)Cc1csc(NC(=O)CNC(=O)CNC(=O)c2ccco2)n1,C32882525_decoy,TRY1,Decoy,0,-7.7171,-7.36,-1.44,-6.168420911046401
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@@H]2/C=C/c1ccccc1,C33516248_decoy,TRY1,Decoy,0,-7.19459,-7.82,-1.25,-7.759668715955614
CCC(CC)NC(=O)COC(=O)c1cc([C@H](O)[C@H](O)[C@H](O)CO)oc1C,C35334256_decoy,TRY1,Decoy,0,-8.62031,-7.59,-0.35,-8.705137268721048
COc1cc(C(=O)O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c1OC,C35456324_decoy,TRY1,Decoy,0,-6.61641,-4.94,-1.7,-5.2945475569184834
CCCCn1c(N)c(N(C(=O)CN2Cc3ccccc3C[C@H]2C(N)=O)C2CCCC2)c(=O)[nH]c1=O,C35488977_decoy,TRY1,Decoy,0,-7.43813,-7.2,-2.05,-6.886027086861417
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)o1,C12714857_decoy,TRY1,Decoy,0,-9.15385,-6.48,-2.03,-6.9124057793062
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)o1,C12714853_decoy,TRY1,Decoy,0,-7.28753,-6.56,-2.52,-6.579256805257267
C[C@@H](Sc1nc(N)cc(=O)[nH]1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C09963049_decoy,TRY1,Decoy,0,-7.99488,-7.81,-2.8,-6.133716683525398
CSC1=N[C@H](N/C(C)=C(/CCO)C(=O)N2NC(SC)=N[C@@H]2N)N=N1,C38783408_decoy,TRY1,Decoy,0,-6.49231,-6.07,-1.94,-6.990698659337806
CCC[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@@H]1c1ccncc1,C39690033_decoy,TRY1,Decoy,0,-7.35007,-8.52,-2.01,-6.891565238120364
Nc1c(NC[C@H]2CCCO2)ncnc1NNC(=O)c1ccccc1Br,C40687092_decoy,TRY1,Decoy,0,-8.00603,-6.84,-1.81,-5.879835138095645
Cc1ccc(C(=O)NNc2ncnc(N3CCN(CCO)CC3)c2N)cc1,C40734437_decoy,TRY1,Decoy,0,-8.05078,-6.64,-1.57,-6.476663657133483
Nc1c(NNC(=O)c2ccccc2Br)ncnc1N1CCN(CCO)CC1,C40734461_decoy,TRY1,Decoy,0,-8.52719,-7.35,-1.74,-6.5203449891841
COC[C@@H](C)Nc1ncnc(NNS(=O)(=O)c2ccc(C)cc2)c1N,C40794767_decoy,TRY1,Decoy,0,-7.74893,-6.83,-5.03,-5.553286052300246
CC(C)NC(=O)CNS(=O)(=O)c1cc(Br)cnc1NN,C41070110_decoy,TRY1,Decoy,0,-8.14209,-5.98,-2.71,-7.350808003641532
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)cc1,C41318105_decoy,TRY1,Decoy,0,-7.97147,-6.82,-3.33,-7.0122792503057445
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)cc1,C41318109_decoy,TRY1,Decoy,0,-7.48906,-6.26,-4.07,-6.490524896602858
COCCNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)NC2CC2)cc1,C42667439_decoy,TRY1,Decoy,0,-7.12921,-6.7,-2.42,-6.19329193208369
COCCNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)NC2CC2)cc1,C42667440_decoy,TRY1,Decoy,0,-7.3467,-5.71,-1.63,-5.101449288846476
CCCCOc1ccc(/C=C/C(=O)NC(C(N)=O)C(N)=O)cc1OCC,C44389165_decoy,TRY1,Decoy,0,-7.65348,-6.0,-3.47,-6.275787431990924
C[C@H](Nc1ccc(Cl)c(C(N)=O)c1)C(=O)NC(=O)NCC(F)(F)F,C44807228_decoy,TRY1,Decoy,0,-7.5803,-6.99,-1.2,-6.14924090965676
C[C@H](/C(=N/NC(=S)NN)c1ccc(O)cc1)[C@H]1OC(=O)c2ccccc21,C48552740_decoy,TRY1,Decoy,0,-8.61693,-7.44,-0.68,-8.358133144510662
C[C@@H](/C(=N/NC(=S)NN)c1ccc(O)cc1)[C@H]1OC(=O)c2ccccc21,C48552744_decoy,TRY1,Decoy,0,-8.15847,-7.03,-0.86,-8.620948169734316
C[C@H](/C(=N/NC(=S)NN)c1ccc(O)cc1)[C@@H]1OC(=O)c2ccccc21,C48552748_decoy,TRY1,Decoy,0,-6.97254,-6.46,-1.46,-6.730626004742631
N#C[C@H](C(=O)CNC(=O)NC1CC1)c1nc(N)nc(Nc2ccccc2)n1,C49395469_decoy,TRY1,Decoy,0,-7.17054,-7.25,-3.38,-6.960163239094636
Cc1sc(NC(=O)C2CC2)c(C(=O)OCc2nc(N)nc(N)n2)c1C,C06990333_decoy,TRY1,Decoy,0,-8.43687,-7.43,-1.72,-7.852155756366946
CNC(=O)c1cc(Cl)ccc1NC(=O)C[C@H](NC(N)=O)c1cccs1,C58227901_decoy,TRY1,Decoy,0,-8.79436,-7.07,-3.46,-7.278096261146986
COc1ccccc1CNC(=O)CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1,C58994218_decoy,TRY1,Decoy,0,-8.95089,-8.56,-1.33,-7.942686826406309
Cc1ccccc1[C@@H](CC(=O)NCCC(=O)Nc1cccnc1)NC(N)=O,C66098434_decoy,TRY1,Decoy,0,-7.66504,-7.75,-3.56,-6.670901793437968
Cc1ccccc1[C@H](CC(=O)NCCC(=O)Nc1cccnc1)NC(N)=O,C66098436_decoy,TRY1,Decoy,0,-6.80389,-6.74,-2.7,-5.384343912142273
CCOCC(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1,C66702839_decoy,TRY1,Decoy,0,-6.49318,-6.55,-3.3,-6.118176343386486
CC(C)(C)OC(=O)NCC(=O)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C67145139_decoy,TRY1,Decoy,0,-7.50808,-7.89,-1.17,-7.422463650896002
NC(=O)Cn1cc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)cn1,C67165273_decoy,TRY1,Decoy,0,-7.71854,-6.98,-2.96,-6.36178746773162
COc1c2c(cc3c1[C@@H](CC(=O)C1=CC[C@@H]4[C@@H]5CC[C@H]6C[C@H](O)CC[C@]6(C)[C@H]5CC[C@]14C)[NH+](C)CC3)OCO2,C08762697_decoy,TRY1,Decoy,0,-9.44957,-7.06,-3.33,-5.304728341993423
COc1c2c(cc3c1[C@@H](C#C[C@@]1(O)C[C@H]4[C@H]5CCC6=CC(=O)CC[C@@]6(C)[C@@H]5CC[C@]4(C)C1)[NH+](C)CC3)OCO2,C08921923_decoy,TRY1,Decoy,0,-8.94221,-7.72,-3.1,-4.844999061290367
O=C1[C@H]2[C@@H](C(=O)N1c1cc(C(F)(F)F)ccc1Cl)[C@]1(C(=O)Nc3ccc(F)cc31)[NH+]1CCC[C@@H]21,C09123929_decoy,TRY1,Decoy,0,-7.45562,-6.55,-4.05,-4.08690034389482
Cc1ccc(C[NH+]2CCN(c3nc4c(c(=O)[nH]c(=O)n4C)n3Cc3c(F)cccc3Cl)CC2)cc1,C09291076_decoy,TRY1,Decoy,0,-7.34754,-6.4,-1.54,-4.566210805975295
O=C1[C@@H]2[C@H]3CCC[NH+]3[C@@]3(C(=O)Nc4ccc(Br)cc43)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1,C09360284_decoy,TRY1,Decoy,0,-7.31876,-5.87,-1.7,-4.544052624208105
COc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H]1CC[C@@]2(O)C#C[C@H]1c2c(cc3c(c2OC)OCO3)CC[NH+]1C,C12660367_decoy,TRY1,Decoy,0,-9.66291,-6.69,-3.16,-4.928555991756111
COc1c2c(cc3c1[C@H](CC(=O)C1=CC[C@@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@@H]5CC[C@]14C)[NH+](C)CC3)OCO2,C12661580_decoy,TRY1,Decoy,0,-9.23795,-7.44,-2.16,-5.950983266754964
Cc1ccc(C)c(N2CC[NH+]([C@H](c3cc4cc5c(cc4[nH]c3=O)OCO5)c3nnnn3C(C)(C)C)CC2)c1,C06195876_decoy,TRY1,Decoy,0,-8.29013,-7.57,-1.74,-6.100831393634239
Cc1cc2cc([C@@H](c3nnnn3C3CCCC3)[NH+]3CC=C(c4ccc(F)cc4)CC3)c(=O)[nH]c2cc1C,C06320993_decoy,TRY1,Decoy,0,-8.74715,-8.62,-1.27,-10.600726523701583
Cc1ccc(C)c2[nH]c(=O)c([C@@H](c3nnnn3C3CCCC3)[NH+]3CCN(C(=O)c4ccco4)CC3)cc12,C06322058_decoy,TRY1,Decoy,0,-7.62679,-6.78,-2.23,-6.620705883490274
Cc1ccc2cc([C@@H](c3nnnn3C3CCCCC3)[NH+]3CCN(c4ccccc4)CC3)c(=O)[nH]c2c1C,C06441864_decoy,TRY1,Decoy,0,-8.36181,-7.99,-1.32,-8.067313385156172
N#Cc1c(-c2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc2n(c1=[NH2+])CCc1cc3c(cc1-2)OCCCO3,C13576585_decoy,TRY1,Decoy,0,-9.56829,-7.33,-3.35,-5.4210882687294415
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21,C16000282_decoy,TRY1,Decoy,0,-7.60099,-9.16,-1.88,-5.440775282840881
COC(=O)c1c(N2C(=O)[C@@H]3[C@H]4CCC[NH+]4[C@@]4(C(=O)Nc5c(C)cc(C)cc54)[C@@H]3C2=O)sc(C)c1C,C09356666_decoy,TRY1,Decoy,0,-7.97463,-5.66,-2.55,-5.289159151363134
COc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@]2(C(=O)Nc4c(Cl)cccc42)[NH+]2CCC[C@@H]32)c(C)cc1[N+](=O)[O-],C09328504_decoy,TRY1,Decoy,0,-8.05072,-6.15,-2.19,-5.261065393190799
O=C1[C@@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@]1(C(=O)Nc3ccc(Br)cc31)[NH+]1CCC[C@@H]21,C09361416_decoy,TRY1,Decoy,0,-7.03989,-7.05,-1.19,-4.481475600567622
COc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@]2(C(=O)Nc4ccc(Cl)cc42)[NH+]2CCC[C@@H]32)c(C)cc1[N+](=O)[O-],C09329411_decoy,TRY1,Decoy,0,-8.08838,-5.81,-1.96,-4.571715771829617
O=c1[nH]c2cc3c(cc2cc1[C@@H](c1nnnn1C1CCCCC1)N1CC[NH+](C2CCCCC2)CC1)OCO3,C20080849_decoy,TRY1,Decoy,0,-9.02247,-6.65,-1.96,-5.622399611449213
Cc1cccc(CN2c3ccccc3C(=O)/C(=C\Nc3cccc4c3N3CC[NH+]=C3S4)S2(=O)=O)c1,C20132880_decoy,TRY1,Decoy,0,-8.81549,-6.97,-2.07,-5.724629247987082
CC(=O)[NH+]=c1ccc2c(CSc3nc4sc(C)c(C)c4c(=O)n3C3CCCC3)cc(O)oc-2c1,C22101783_decoy,TRY1,Decoy,0,-9.37378,-8.39,-1.39,-6.836771138062921
Cc1cc[nH+]c(N2CCN(CC[C@@H]3Cn4c(-c5cc(C)c(O)c(C)c5)c(C)c5cccc(c54)O3)CC2)c1,C26401819_decoy,TRY1,Decoy,0,-9.3134,-7.4,-3.09,-7.015244189469344
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(C(=O)Nc3c1ccc(Cl)c3C)[NH+]1CCC[C@@H]21,C16001799_decoy,TRY1,Decoy,0,-7.10833,-6.41,-1.58,-5.230089354458488
COc1ccc2c(c1OC)C(=O)O[C@H]2N[C@H]1N2C[C@@]3(C)C[NH+]1C[C@@](C)(C2)C3c1ccc2c(c1)OCO2,C32123981_decoy,TRY1,Decoy,0,-8.68693,-8.37,-2.74,-6.33277683714725
C[C@@H](c1nc(=O)c2c(-c3ccccc3)csc2[nH]1)[NH+]1CCN(S(=O)(=O)c2ccccc2F)CC1,C13041339_decoy,TRY1,Decoy,0,-7.95023,-8.88,-3.88,-8.835745370652813
CSc1nc(N2CC[NH+](CC(=O)Nc3ccc(Br)cc3)CC2)c2c3c(sc2n1)CCC3,C34757038_decoy,TRY1,Decoy,0,-11.4897,-7.11,-1.87,-7.352922871347949
O=C(CC[NH+]1CCc2sccc2[C@H]1c1cccc(F)c1)N1CCN(C(=O)Nc2cccc(Cl)c2)CC1,C34830574_decoy,TRY1,Decoy,0,-10.0907,-6.47,-4.09,-6.552730287261383
COc1c2c(cc3c1[C@@H](CC(=O)[C@H]1CC[C@H]4[C@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@@H]5CC[C@]14C)[NH+](C)CC3)OCO2,C33916875_decoy,TRY1,Decoy,0,-9.41786,-8.11,-1.32,-6.54236785753609
CCn1c(SCc2cc(O)oc3c/c(=[NH+]/C(C)=O)ccc2-3)nc2sc3c(c2c1=O)CC[C@@H](C)C3,C21242592_decoy,TRY1,Decoy,0,-8.56113,-9.3,-2.13,-6.229687140910814
COc1c2c(cc3c1[C@@H](CC(=O)C1=CC[C@@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@@]6(C)[C@H]5CC[C@@]14C)[NH+](C)CC3)OCO2,C37238532_decoy,TRY1,Decoy,0,-9.52434,-9.07,-2.0,-6.336375790522106
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3=CC4=[NH+][C@H](C5(C)CC5)C[C@H](C(F)(F)F)N4N3)CC2)cc1,C01332962_decoy,TRY1,Decoy,0,-8.19572,-6.65,-2.72,-7.3711899113256925
COc1ccc([C@H]2C3=C([NH+]=C4N=C(SC)NN42)c2ccccc2O[C@@H]3c2ccc(C)cc2)cc1OC,C02209421_decoy,TRY1,Decoy,0,-7.11121,-0.45,-2.44,-3.2266331372215644
COc1ccc([C@H]2Oc3ccc(Cl)cc3C3=C2[C@@H](c2ccc(OC)cc2)N2NC(SC)=NC2=[NH+]3)cc1,C09461541_decoy,TRY1,Decoy,0,-8.07953,-6.3,-1.3,-5.391483526841563
COc1ccc([C@H]2C3=C([NH+]=C4N=C(SC)NN42)c2cc(Cl)ccc2O[C@@H]3c2ccc(OC)cc2)cc1,C09461543_decoy,TRY1,Decoy,0,-7.37648,-5.84,-2.03,-5.544869698287515
CC[NH+]1CCN(Cc2c(O)cc(C)c3c2O/C(=C\c2cc4cc(Br)ccc4o2)C3=O)CC1,C22935605_decoy,TRY1,Decoy,0,-10.1216,-6.0,-3.86,-5.635227242904968
O=C1[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@H](c3cccc([N+](=O)[O-])c3)N2C(=O)CN1CCc1c[nH]c2ccccc12,C38971400_decoy,TRY1,Decoy,0,-7.32876,-8.19,-2.04,-7.596873887750435
Cc1ccc(N2C(=O)[C@H]3[C@H]4CCC[NH+]4[C@@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@H]3C2=O)c(Br)c1,C02451941_decoy,TRY1,Decoy,0,-8.59191,-7.22,-0.73,-4.852230632750566
COc1c2c(cc3c1[C@@H](CC(=O)C1=CC[C@@H]4[C@H]5CC[C@@H]6C[C@H](O)CC[C@@]6(C)[C@H]5CC[C@@]14C)[NH+](C)CC3)OCO2,C43737044_decoy,TRY1,Decoy,0,-9.32931,-6.05,-3.07,-6.131671333257468
Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2\C(=[NH2+])N3N=C(C45CC6CC(CC(C6)C4)C5)SC3=NC2=O)o1,C20238975_decoy,TRY1,Decoy,0,-9.6958,-6.77,-3.34,-5.789598982261047
Cc1cc(O)c(C[NH+]2CCCC[C@@H]2C)c2c1C(=O)/C(=C/c1cc(Br)cc3c1OCOC3)O2,C41511520_decoy,TRY1,Decoy,0,-9.56372,-5.9,-0.96,-5.091155675470022
O=c1cc(-c2cc3ccccc3oc2=O)c2ccc(O)c(C[NH+]3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2o1,C41584796_decoy,TRY1,Decoy,0,-6.40755,-7.81,-3.97,-5.031067133165007
Cc1ccsc1/C=C1\Oc2c(C[NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)c(O)cc(C)c2C1=O,C41585005_decoy,TRY1,Decoy,0,-8.74862,-6.43,-0.88,-5.091918236184966
O=C1/C(=C/c2cc(Cl)cc3c2OCOC3)Oc2c1ccc(O)c2CN1CCN(c2cccc[nH+]2)CC1,C41585917_decoy,TRY1,Decoy,0,-8.82511,-7.12,-3.43,-5.919940764508969
O=C(c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc(F)cc1)N2)N1CC[NH+](C23CC4CC(CC(C4)C2)C3)CC1,C15319717_decoy,TRY1,Decoy,0,-7.91368,-7.14,-5.29,-6.423528886485166
CCOc1cc(/C=N/N2CC(=O)N3[C@H](c4ccccc4)[C@@H]4[NH+]=c5ccccc5=C4C[C@H]3C2=O)ccc1O,C63351545_decoy,TRY1,Decoy,0,-9.02942,-7.26,-2.16,-8.486171219662102
C=CCNC(=O)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@@H](c3ccc(F)cc3)N2C1=O,C63376068_decoy,TRY1,Decoy,0,-8.31539,-6.2,-1.12,-6.568690421759742
O=C1[C@@H](CC2=c3ccccc3=[NH+]C2)N=C2c3ccccc3N=C(SCC3=CC(=O)N4C=CC=C[C@@H]4N3)N12,C63707950_decoy,TRY1,Decoy,0,-8.96759,-8.8,-1.27,-7.615152225982612
Cc1nc2ccc(N[C@H]3[NH+]=c4ccccc4=N/C3=N\S(=O)(=O)c3ccc4c(c3)OCCO4)cc2s1,C38998995_decoy,TRY1,Decoy,0,-9.6721,-9.16,-2.43,-7.180417343644713
COc1ccc([C@H]2c3cccn3-c3sc4c(c3CN2C(=O)Nc2cc(C)ccc2C)CC[NH+](C)C4)cc1,C35427141_decoy,TRY1,Decoy,0,-10.0437,-6.29,-2.55,-6.298017169089482
COc1ccc([C@@H]2c3cccn3-c3sc4c(c3CN2C(=O)Nc2cc(C)ccc2OC)CC[NH+](C)C4)cc1,C35427186_decoy,TRY1,Decoy,0,-7.29908,-5.83,-1.46,-5.737905862078271
COc1cccc([C@@H]2c3cccn3-c3sc4c(c3CN2C(=O)Nc2cc(C)ccc2OC)CC[NH+](C)C4)c1,C35427338_decoy,TRY1,Decoy,0,-7.24443,-5.89,-3.91,-5.198451474533204
CCCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c(=O)[nH]c1=S,C03985165_decoy,TRY1,Decoy,0,-7.2895,-7.1,-5.66,-2.030417740777106
CCCCCCn1c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(=O)[nH]c1=S,C04087123_decoy,TRY1,Decoy,0,-8.41715,-7.15,-1.88,-6.3972708823497815
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@@H]1c1ccc(O)cc1)c1ccc(Cl)cc1,C04635150_decoy,TRY1,Decoy,0,-9.00481,-5.31,-1.41,-6.178170226161543
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)c3cccs3)c2C(N)=O)C1,C04950525_decoy,TRY1,Decoy,0,-9.68186,-5.89,-3.41,-6.109933792472327
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O,C05202210_decoy,TRY1,Decoy,0,-8.29542,-7.48,-3.6,-5.207148066747878
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C05469936_decoy,TRY1,Decoy,0,-7.58238,-6.86,-2.87,-7.363564313017969
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCN(c2ccc(O)cc2)CC1,C08143643_decoy,TRY1,Decoy,0,-10.3464,-8.09,-2.45,-6.636854100213914
CN(C)c1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C08254677_decoy,TRY1,Decoy,0,-10.0507,-6.71,-1.91,-7.229917760591012
C[NH+](C)CCNC(=O)[C@@H]1C[C@@H](O)[C@H](O)[C@@H]2NC(=S)N(c3ccc(Cl)cc3)[C@@H]21,C08636322_decoy,TRY1,Decoy,0,-8.14327,-7.07,-3.12,-7.738334423793674
O=c1c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c(O)nc(O)n1CCC1=CCCCC1,C08742613_decoy,TRY1,Decoy,0,-8.47621,-7.4,-3.2,-6.574192023042463
CC1(C)CC(NC(=O)CNC(=O)Cc2n[nH]c(=O)c3ccccc23)CC(C)(C)[NH2+]1,C09576746_decoy,TRY1,Decoy,0,-7.31295,-6.26,-2.93,-4.973273033128383
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2c(C)cccc21,C12902417_decoy,TRY1,Decoy,0,-7.34573,-6.88,-1.32,-7.035500044205762
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)nc(O)n(-c2ccc(C)c(Cl)c2)c1=O,C09329902_decoy,TRY1,Decoy,0,-8.88292,-8.02,-1.65,-8.339436592194515
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)nc(O)n(-c2ccc(Br)cc2)c1=O,C09331999_decoy,TRY1,Decoy,0,-10.1238,-8.18,-2.03,-7.747013481109136
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CC=C(c2ccc(O)cc2)CC1,C25680380_decoy,TRY1,Decoy,0,-9.97275,-8.73,-1.6,-6.650403642709835
CC(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)C)[C@H]1CCCC[C@H]1C,C31469419_decoy,TRY1,Decoy,0,-7.94912,-7.23,-1.88,-8.111991164251712
CC[NH+]1CCc2c(sc(NC(=O)Nc3ccsc3C(=O)OC)c2C(N)=O)C1,C32579205_decoy,TRY1,Decoy,0,-9.1083,-5.53,-1.26,-5.597367270056669
NNc1nc(NN)c2c([nH+]1)CC1=C2C[C@H](c2ccccc2)S[C@@H]1c1ccccc1,C34789438_decoy,TRY1,Decoy,0,-8.05104,-8.83,-1.26,-11.611389017857205
Cc1ccc(CNc2[nH+]c3c(n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)N[C@H](N)NC3=O)cc1,C36281915_decoy,TRY1,Decoy,0,-8.58772,-8.11,-1.53,-8.944547022485665
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C03978028_decoy,TRY1,Decoy,0,-8.2933,-5.52,-4.75,-5.19770540191405
CC1=C(c2ccc3c(c2)OCCO3)[C@H](c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2O)[NH+]=N1,C38545705_decoy,TRY1,Decoy,0,-8.27269,-6.82,-2.29,-5.603354557475546
C=CC[NH+]1[C@H](SCC(=O)Nc2nnc(CC)s2)NN[C@H]1c1ccccc1O,C39021589_decoy,TRY1,Decoy,0,-8.15409,-5.29,-2.34,-6.090512756239955
C[C@H](O)CNC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[NH+]3C[C@@H]2CC[C@@H]1O,C39228605_decoy,TRY1,Decoy,0,-7.79842,-6.8,-1.41,-5.213973735751349
CCOC(=O)[C@@H]1NN[NH+](Cc2ccc(C)cc2)[C@@H]1NC(=O)CSc1nc[nH]n1,C39290208_decoy,TRY1,Decoy,0,-6.96891,-5.37,-0.9,-5.138430763890216
CCCCc1nc2c(o1)NC([NH3+])=C(C#N)[C@@]21C(=O)Nc2ccc(Br)cc21,C39323857_decoy,TRY1,Decoy,0,-7.98622,-6.98,-2.83,-4.803442605689038
CC[NH+]1CCN(C(=O)c2sc3nc(N)c(C#N)c(-c4ccccc4)c3c2N)CC1,C39426795_decoy,TRY1,Decoy,0,-6.00379,-6.86,-1.4,-5.110084354223228
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@@H](c2cc(C)on2)ON1,C39656093_decoy,TRY1,Decoy,0,-9.63725,-6.88,-0.9,-7.286799387896298
CC1(C)C[C@@H]2C[C@@](C)(CN2c2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)C1,C40734847_decoy,TRY1,Decoy,0,-8.19372,-6.12,-1.28,-4.780509059577007
Cc1cccnc1Nc1[nH+]cnc(Nc2ncc(C(F)(F)F)cc2Cl)c1N,C40758240_decoy,TRY1,Decoy,0,-7.9615,-8.0,-2.8,-6.007538549421118
C[C@@H](O)[C@@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44019214_decoy,TRY1,Decoy,0,-8.31175,-8.02,-1.92,-5.728409948342721
NC(=O)C[C@@H]([NH3+])c1c(Sc2n[nH]nc2-c2ccccc2)nc2ccccn2c1=O,C44255311_decoy,TRY1,Decoy,0,-6.51962,-5.72,-2.55,-4.875417414764961
COc1cc(C)c2c(c1C[C@@H](C)[NH3+])Oc1c(c(C)c(O)c3c1[C@H](O)OC3=O)OC2=O,C44463413_decoy,TRY1,Decoy,0,-6.79957,-6.29,-0.19,-4.937820207889033
CCOc1ccc(Nc2c(C)c(N[C@H]3CCCC[C@H]3[NH3+])c(C#N)c3ccnn23)cc1,C45254996_decoy,TRY1,Decoy,0,-9.69008,-6.14,-2.89,-6.19944109886731
CNc1ccc([C@@H]2[NH+]=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)cc1[N+](=O)[O-],C45447324_decoy,TRY1,Decoy,0,-8.75482,-5.98,-2.01,-4.741528447574964
CC(C)N1C(=O)/C(=C\Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@H]2C[NH+](C)CCN32)C(=O)NC1=S,C18101481_decoy,TRY1,Decoy,0,-7.93549,-9.32,-2.19,-6.021974449211752
C[C@@H]1CC(=O)N2[C@H](NC(NCCc3c[nH]c4ccccc34)=[NH+][C@@H]2c2ccccc2)N1,C39357301_decoy,TRY1,Decoy,0,-8.26232,-6.24,-3.28,-4.79177979753887
Cc1ccc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c(Cl)c1,C14156520_decoy,TRY1,Decoy,0,-10.7904,-8.4,-2.03,-12.150100309070234
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1,C59888292_decoy,TRY1,Decoy,0,-10.7376,-7.53,-2.26,-7.885537510830427
CC(=O)Nc1ccc(OC[C@H]2NO[C@H](C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)N2)cc1,C63781940_decoy,TRY1,Decoy,0,-11.1557,-8.37,-2.64,-8.203127665956012
COc1ccccc1NC(=O)C[C@@H]1NO[C@@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)N1,C63818746_decoy,TRY1,Decoy,0,-8.51313,-8.41,-1.48,-7.099694873893179
NC(=O)CS[C@H]1NN[C@@H](N2CCN(C(=O)CC3=c4ccccc4=[NH+]C3)CC2)S1,C64409695_decoy,TRY1,Decoy,0,-7.12783,-5.84,-2.35,-5.217648536163996
Cc1cccc2c1c(/N=[NH+]/C(N)=S)c(O)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C36231209_decoy,TRY1,Decoy,0,-8.13125,-5.72,-1.37,-6.120894715478291
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1NNS[C@@H]1NC(=O)N1CCOCC1,C65330192_decoy,TRY1,Decoy,0,-7.39877,-7.58,-1.72,-5.53562096562297
[NH3+]CCSC[C@@H]1O[C@@H](n2cnc3c(NCc4ccc([N+](=O)[O-])cc4)ncnc32)[C@H](O)[C@@H]1O,C34369787_decoy,TRY1,Decoy,0,-7.65168,-7.71,-3.35,-6.22193436303041
Cc1cc2c(cc1Cl)nc1c(=O)[nH]c(=O)nc-1n2C[C@H](O)[C@H](O)[C@H](O)CO,C02004116_decoy,TRY1,Decoy,0,-7.81189,-5.68,-1.31,-5.87544246068653
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1Cl,C04430211_decoy,TRY1,Decoy,0,-7.9842,-5.26,-2.21,-4.902304576380217
Cn1cnc([N+](=O)[O-])c1Sc1nc(N)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C04430698_decoy,TRY1,Decoy,0,-5.73272,-6.44,-1.78,-4.593874974895531
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C06143339_decoy,TRY1,Decoy,0,-5.75892,-7.32,-3.73,-5.060311477908047
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C06143340_decoy,TRY1,Decoy,0,-7.34435,-7.11,-0.79,-7.063744505086182
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C06143341_decoy,TRY1,Decoy,0,-6.06832,-7.4,-0.94,-6.399186929755962
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C06143342_decoy,TRY1,Decoy,0,-6.70011,-6.98,-2.84,-5.4822284734627145
Nc1ncnc2c1nc(NN=C1C(=O)NC(=O)NC1=O)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636786_decoy,TRY1,Decoy,0,-6.60686,-8.18,-1.38,-7.694777948352169
C/C(=C\CNc1ncnc2c1ncn2[C@]1(C)O[C@](C)(CO)[C@@](C)(O)[C@@]1(C)O)CO,C09915813_decoy,TRY1,Decoy,0,-8.24159,-6.85,-3.28,-5.813659790383269
Nc1ncnc2c1nc(NN=C1C(=O)NC(=O)NC1=O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975170_decoy,TRY1,Decoy,0,-7.05869,-7.48,-0.69,-6.767725213509692
Nc1ncnc2c1nc(NN=C1C(=O)NC(=O)NC1=O)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975171_decoy,TRY1,Decoy,0,-7.32991,-8.21,-0.86,-7.083872496041748
Nc1ncnc2c1nc(NN=C1C(=O)NC(=O)NC1=O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975172_decoy,TRY1,Decoy,0,-7.98281,-8.24,-2.38,-7.456600685595931
Nc1ncnc2c1nc(NN=C1C(=O)NC(=O)NC1=O)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975173_decoy,TRY1,Decoy,0,-8.0869,-8.28,-0.77,-8.26530336454708
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C12082299_decoy,TRY1,Decoy,0,-6.76239,-7.13,-2.19,-5.331892003568305
CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C12082301_decoy,TRY1,Decoy,0,-7.06329,-7.39,-1.62,-5.958248798407939
Nn1c(CSc2nnc3n(N)cnn23)nnc1CSc1nnc2n(N)cnn12,C12360725_decoy,TRY1,Decoy,0,-9.05867,-8.65,-2.04,-11.277534203023205
O=c1[nH]nc(Sc2ncnc3c2ncn3[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C06447031_decoy,TRY1,Decoy,0,-7.16412,-6.79,-1.07,-6.380508703608212
O=c1[nH]nc(Sc2ncnc3c2ncn3[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C06447033_decoy,TRY1,Decoy,0,-7.68634,-7.0,-1.58,-6.91575218856196
O=c1[nH]nc(Sc2ncnc3c2ncn3[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C06447035_decoy,TRY1,Decoy,0,-6.16968,-6.69,-1.76,-4.591305996159078
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1N(C)C,C02558223_decoy,TRY1,Decoy,0,-7.29702,-5.33,-2.01,-5.433549465205723
CSc1nc(SC)c2c3c(N)ncnc3n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04774172_decoy,TRY1,Decoy,0,-5.79296,-6.35,-2.27,-5.013951766566133
CSc1nc(SC)c2c3c(N)ncnc3n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04774173_decoy,TRY1,Decoy,0,-6.44225,-4.91,-3.04,-3.834056886275389
O=c1[nH]c(=O)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2[nH]c(=O)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c12,C13425008_decoy,TRY1,Decoy,0,-4.99775,-7.51,-1.82,-6.339428960722739
O=c1[nH]c(=O)n([C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c2[nH]c(=O)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c12,C13425011_decoy,TRY1,Decoy,0,-5.85697,-7.11,-1.69,-5.199634301878253
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2cc1N(C)C,C13518574_decoy,TRY1,Decoy,0,-7.03843,-5.62,-3.32,-5.523702831441774
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@@H](O)CO)c2cc1N(C)C,C13522081_decoy,TRY1,Decoy,0,-6.99784,-5.79,-1.71,-5.593676540873307
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@@H](O)CO)c2cc1N(C)C,C13522086_decoy,TRY1,Decoy,0,-6.78847,-5.0,-1.39,-4.323727892372438
COc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,C16215955_decoy,TRY1,Decoy,0,-7.83812,-6.02,-1.93,-5.225385695089562
CC(C)(C)N/N=C(\C(=O)Nc1nc(=S)[nH][nH]1)[C@@H]1C(=O)Nc2ccccc2[S@@+]1[O-],C16957760_decoy,TRY1,Decoy,0,-8.19249,-5.81,-0.82,-6.029559672574396
[NH2+]=c1ccn([C@H]2O[C@@H](CO[P@@](=O)([O-])Oc3ccccc3)[C@H](O)[C@H]2O)c(=O)[nH]1,C17027397_decoy,TRY1,Decoy,0,-7.29489,-8.04,-1.66,-7.375937009375553
Cn1cnc([N+](=O)[O-])c1Sc1nc(N)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C17301336_decoy,TRY1,Decoy,0,-6.84816,-5.17,-2.04,-5.06304825977827
Cn1cnc([N+](=O)[O-])c1Sc1nc(N)nc2c1ncn2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C17301338_decoy,TRY1,Decoy,0,-5.65478,-5.28,-2.07,-4.08964018461166
CC1(C)C2([N+](=O)[O-])CN3CC1([N+](=O)[O-])CN(C2)C3[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C19330117_decoy,TRY1,Decoy,0,-6.95375,-5.41,-3.51,-5.185299921454336
CC1(C)C2([N+](=O)[O-])CN3CC1([N+](=O)[O-])CN(C2)C3[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C19330120_decoy,TRY1,Decoy,0,-7.38372,-5.32,-2.62,-6.037566671709002
O=[N+]([O-])c1ccccc1O[C@@H]1OC[C@@H](O[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,C22065214_decoy,TRY1,Decoy,0,-3.79127,-5.84,-1.58,-4.428265197613037
O=[N+]([O-])c1ccccc1O[C@@H]1OC[C@@H](O[C@@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,C22065217_decoy,TRY1,Decoy,0,-4.39624,-8.4,-1.79,-5.875971482919071
CC(=O)Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2oc(CO)cc(=O)c12,C31167042_decoy,TRY1,Decoy,0,-7.13876,-7.45,-1.44,-6.769060037794719
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)CO)c2cc1N(C)C,C35050967_decoy,TRY1,Decoy,0,-6.75939,-5.09,-1.77,-4.707294261295055
Cc1cc2cc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@H](O)CO)c2cc1N(C)C,C35050969_decoy,TRY1,Decoy,0,-6.42299,-5.54,-1.76,-4.618164162347271
Nc1nc2c(nc(N/N=C/c3ccc([N+](=O)[O-])o3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35183234_decoy,TRY1,Decoy,0,-7.0007,-9.26,-2.94,-7.3999129972349795
O=[N+]([O-])c1ccccc1O[C@H]1OC[C@@H](O[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C35645806_decoy,TRY1,Decoy,0,-4.97183,-5.26,-2.04,-4.019386297348285
O=[N+]([O-])c1ccccc1O[C@H]1OC[C@@H](O[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C35645813_decoy,TRY1,Decoy,0,-3.67623,-5.08,-3.12,-3.372372230637688
O=[N+]([O-])c1ccccc1O[C@@H]1OC[C@@H](O[C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C35645816_decoy,TRY1,Decoy,0,-4.74708,-5.16,-2.01,-4.152786224488173
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1N(C)C,C35653106_decoy,TRY1,Decoy,0,-6.74778,-4.62,-1.36,-5.003098764622046
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@H](O)CO)c2cc1N(C)C,C35653108_decoy,TRY1,Decoy,0,-7.48015,-5.36,-3.31,-5.453605752851487
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)CO)c2cc1N(C)C,C35653110_decoy,TRY1,Decoy,0,-6.64095,-5.62,-1.95,-4.89992595168016
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@H](O)CO)c2cc1N(C)C,C35653112_decoy,TRY1,Decoy,0,-6.94716,-6.02,-3.0,-5.804831903207628
COc1cc(-c2c(C)cc(O)cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)oc(=O)c1,C06070013_decoy,TRY1,Decoy,0,-6.87708,-7.03,-1.15,-5.268822718836573
CC(C)[NH+]1CCN([C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C39776657_decoy,TRY1,Decoy,0,-6.79527,-6.27,-1.5,-5.307952610869188
CC(C)[NH+]1CCN([C@H]2N=C3C(=O)N=C([NH-])N=C3N2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C39776659_decoy,TRY1,Decoy,0,-6.83531,-6.3,-1.41,-4.472227385958508
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCC[NH+](C)C,C04237016_decoy,TRY1,Decoy,0,-9.71429,-6.06,-4.19,-7.135124820281465
CC(=O)Nc1ccc(NC(=O)C[NH2+]CCCNc2ccc([N+](=O)[O-])cc2)cc1,C05631922_decoy,TRY1,Decoy,0,-7.40475,-4.26,-3.38,-4.610871278251298
C[NH+](C)CCCNC(=O)C(=O)Nc1sc2c(c1C(N)=O)CC(C)(C)OC2,C06758102_decoy,TRY1,Decoy,0,-7.97928,-6.91,-1.52,-5.80481473951709
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCC,C08253881_decoy,TRY1,Decoy,0,-8.08694,-5.29,-2.84,-5.163225460643935
COc1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+](C)C)[C@H]3S2)cc1,C08636324_decoy,TRY1,Decoy,0,-8.79399,-6.63,-0.93,-6.708778699065581
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08791067_decoy,TRY1,Decoy,0,-8.79974,-6.0,-1.52,-5.390703542374083
COc1ccc(Nc2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C09193587_decoy,TRY1,Decoy,0,-6.52906,-6.63,-1.13,-6.515400496026508
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](CCC(N)=O)[NH2+][C@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@@H]3C2=O)cc1,C02136479_decoy,TRY1,Decoy,0,-9.3857,-8.25,-2.13,-7.22707784042644
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4c(C)cc(C)cc43)[C@@H]2C1=O,C02138946_decoy,TRY1,Decoy,0,-7.60312,-5.13,-0.89,-5.25431587565012
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C12881872_decoy,TRY1,Decoy,0,-7.86077,-6.67,-1.27,-5.305789091819898
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)NNC(=S)NCCC[NH+](C)C)cc3N2)cc1C,C02793966_decoy,TRY1,Decoy,0,-9.868,-7.25,-3.64,-6.8350724270639605
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(Cl)c3)n2)CC(C)(C)[NH2+]1,C20835072_decoy,TRY1,Decoy,0,-9.41674,-7.32,-1.96,-7.108808696235121
NC(=O)COc1ccc2ccccc2c1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1,C20872809_decoy,TRY1,Decoy,0,-7.23796,-7.2,-1.85,-5.9457951388607615
CCOc1ccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1OCC,C26477096_decoy,TRY1,Decoy,0,-8.09394,-6.83,-1.25,-7.271323674314797
C[C@]12CN3C[C@](c4ccccc4)(C[NH+](C1)[C@H]3[C@](C)(O)[C@](C)(O)[C@](C)(O)[C@](C)(O)CO)C2=O,C26896285_decoy,TRY1,Decoy,0,-7.68592,-6.72,-1.7,-5.953989536256708
Cc1cc(OCCOc2ccc(N)cc2)ccc1N1C(N)=NC(N)=[NH+]C1(C)C,C17040572_decoy,TRY1,Decoy,0,-8.02561,-7.42,-2.63,-5.877158392168354
O=C1OCC(CO)(CO)[NH+]=C1NNc1ccc([N+](=O)[O-])cc1Br,C05445445_decoy,TRY1,Decoy,0,-6.82383,-6.03,-1.8,-4.829584784337919
[H]/N=C1/NC(=[NH2+])NC(C)(C)N1c1cccc(/C=C/C=C/c2cccc([N+](=O)[O-])c2)c1,C17020573_decoy,TRY1,Decoy,0,-9.93915,-8.61,-2.38,-8.780874931922396
Cc1ccc(OC[C@@H](O)C[NH2+][C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1,C36385860_decoy,TRY1,Decoy,0,-7.59723,-7.21,-2.87,-8.638403592414882
COc1ccc(OC)c(Nc2nc(NCCC[NH+](C)C)nc(N)c2[N+](=O)[O-])c1,C09292371_decoy,TRY1,Decoy,0,-7.0965,-6.89,-2.22,-9.36973042678169
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C03830998_decoy,TRY1,Decoy,0,-7.27169,-5.8,-2.28,-5.229309370045264
O=C(Nc1ccc(-c2ccn[nH]2)cc1)[C@H]1CCC[NH+](CC2=C[C@H]3NON[C@@H]3C=C2)C1,C39438441_decoy,TRY1,Decoy,0,-10.4573,-7.21,-2.14,-6.483279088797676
CC1(C)CC(Nc2ncnc(NNc3ccccc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40624403_decoy,TRY1,Decoy,0,-7.49387,-7.85,-2.37,-7.752179428694515
Cc1cc(Nc2[nH+]cnc(Nc3ncc(C(F)(F)F)cc3Cl)c2N)no1,C40681187_decoy,TRY1,Decoy,0,-6.96113,-6.95,-2.14,-5.228241445043163
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OC(C)C,C40744464_decoy,TRY1,Decoy,0,-6.67524,-6.03,-1.25,-4.8361281628842665
Nc1nonc1C(=O)NCC[NH2+]Cc1ccccc1OCc1ccc(F)cc1Cl,C40744482_decoy,TRY1,Decoy,0,-7.37892,-7.35,-1.63,-7.045738401430693
CN(c1ncnc(NNC(=O)c2ccc(Cl)cc2)c1N)C1CC[NH+](C)CC1,C40784480_decoy,TRY1,Decoy,0,-8.95503,-6.79,-1.02,-6.671063409599308
COc1cc(OC)c(Nc2ncnc(NCCCn3cc[nH+]c3)c2N)cc1Cl,C40798608_decoy,TRY1,Decoy,0,-9.1283,-4.85,-4.78,-5.386863562113947
Nc1c(NCCCn2cc[nH+]c2)ncnc1Nc1ccc(OC(F)(F)F)cc1,C40799820_decoy,TRY1,Decoy,0,-7.07497,-4.86,-1.68,-4.566647927023273
C[C@H](C(=O)Nc1ccccc1C(=O)NCc1ccco1)[NH+]1CCC(C(N)=O)CC1,C42286483_decoy,TRY1,Decoy,0,-7.17012,-6.83,-0.61,-7.550993300730584
CC(C)[NH+](CCNC(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C,C42893852_decoy,TRY1,Decoy,0,-7.47009,-5.01,-2.06,-5.267698715895178
Cc1ccccc1NC(=O)NNC(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1,C43137024_decoy,TRY1,Decoy,0,-8.83811,-8.24,-3.82,-7.605869689238153
CC(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)C)C1CCCCC1,C47549508_decoy,TRY1,Decoy,0,-8.51551,-6.86,-2.81,-6.824489245157087
Cc1c(NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cccc1C(N)=O,C48731421_decoy,TRY1,Decoy,0,-8.73124,-8.48,-1.16,-8.551501625671396
O=C(NCCCCn1cc[nH+]c1)NNC(=O)Nc1ccc(Br)cc1,C56745278_decoy,TRY1,Decoy,0,-7.81938,-6.31,-2.03,-6.564907618917265
C[C@H](NC(=O)Nc1ccc(N(C)C)[nH+]c1)c1ccc(NC(=O)NC2CC2)cc1,C48091011_decoy,TRY1,Decoy,0,-8.57427,-7.19,-3.11,-6.749186092951837
CC1=C(NC(=O)C(=O)NCCNC(=O)[C@@H]2C=c3ccccc3=[NH+]2)[C@@H](C)N(C)N1,C63808269_decoy,TRY1,Decoy,0,-6.76843,-6.68,-1.67,-8.537960643938312
CC[NH+](CC)[C@H](CNC(=O)C(=O)Nc1ccccc1CC(N)=O)c1ccco1,C65602348_decoy,TRY1,Decoy,0,-8.41986,-6.32,-3.31,-5.698382953004948
Cc1ccc(C(=O)NNC(=O)Nc2ccccc2N2CC[NH+](C)CC2)c(O)c1,C65816061_decoy,TRY1,Decoy,0,-7.77667,-7.06,-1.45,-5.83873051043562
COc1ccc(Cl)cc1NCCC(=O)NNC(=O)NCCCn1cc[nH+]c1,C65897837_decoy,TRY1,Decoy,0,-8.79886,-6.36,-2.37,-6.180955770944719
CC(C)Cn1c(CCC(N)=O)nn(C[NH+]2CCC[C@H](CCC(N)=O)C2)c1=S,C66080389_decoy,TRY1,Decoy,0,-8.32035,-4.79,-3.09,-5.270018067947949
CS(=O)(=O)c1ccc(NCCN/C(N)=[NH+]/C[C@H]2CCCO2)c([N+](=O)[O-])c1,C66244509_decoy,TRY1,Decoy,0,-7.95977,-6.56,-2.09,-5.51303829638347
NC(=O)C1([NH+]2CCCCC2)CCN(c2ncc(C(=O)NCc3ccccc3F)c(N)n2)CC1,C67336653_decoy,TRY1,Decoy,0,-8.5405,-5.08,-1.48,-5.21223832976987
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)CC1,C67624121_decoy,TRY1,Decoy,0,-10.1519,-6.35,-3.93,-6.524743755068583
CC(=O)c1c(-c2ccco2)c(C#N)c(=S)n([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1-c1ccccc1,C05956249_decoy,TRY1,Decoy,0,-7.02581,-6.74,-4.75,-5.335445697463846
COC(=O)C1=C(N)N(c2ccc(S(N)(=O)=O)cc2)C2=C(C(=O)CC(C)(C)C2)[C@H]1c1cccnc1,C06088323_decoy,TRY1,Decoy,0,-9.97956,-5.68,-3.2,-6.6430023427226805
CC(C)OC(=O)C1=c2s/c(=C\c3ccc(O)cc3)c(=O)n2C(N)=C(C#N)[C@@H]1c1ccc(O)cc1,C08448549_decoy,TRY1,Decoy,0,-9.41918,-5.66,-2.9,-6.795277187780592
CC(C)OC(=O)C1=c2s/c(=C\c3ccc(O)cc3)c(=O)n2C(N)=C(C#N)[C@H]1c1ccc(O)cc1,C08448550_decoy,TRY1,Decoy,0,-8.88032,-8.09,-2.45,-7.527625998650255
O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)[C@](Cc1c[nH]c3ccccc13)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C09187264_decoy,TRY1,Decoy,0,-7.13752,-8.9,-2.41,-7.208533330402437
COc1ccc([C@@H]2C(C#N)=C(N)N(Nc3cc(=O)[nH]nc3-c3ccccc3)C3=C2C(=O)CCC3)cc1,C12420516_decoy,TRY1,Decoy,0,-6.96948,-8.84,-1.79,-7.592881099550242
O=C1NC(=S)NC(=O)C1=CNc1ccc(S(=O)(=O)Nc2ccc(Br)cc2)cc1,C03067182_decoy,TRY1,Decoy,0,-8.17042,-7.81,-3.17,-5.711217937765113
Cc1ccccc1Nc1nc(N)nc(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCCCO4)C2=O)n1,C12552003_decoy,TRY1,Decoy,0,-8.04506,-8.63,-1.42,-6.577122997822307
Cc1c(/N=N/c2ccccc2)c(-c2ccccc2)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(=S)c1C#N,C17252523_decoy,TRY1,Decoy,0,-6.29165,-5.1,-1.53,-4.015489210274484
NC(=O)c1c(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccco2)N3)sc2c1CCCCC2,C18210516_decoy,TRY1,Decoy,0,-10.1941,-6.38,-1.3,-6.493188545100436
O=C1[C@@H]2[C@H](c3ccccc3O)[NH2+][C@@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@H]2C(=O)N1c1ccc(F)cc1,C20533588_decoy,TRY1,Decoy,0,-7.48455,-7.7,-2.08,-6.160112663028984
Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@](Cc2c[nH]c4ccccc24)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)cc1,C20547971_decoy,TRY1,Decoy,0,-6.3527,-8.07,-1.23,-6.050845834876601
Cc1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@](Cc2c[nH]c4ccccc24)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)c1,C20548084_decoy,TRY1,Decoy,0,-7.05012,-8.01,-2.25,-5.71036855620646
COc1c2c(cc3occ(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c13)OCO2,C31161537_decoy,TRY1,Decoy,0,-7.25176,-8.8,-2.8,-5.536111967489957
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(-c2ccc(F)c(Cl)c2)n(C2CCCC2)c1=S,C32594356_decoy,TRY1,Decoy,0,-6.71105,-5.25,-1.67,-4.774397616701057
COc1cc([C@H]2c3cc4c(cc3[C@H](Nc3ccc(N)cc3)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O,C08652876_decoy,TRY1,Decoy,0,-8.58009,-9.92,-2.12,-10.325682575299789
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@@H]1CCCCO1,C35565251_decoy,TRY1,Decoy,0,-9.65368,-6.16,-2.28,-5.681311101131022
C[C@@H](N[C@@H]1N=NC(=O)NC1=O)C(=O)N/N=C/c1cc(Br)cc(Br)c1O,C38811077_decoy,TRY1,Decoy,0,-8.59433,-6.41,-1.8,-6.057381963947704
CC(C)S(=O)(=O)C1=C2Nc3ccccc3C[NH+]2[C@H](C(=O)N(c2ccccc2O)c2ccccc2O)C1,C39545420_decoy,TRY1,Decoy,0,-8.89193,-6.84,-3.09,-6.3050053239001365
COc1ccc(Cl)cc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3cccc(Cl)c3)[nH]c(=O)c21,C40399422_decoy,TRY1,Decoy,0,-9.34713,-7.7,-2.17,-7.201426405168364
O=C1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)c2c(nc(Nc3cc(Cl)cc(Cl)c3)[nH]c2=O)N1,C40399481_decoy,TRY1,Decoy,0,-8.10105,-8.37,-1.54,-8.251691530449163
O=C1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)c2c(nc(Nc3cc(Cl)cc(Cl)c3)[nH]c2=O)N1,C40399482_decoy,TRY1,Decoy,0,-7.7127,-6.9,-1.63,-5.963554458797074
COc1ccc(Nc2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2cccc(Cl)c2Cl)CC(=O)N3)cc1,C40399899_decoy,TRY1,Decoy,0,-8.91773,-6.61,-1.68,-6.102811042106577
C[C@]1(CO)[C@H]2Cc3s/c(=N\S(C)(=O)=O)[nH]c3[C@@H](CC(=O)NC3CCCC3)[C@@]2(C)CC[C@H]1O,C43553380_decoy,TRY1,Decoy,0,-10.2607,-7.5,-3.75,-6.827189468309973
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)N4CCOCC4)nc3[C@@H](CC(=O)NC3CC3)[C@@]2(C)CC[C@H]1O,C43553395_decoy,TRY1,Decoy,0,-10.3787,-6.48,-2.11,-7.002894015144388
CC(C)NC(=O)C[C@@H]1c2nc(NC(=O)N3CCOCC3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553399_decoy,TRY1,Decoy,0,-11.1219,-7.43,-1.28,-7.418525473027314
COc1ccc([C@@H]2CC(=O)C3=C(C2)Nc2[nH]nc(O)c2[C@H]3c2cc([N+](=O)[O-])ccc2O)cc1OC,C18197765_decoy,TRY1,Decoy,0,-6.09497,-6.68,-2.2,-5.142980792553378
COc1ccc(CN2C(=O)[C@@H]3[C@H](CC(N)=O)N[C@@]4(C(=O)Nc5c(C)cc(Cl)cc54)[C@@H]3C2=O)cc1,C20610534_decoy,TRY1,Decoy,0,-6.55319,-5.76,-1.57,-4.958662612052936
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C20611756_decoy,TRY1,Decoy,0,-7.59572,-5.3,-2.79,-5.331708718701973
NC(=O)CC[C@@H]1N[C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]12,C15968835_decoy,TRY1,Decoy,0,-9.4408,-6.75,-2.01,-6.210773810676544
Cc1ccc2c(c1C)NC(=O)[C@]21N[C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C15969359_decoy,TRY1,Decoy,0,-9.59818,-8.98,-2.27,-8.650171137605023
Cc1c(Cl)ccc2c1NC(=O)[C@@]21N[C@@H](CCC(N)=O)[C@H]2C(=O)N([C@H](C)c3ccccc3)C(=O)[C@H]21,C20758448_decoy,TRY1,Decoy,0,-8.23598,-6.81,-1.09,-6.495365174185885
CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccc(OC)c4)c32)cc(Br)c1O,C09160722_decoy,TRY1,Decoy,0,-7.55569,-5.58,-1.53,-5.241694430434472
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](CCC(N)=O)N[C@@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@@H]3C2=O)cc1,C20518360_decoy,TRY1,Decoy,0,-8.54667,-6.12,-1.91,-6.35833421328488
CC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CCC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C20518358_decoy,TRY1,Decoy,0,-8.79989,-6.64,-3.28,-6.266212186058015
Cc1cc(Cl)cc2c1NC(=O)[C@]21N[C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C16010299_decoy,TRY1,Decoy,0,-7.93613,-6.75,-1.16,-5.373391566136
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CC(N)=O)N[C@]3(C(=O)Nc4c3ccc(Cl)c4C)[C@@H]2C1=O,C16012015_decoy,TRY1,Decoy,0,-8.17841,-5.77,-1.13,-5.2303128169976505
CCc1ccc(N2C(=O)[C@@H]3[C@H](CCC(N)=O)N[C@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@@H]3C2=O)cc1,C16012573_decoy,TRY1,Decoy,0,-9.19358,-8.35,-0.47,-6.972449416122844
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2,C16020002_decoy,TRY1,Decoy,0,-8.86205,-9.51,-2.46,-8.60347472151915
NC(=O)C[C@@H]1N[C@]2(C(=O)Nc3ccc(Br)cc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]12,C16022294_decoy,TRY1,Decoy,0,-8.69906,-5.87,-4.45,-5.51118528974925
NC(=O)c1c(NC(=O)c2cnn3c2N[C@H](c2ccco2)C[C@H]3C(F)(F)F)sc2c1CCCC2,C09130321_decoy,TRY1,Decoy,0,-9.30285,-6.47,-0.85,-5.72098950914611
CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(OC)cc4)c32)cc(Br)c1O,C00718457_decoy,TRY1,Decoy,0,-7.03858,-6.42,-3.11,-5.438229603328463
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@H](C)O)N[C@]23C(=O)Nc2ccc(Br)cc23)c1,C13591907_decoy,TRY1,Decoy,0,-8.9429,-5.12,-1.03,-5.107653304285709
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@@H](C)O)N[C@]23C(=O)Nc2ccc(Br)cc23)c1,C57099748_decoy,TRY1,Decoy,0,-9.34469,-5.51,-2.2,-5.7994325312874775
Nc1cc(=O)[nH]c(SCC(=O)Nc2c(Br)cc(Br)cc2[N+](=O)[O-])n1,C33792367_decoy,TRY1,Decoy,0,-7.21102,-7.76,-2.28,-8.07187719364552
O=C1[C@@H]2[C@@H](c3ccccc3O)[NH2+][C@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@H]2C(=O)N1c1ccc(F)cc1,C13554555_decoy,TRY1,Decoy,0,-7.64582,-6.27,-2.27,-4.858594495967003
COc1ccc(CN2C(=O)[C@H]3[C@@H](C2=O)[C@]2(N[C@@H]3CC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C15959136_decoy,TRY1,Decoy,0,-8.5379,-7.69,-0.74,-5.975707342580527
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C15959873_decoy,TRY1,Decoy,0,-9.46773,-6.75,-2.17,-6.647767813613502
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C15959871_decoy,TRY1,Decoy,0,-9.06981,-6.62,-1.36,-6.345518979261086
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(c2ccccc2Br)O1,C38735621_decoy,TRY1,Decoy,0,-8.85787,-7.8,-1.8,-6.712254935405507
Cn1cccc1C(=O)N[C@H]1CCN2C(=O)[C@@H]3C[C@H](n4nnc(C(N)=O)c4C(N)=O)CN3C(=O)[C@H]12,C04221579_decoy,TRY1,Decoy,0,-7.67325,-7.97,-2.72,-6.732069646073596
O=C(CNc1n[nH]c(=O)[nH]c1=O)N/N=C/c1cc(Br)c(O)c(Br)c1,C01800962_decoy,TRY1,Decoy,0,-9.98641,-7.02,-1.27,-6.857304633451221
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@@H](O)[C@H]1O,C04534185_decoy,TRY1,Decoy,0,-5.89164,-5.87,-1.84,-4.708682712656006
CC(=O)N[C@@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@@H](O)[C@H]1O,C01319767_decoy,TRY1,Decoy,0,-7.95888,-6.13,-2.17,-5.462955737504912
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@@H](O)[C@@H]1O,C04534186_decoy,TRY1,Decoy,0,-8.21504,-6.15,-3.29,-5.695950118845669
CC(=O)N[C@@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@@H](O)[C@@H]1O,C04534187_decoy,TRY1,Decoy,0,-7.34998,-6.0,-1.11,-5.210421032195593
O=c1c2cc(Br)ccc2nc(-c2ccccc2)n1NC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C05885443_decoy,TRY1,Decoy,0,-6.93023,-5.95,-0.8,-4.847305873330496
O=c1c2cc(Br)ccc2nc(-c2ccccc2Cl)n1NC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C05885469_decoy,TRY1,Decoy,0,-6.35505,-5.78,-1.76,-4.566288058836241
O=c1c2cc(Br)ccc2nc(-c2ccccc2Cl)n1NC[C@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O,C05885477_decoy,TRY1,Decoy,0,-7.30752,-7.45,-0.98,-5.661662925963886
NS(=O)(=O)c1ccc(Nc2nc3nonc3nc2Nc2ccc(S(N)(=O)=O)cc2)cc1,C02924118_decoy,TRY1,Decoy,0,-7.67256,-6.29,-1.65,-5.593342624735176
CN(C)c1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1,C06135836_decoy,TRY1,Decoy,0,-9.00799,-7.54,-3.26,-8.47929462808835
COCCNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06905076_decoy,TRY1,Decoy,0,-7.16478,-6.55,-1.59,-5.954628132497905
CC(=O)N[C@@]1(C)[C@](C)(Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@@](C)(CO)[C@@](C)(O)[C@@]1(C)O,C09915659_decoy,TRY1,Decoy,0,-5.66326,-6.76,-2.25,-4.481758387567663
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=N/NC(N)=S)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C12656103_decoy,TRY1,Decoy,0,-10.8599,-5.36,-1.36,-6.557312189212175
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)cc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C08740495_decoy,TRY1,Decoy,0,-8.16109,-8.06,-1.32,-8.16061723582478
O=C(O[C@H]1C=C(CO)[C@H]2[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C14858115_decoy,TRY1,Decoy,0,-8.47363,-8.4,-2.57,-6.059173662932693
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@@H]1O,C15020045_decoy,TRY1,Decoy,0,-6.14773,-5.72,-1.97,-5.466682078549501
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@@H](O)[C@H]1O,C15205855_decoy,TRY1,Decoy,0,-6.33286,-6.6,-3.53,-5.0140651627353
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@@H](O)[C@H]1O,C15205857_decoy,TRY1,Decoy,0,-6.88044,-5.58,-1.27,-4.827898946386865
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3cc(Cl)c(Br)cc23)O[C@H](CO)[C@@H](O)[C@H]1O,C15205863_decoy,TRY1,Decoy,0,-8.4124,-5.68,-1.73,-5.2488637039711294
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@H]1O,C15206374_decoy,TRY1,Decoy,0,-7.63653,-5.51,-2.43,-6.02379596191039
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@H](O)[C@H]1O,C15206378_decoy,TRY1,Decoy,0,-6.95904,-6.32,-3.22,-5.001092485392844
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@@H]1O,C22053027_decoy,TRY1,Decoy,0,-7.28896,-5.75,-1.26,-5.262486398410053
CC(=O)N[C@@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@@H]1O,C22053031_decoy,TRY1,Decoy,0,-7.20125,-5.97,-1.75,-5.084315569532145
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@H]1O,C22053036_decoy,TRY1,Decoy,0,-7.8383,-5.78,-2.74,-5.454431640825666
CC(=O)N[C@@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@H](O)[C@H]1O,C22053040_decoy,TRY1,Decoy,0,-6.19251,-5.51,-1.73,-3.632529044173638
Nc1nc2c(nc(Nc3ccc4c(c3)Cc3ccccc3-4)n2[C@@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1,C22055703_decoy,TRY1,Decoy,0,-8.18891,-9.87,-0.44,-7.912869177613229
Nc1nc2c(nc(Nc3ccc4c(c3)Cc3ccccc3-4)n2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1,C22055707_decoy,TRY1,Decoy,0,-7.40215,-8.86,-2.66,-9.059992191832254
Cn1c(NC2=N[C@@H]3C(=O)NC(N)=N[C@H]3N2[C@@H]2C[C@@H](O)[C@@H](CO)O2)nc2ncc(-c3ccccc3)cc21,C22055796_decoy,TRY1,Decoy,0,-8.7404,-10.11,-1.59,-8.53806467458303
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)C2CCCC2)o1,C26146796_decoy,TRY1,Decoy,0,-8.76534,-4.89,-0.62,-5.757692414374274
C[C@@H]1[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)O[C@H](c2ccc(O)cc2)[C@@]1(C)O,C35458965_decoy,TRY1,Decoy,0,-8.00844,-8.85,-4.84,-5.631240194282797
Cc1ccc(CN(C(=O)[C@@H]2CCC(=O)N2)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36601090_decoy,TRY1,Decoy,0,-8.61295,-7.36,-2.79,-9.190944935867565
Nc1nc2c(nc(SCc3ccccc3Br)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C09186941_decoy,TRY1,Decoy,0,-8.96262,-8.51,-3.52,-10.31034107835066
COc1cc([C@H]2Oc3c(O)ccc([C@@H]4Oc5cc(O)cc(O)c5C(=O)[C@H]4O)c3[C@H]2CO)ccc1O,C31159719_decoy,TRY1,Decoy,0,-10.2488,-8.84,-1.74,-8.593846665260171
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4c(C)cccc4C(C)C)N3N)N=N2)cc1,C38995931_decoy,TRY1,Decoy,0,-10.4105,-7.02,-3.54,-7.081781758633006
CC(=O)N[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@H](O)[C@@H]1O,C43505200_decoy,TRY1,Decoy,0,-6.5875,-5.93,-1.77,-4.842057600547582
C[C@@]12CC[C@@H]3[C@H](CC[C@@]4(O)C[C@@H](O)CC[C@@]34/C=N/NC(N)=S)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C43736119_decoy,TRY1,Decoy,0,-9.7394,-7.91,-1.78,-6.563012190386771
CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)[C@@H](O)[C@@H](O)[C@H]1O,C43794446_decoy,TRY1,Decoy,0,-7.72669,-8.07,-2.03,-7.333857507480861
CC(=O)N[C@H]1[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@@H](CO)[C@H](O)[C@@H]1O,C44608286_decoy,TRY1,Decoy,0,-7.75041,-6.65,-1.19,-5.7801147705343086
CC(=O)N[C@H]1[C@@H](Oc2cc3c(Cl)c(Br)ccc3[nH]2)O[C@@H](CO)[C@H](O)[C@@H]1O,C44699204_decoy,TRY1,Decoy,0,-8.45751,-5.65,-3.02,-5.438085205059904
COc1cc(-c2coc3c([C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)ccc3c2=O)ccc1O,C45201953_decoy,TRY1,Decoy,0,-8.65862,-8.09,-2.66,-7.640609237773512
COc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)cc(I)c1O,C09763695_decoy,TRY1,Decoy,0,-8.18068,-6.5,-3.31,-6.280900737659641
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@@H](CC(N)=O)[C@H]3C(=O)N(c4ccc(C(N)=O)cc4)C(=O)[C@H]31)C(=O)N2,C15958453_decoy,TRY1,Decoy,0,-9.23446,-7.51,-2.34,-6.751627367045421
Cc1cc(Cl)c2c(c1)[C@]1(N[C@@H](CC(N)=O)[C@H]3C(=O)N(c4ccc(C(N)=O)cc4)C(=O)[C@H]31)C(=O)N2,C15958452_decoy,TRY1,Decoy,0,-8.27116,-6.83,-2.89,-5.190634018992896
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](CC(N)=O)[C@H]3C(=O)N(c4ccc(C(N)=O)cc4)C(=O)[C@H]31)C(=O)N2,C15958454_decoy,TRY1,Decoy,0,-8.86374,-6.18,-2.06,-5.518805671920612
Nc1nnc(CC(=O)N/N=C/c2cc(Br)c(O)c(Br)c2O)s1,C02898656_decoy,TRY1,Decoy,0,-9.66508,-7.74,-1.75,-8.431768662462533
Nc1nnc(Sc2nc(Sc3nnc(N)s3)nc(Sc3nnc(N)s3)n2)s1,C58930029_decoy,TRY1,Decoy,0,-10.9586,-7.37,-2.01,-10.064197840684432
NC(=O)CSc1n[nH]c(N/N=C/c2cc(Br)cc(Br)c2O)n1,C59017016_decoy,TRY1,Decoy,0,-10.0904,-5.17,-2.08,-6.075596600961196
C/C(O)=N\[C@H]1[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](CO)[C@@H](O)[C@@H]1O,C04283237_decoy,TRY1,Decoy,0,-6.73289,-6.57,-1.16,-4.9553764959398
O=C(NC1CCCCC1)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2n1nnnc1Oc1ccc(-n2ccnc2)cc1,C04147841_decoy,TRY1,Decoy,0,-7.87531,-6.6,-2.02,-5.4033954694770285
Cc1ccccc1OC[C@H](O)Cn1c(NCCCn2ccnc2)nc2c1c(=O)n(C)c(=O)n2C,C01833189_decoy,TRY1,Decoy,0,-8.08252,-7.25,-1.69,-6.822247961433678
O=S1(=O)C[C@@H](O)[C@H](S(=O)(=O)NCCCc2nnc(S(=O)(=O)Cc3ccccc3)o2)C1,C09027044_decoy,TRY1,Decoy,0,-8.06431,-6.56,-3.34,-6.000910737326848
O=S1(=O)C[C@H](O)[C@@H](S(=O)(=O)NC[C@H](c2cccnc2)S(=O)(=O)c2ccc3c(c2)OCO3)C1,C09006799_decoy,TRY1,Decoy,0,-9.67282,-8.77,-3.24,-9.428020222456936
O=C(NC[C@H](c1ccco1)S(=O)(=O)c1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCS(=O)(=O)C1,C09081615_decoy,TRY1,Decoy,0,-8.71648,-8.27,-2.83,-9.928774285484923
Cn1cnc2c1c(=O)n(CC(=O)Nc1nc(-c3ccc4c(c3)CCC(=O)N4)cs1)c(=O)n2C,C09466620_decoy,TRY1,Decoy,0,-9.63489,-7.78,-1.7,-7.74715412600086
O=C(CCc1nnc2ccc(NCCCN3CCCC3=O)nn12)NCc1ccc2c(c1)OCO2,C09746142_decoy,TRY1,Decoy,0,-8.42771,-7.11,-3.28,-5.793780206387662
CCOC(=O)c1c(NC(=O)COC(=O)/C=C/c2c(C)nn(C)c2C)sc(C(=O)NC)c1C,C10439358_decoy,TRY1,Decoy,0,-8.84728,-7.27,-3.98,-7.635567475113747
CCn1c(NNC(=O)[C@H]2CCCN(C3=NS(=O)(=O)c4ccccc43)C2)nc2ccccc2c1=O,C11162302_decoy,TRY1,Decoy,0,-8.89822,-7.55,-3.75,-7.219430622706025
N#CC1=C(N)N(c2cccc([N+](=O)[O-])c2)C2=C(C(=O)CCC2)[C@@H]1c1cc(Cn2cncn2)cs1,C12428892_decoy,TRY1,Decoy,0,-7.98409,-7.37,-2.61,-5.617573349923736
Cc1ccc(NC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1S(=O)(=O)N1CCOCC1,C12529449_decoy,TRY1,Decoy,0,-7.89514,-7.59,-2.28,-6.843017030893491
COc1cc(/C=C/C(=O)O[C@H](C)C(=O)N2CCNC2=O)cc(S(=O)(=O)NCc2ccco2)c1OC,C12620711_decoy,TRY1,Decoy,0,-8.49076,-7.14,-4.26,-6.4379917447972925
COc1cc2cc(CN(CCO)S(=O)(=O)c3cccc4nsnc34)c(=O)[nH]c2cc1OC,C06239404_decoy,TRY1,Decoy,0,-8.83888,-6.32,-2.85,-6.145232122970369
O=C(COC(=O)CSc1nnc(NC2CCCCC2)s1)NCCN1C(=O)CSC1=O,C13109302_decoy,TRY1,Decoy,0,-9.54871,-5.08,-2.83,-5.583375002364368
CC(=O)OC[C@H]1O[C@@H](n2c(Br)nc3c(N)ncnc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C09602064_decoy,TRY1,Decoy,0,-7.30752,-8.08,-2.76,-9.34643686383587
C[C@@H](NC(=O)CN1C(=O)N[C@](C)(c2cccc(-n3cnnn3)c2)C1=O)c1ccc2c(c1)OCO2,C14164209_decoy,TRY1,Decoy,0,-7.4705,-8.82,-2.37,-7.125268784648427
Cc1nc2ccccn2c1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C#N)CC1,C15429773_decoy,TRY1,Decoy,0,-7.4694,-6.11,-4.52,-5.735668018856443
CC(=O)O[C@@H]1[C@@H](OC(C)=O)c2c3c(n(C#N)c2[C@H](OC(C)=O)[C@]1(C)O)C(=O)c1c(O)cccc1C3=O,C16953892_decoy,TRY1,Decoy,0,-6.26497,-7.03,-2.73,-5.322023517783741
CC[C@H](C)N1C(=O)NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C1=O,C09433906_decoy,TRY1,Decoy,0,-8.3656,-8.52,-2.24,-6.69877587953294
CC[C@@H](C)N1C(=O)NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C1=O,C09433905_decoy,TRY1,Decoy,0,-8.35718,-8.7,-2.03,-6.731890056211176
CC[C@]1(C)NC(=O)N(NC(=O)COC(=O)c2ccc3c(c2)S(=O)(=O)c2ccccc2C3=O)C1=O,C19124681_decoy,TRY1,Decoy,0,-8.73582,-8.39,-2.6,-6.129366764846194
COCCOC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCCOC)[C@@H]1c1ccc(NC(C)=O)cc1,C20428532_decoy,TRY1,Decoy,0,-7.63626,-4.79,-3.94,-5.586893660599463
C[C@@H](NC(=O)c1cc2n(n1)C[C@](C)(C(=O)NC1CCCC1)N(C)C2=O)c1ccc2c(c1)OCCO2,C21874486_decoy,TRY1,Decoy,0,-8.75544,-8.51,-2.37,-7.035756983235283
CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1ccc(C)c(N/C=C2\C(=O)N(C)C(=O)C(C#N)=C2C)c1,C22000545_decoy,TRY1,Decoy,0,-7.76284,-8.34,-5.43,-5.705284003196786
C=CCn1c(SCc2nc3ccccc3c(=O)n2CC(N)=O)nnc1[C@@H]1CCS(=O)(=O)C1,C24509166_decoy,TRY1,Decoy,0,-8.13073,-5.53,-2.07,-5.2752554790181225
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)CSc1n[nH]c(/C=C/c2ccc(C)o2)n1,C25609045_decoy,TRY1,Decoy,0,-9.39417,-7.24,-3.35,-6.960172174877831
CCOC(=O)C1=C(Cn2cc(S(=O)(=O)N(CC)CC)ccc2=O)NC(=O)N[C@H]1c1ccco1,C31646276_decoy,TRY1,Decoy,0,-7.6193,-6.24,-3.17,-6.009816415068507
COC(=O)[C@@H](C(=O)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc2cc(C)c(C)cc2[nH]c1=O,C17214006_decoy,TRY1,Decoy,0,-7.96982,-6.26,-3.16,-5.734172151519072
CC(C)OC(=O)C[C@H](NC(=O)C1=NN(c2ccccc2)C(=O)[C@@H](C)N1)c1ccccc1[N+](=O)[O-],C32807747_decoy,TRY1,Decoy,0,-7.34909,-7.74,-4.47,-7.016872020002444
CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1ccc(NC(=O)CSc2nnnn2C)cc1,C22321976_decoy,TRY1,Decoy,0,-8.94889,-7.48,-3.47,-7.021598892733352
Cc1cc(NC(=O)[C@H]2[C@H]3C(=O)N(c4cccnc4)[C@H](C(=O)NC(C)(C)C)[C@@]34C=C[C@]2(C)O4)no1,C33939913_decoy,TRY1,Decoy,0,-8.35712,-7.6,-1.2,-6.311616183694309
COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(CCN4CCOCC4)c(=O)c32)cc(OC)c1OC,C19690932_decoy,TRY1,Decoy,0,-7.765,-5.8,-2.13,-5.980662755362345
Cc1cc(NC(=O)CCC(=O)N(Cc2ccco2)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccncc2)no1,C13150868_decoy,TRY1,Decoy,0,-8.83711,-6.91,-2.16,-6.764325094851707
C=CCN1C(=O)N=C2Oc3ccc([N+](=O)[O-])cc3[C@@H]([C@H]3C(=O)NC(=O)N(CC=C)[C@H]3O)[C@@H]2C1=O,C38701797_decoy,TRY1,Decoy,0,-7.35735,-6.58,-3.0,-5.827163253693501
CC(C)C[C@H]1C(=O)N(CC(=O)N[C@@H]2N=N[C@@H](C)N2)C[C@@H]2N(Cc3cncs3)CCC(=O)N21,C39225696_decoy,TRY1,Decoy,0,-8.8763,-5.84,-2.97,-5.6077805561796525
C[C@H]1CCCN(S(=O)(=O)c2ccc(N(C)CCC[C@H]3N=NC(N)=C3C#N)c([N+](=O)[O-])c2)C1,C39443537_decoy,TRY1,Decoy,0,-7.37766,-7.17,-2.06,-7.335543197898735
N#CCCN(CCC#N)c1ncnc(NNC(=O)C(c2ccccc2)c2ccccc2)c1[N+](=O)[O-],C40618162_decoy,TRY1,Decoy,0,-7.08248,-6.88,-2.04,-6.865658132485321
CCOc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2C=C[C@H]3C2)cc(OCC)c1OCC,C45293984_decoy,TRY1,Decoy,0,-9.0475,-6.27,-3.5,-6.266256771321097
O=C(CCSc1nnc(-c2ccncc2)n1C1CC1)NC(=O)Nc1ccc2c(c1)OCCO2,C45698093_decoy,TRY1,Decoy,0,-9.57509,-7.39,-2.3,-8.521900955241572
O=C(CCSc1nnc([C@@H]2COc3ccccc3O2)o1)NC(=O)Nc1ccc2c(c1)OCCO2,C45868834_decoy,TRY1,Decoy,0,-9.65476,-7.51,-1.91,-7.00943986286108
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O,C46539574_decoy,TRY1,Decoy,0,-8.05924,-8.2,-2.02,-6.928543381864651
COc1cc(-c2cc(C(=O)N3CCC(C(=O)Nc4cc(C)on4)CC3)[nH]n2)cc(OC)c1OC,C49412060_decoy,TRY1,Decoy,0,-8.58576,-7.34,-1.74,-7.180941642244813
COc1c2c(cc3c1[C@H](CN/C=C1\C(=O)NC(=O)N(c4ccc(C)cc4)C1=O)N(C)CC3)OCO2,C20113052_decoy,TRY1,Decoy,0,-6.61175,-8.52,-1.82,-4.997014450541768
CN1CCN(S(=O)(=O)N2CCN(CC(=O)NC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)CC1,C59385281_decoy,TRY1,Decoy,0,-9.19013,-5.5,-1.57,-5.912026375305725
COc1cc(N2C(=O)C[C@@H](c3c(C)[nH]n(-c4nc5ccccc5[nH]4)c3=O)C2=O)cc(OC)c1OC,C13611243_decoy,TRY1,Decoy,0,-7.42362,-7.39,-2.89,-5.542191866387212
COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)ccc1Oc1c(N)n(C)c(=O)n(C)c1=O,C59599122_decoy,TRY1,Decoy,0,-7.31106,-8.65,-2.34,-6.679219169155853
Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3cccc(S(=O)(=O)/N=C4/CCCN4)c3)ccc21,C60266155_decoy,TRY1,Decoy,0,-7.23598,-8.81,-3.0,-8.457319353506543
COC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1nc(C)n(-c2nc(C(F)(F)F)n[n-]2)n1,C63111006_decoy,TRY1,Decoy,0,-7.92395,-6.35,-2.91,-6.226043684010046
COc1cc(C2=NO[C@@H](CCn3c(=O)[nH]c4cc5c(cc4c3=O)OCO5)N2)ccc1OC(C)C,C64438407_decoy,TRY1,Decoy,0,-7.11371,-6.49,-2.13,-4.877666699849056
COc1ccc(NC(=O)c2ncn3c2C(=O)N(C2CC2)[C@](C)(C(=O)NCCCOC(C)C)C3)cc1,C64954665_decoy,TRY1,Decoy,0,-7.97104,-6.05,-4.09,-5.9429530059131
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)/C=C/c3ccc(OC)c(OC)c3)c2C(N)=O)C1,C04177321_decoy,TRY1,Decoy,0,-10.2275,-6.5,-1.24,-6.657658392780058
CC[NH+](CC)CCCN(CC(=O)NC1CCCCC1)C(=O)c1snc(C(N)=O)c1N,C06511134_decoy,TRY1,Decoy,0,-9.50566,-6.98,-1.68,-9.94507747154532
CC(=O)Oc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2([NH2+][C@@H]3CCC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C02136476_decoy,TRY1,Decoy,0,-9.38237,-8.84,-2.06,-9.445489814021409
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)cc1,C08971799_decoy,TRY1,Decoy,0,-8.6086,-6.1,-2.93,-7.229966147082975
CCOC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)cc1,C08971801_decoy,TRY1,Decoy,0,-9.02072,-5.41,-1.75,-5.998025662717805
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)cc1,C08971803_decoy,TRY1,Decoy,0,-8.57842,-6.51,-2.94,-7.3779545804047455
C[C@@H]([NH2+]CC(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccc(S(N)(=O)=O)cc1,C09389487_decoy,TRY1,Decoy,0,-8.6972,-6.44,-1.75,-5.14157762124495
CCOC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)CC[NH+]1CCC(C(N)=O)CC1,C09462802_decoy,TRY1,Decoy,0,-10.2813,-6.88,-4.02,-6.917383097357421
COc1ccc(C(c2c(O)[nH]c(=S)[nH]c2=O)c2c(O)[nH]c(=S)[nH]c2=O)cc1C[NH+]1CCCC1,C09310763_decoy,TRY1,Decoy,0,-9.68823,-5.29,-1.34,-5.8576049737804485
COCCOC(=O)c1c(NC(=O)C[NH2+]Cc2ccccc2Cl)sc(C(N)=O)c1C,C03414760_decoy,TRY1,Decoy,0,-9.11963,-6.77,-0.72,-7.149309149526413
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C12884042_decoy,TRY1,Decoy,0,-8.40101,-5.22,-1.91,-5.587517545456614
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@H](CC(N)=O)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C12884059_decoy,TRY1,Decoy,0,-9.36061,-7.6,-1.35,-7.539674454905593
Cc1nn(-c2ccccc2)c(Oc2ccc(F)cc2)c1C[NH2+]CCCc1n[nH]c(N)c1C#N,C13112549_decoy,TRY1,Decoy,0,-7.5788,-8.28,-1.68,-7.907524120319949
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@H]([C@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)cc1,C13592283_decoy,TRY1,Decoy,0,-7.30512,-6.16,-0.76,-5.544944665108079
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(-n4cccn4)cc3)C[NH+]12,C15707446_decoy,TRY1,Decoy,0,-8.01539,-6.4,-2.04,-5.971830831659056
COc1ccc(NC(=S)N[C@H]2C[C@H]3C(=O)NC[C@@H](CCC(=O)NC4CC4)[NH+]3C2)cc1,C15708351_decoy,TRY1,Decoy,0,-8.2201,-6.33,-1.32,-6.111110451964307
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]([C@@H](C)O)[NH2+][C@@]23C(=O)Nc2ccc(F)cc23)cc1,C15973224_decoy,TRY1,Decoy,0,-8.87983,-6.58,-0.59,-6.397554157270962
COc1cc(NC(=O)NC[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2[NH+](C)CCc2ccccn2)cc(OC)c1,C20465906_decoy,TRY1,Decoy,0,-6.73942,-6.63,-2.6,-6.153669694417541
CCNC(=O)N[C@H]1CC[C@]2(C)CC[C@@H]([C@H](C)C(=O)NCC[NH+]3CCCC3)[C@H](O)[C@H]2[C@@H]1C,C20467330_decoy,TRY1,Decoy,0,-9.20534,-6.43,-2.34,-6.310818785885515
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCCN3CCOCC3)C[NH+]12)NCc1ccc(F)cc1,C15707699_decoy,TRY1,Decoy,0,-9.7294,-7.37,-2.0,-7.393522762198276
CCCCNc1[nH+]c2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCCN1CCOCC1,C20504796_decoy,TRY1,Decoy,0,-11.1559,-6.51,-1.81,-7.378567885500149
Cc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)NNC(=S)NCCC[NH+](C)C)cc3N2)cc1C,C02793965_decoy,TRY1,Decoy,0,-10.1614,-6.68,-3.2,-6.419343656763992
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Br)ccc3O)n2)CC(C)(C)[NH2+]1,C20834599_decoy,TRY1,Decoy,0,-10.443,-6.66,-1.45,-6.2959980300930765
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(C(F)(F)F)cc2)NCCc2c[nH]c[nH+]2)n1,C14156558_decoy,TRY1,Decoy,0,-9.55739,-8.08,-0.55,-8.284445446450633
NC(=O)c1c(NC(=O)CN2CC[NH+](CC(=O)Nc3ccc(F)cc3)CC2)sc2c1CCCC2,C22356570_decoy,TRY1,Decoy,0,-9.53901,-8.22,-2.59,-7.37192912188589
CNc1[nH+]n(CC(=O)Nc2c(C)cc(C)cc2C)c(N)c1-c1nc(-c2cccc(Cl)c2)no1,C23125393_decoy,TRY1,Decoy,0,-8.81328,-7.56,-2.29,-7.579169653898048
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4nc(=O)c5c(C)c(C)sc5[nH]4)CC3)n2)cc1,C22786127_decoy,TRY1,Decoy,0,-8.77781,-7.34,-2.61,-6.375961312134818
CCc1c(C)sc(NC(=O)N2CC[NH+](CC(=O)Nc3ccccc3C)CC2)c1C(N)=O,C34786313_decoy,TRY1,Decoy,0,-8.04111,-7.23,-2.52,-6.359705422256992
CCOC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)cc1,C35828238_decoy,TRY1,Decoy,0,-9.00454,-5.66,-2.71,-5.951455431032103
COc1ccc2c(CCNC(=O)CS[C@@H]3N[NH2+]NN3c3ccccc3OC)c[nH]c2c1,C39022131_decoy,TRY1,Decoy,0,-8.77605,-7.98,-1.07,-6.859394589863808
O=S(=O)(Oc1ccccc1)[C@@H]1CN([C@@H](CNO)c2ccc(-c3ccccc3O)cc2)CC[NH2+]1,C39534193_decoy,TRY1,Decoy,0,-9.35832,-8.19,-3.09,-7.448601382422238
O=S(=O)(Oc1ccccc1)[C@H]1CN([C@@H](CNO)c2ccc(-c3ccccc3O)cc2)CC[NH2+]1,C39534194_decoy,TRY1,Decoy,0,-9.19297,-7.32,-2.09,-6.410622567387644
O=C(NCCc1c[nH]c2ccccc12)[C@H]1C[C@@H]2[NH2+][C@H](c3ccco3)C[C@H](C(F)(F)F)N2N1,C39709606_decoy,TRY1,Decoy,0,-8.37404,-8.38,-2.24,-10.822347242364534
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(-c2ccc(Br)cc2Br)o1,C40744415_decoy,TRY1,Decoy,0,-8.49157,-8.08,-0.66,-6.361926057419416
Cc1cccc(COc2ccc(Br)cc2C[NH2+]CCNC(=O)c2nonc2N)c1,C40744516_decoy,TRY1,Decoy,0,-9.42844,-7.94,-1.44,-8.574493192275675
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCc1ccccc1C,C40744535_decoy,TRY1,Decoy,0,-7.71489,-7.24,-2.95,-6.217040616027712
C[C@H]1NN(c2ccccc2)[C@@H](Cl)[C@H]1[C@H]1[NH2+][C@@H](C(=O)[O-])[C@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@H]12,C33933375_decoy,TRY1,Decoy,0,-6.73471,-8.0,-1.65,-6.251394893527222
C[C@H]1NN(c2ccccc2)[C@@H](Cl)[C@@H]1[C@H]1[NH2+][C@@H](C(=O)[O-])[C@H]2C(=O)N(CC[NH2+]Cc3ccccc3)C(=O)[C@H]12,C33933379_decoy,TRY1,Decoy,0,-7.05675,-7.45,-2.4,-6.017886221774841
Cc1c(C(N)=O)cc(-c2ccc3c(c2)OCCCO3)n1[C@@H](Cc1ccc(O)cc1)C(=O)NCC[NH+](C)C,C43225879_decoy,TRY1,Decoy,0,-9.42099,-7.8,-3.02,-8.722132925493549
C[NH+](CC(=O)Nc1ccc(Cl)c(Cl)c1)CC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C45605903_decoy,TRY1,Decoy,0,-8.14777,-7.21,-2.44,-5.928943713631245
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+](C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C14923177_decoy,TRY1,Decoy,0,-7.67089,-8.1,-1.95,-5.764923276088047
NC(=O)C1CC[NH+](CC(=O)Nc2sc3c(c2C(=O)Nc2ccc(Cl)cc2)CCCC3)CC1,C21847244_decoy,TRY1,Decoy,0,-10.1717,-7.06,-2.27,-7.645686982780654
CCc1ccccc1NC(=S)N/C(=N/c1nc(C)cc(C)n1)N1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C14161199_decoy,TRY1,Decoy,0,-8.57305,-7.28,-2.43,-6.078722798905565
C=CCn1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cn1,C59832361_decoy,TRY1,Decoy,0,-9.51832,-7.13,-1.41,-6.855204435502052
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)n2)cc1,C09716793_decoy,TRY1,Decoy,0,-7.71067,-7.11,-1.99,-6.1576062213682725
CCOc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(C(F)(F)F)c4)CC3)n2)cc1,C09971242_decoy,TRY1,Decoy,0,-8.21152,-7.29,-2.13,-6.213371694430864
CC[NH+](CC(=O)Nc1c(Cl)cccc1Cl)CC(=O)Nc1oc(C)c2c(C)n[nH]c(=O)c12,C10927912_decoy,TRY1,Decoy,0,-8.20293,-7.86,-2.77,-7.862156216563783
CCOC(=O)C1=C(C[NH2+]CC23CC4CC(CC(C4)C2)C3)NC(=O)N[C@H]1c1ccc2c(c1)OCO2,C12412580_decoy,TRY1,Decoy,0,-9.10288,-6.38,-3.4,-6.172467304021762
CC[C@@H]([NH2+]C1CCN(c2ccc(NS(=O)(=O)N(C)C)cc2)CC1)c1nc2cc(C)ccc2[nH]1,C11912024_decoy,TRY1,Decoy,0,-9.64376,-6.77,-2.91,-5.84641075646101
CC[C@H]([NH2+]C1CCN(c2ccc(NS(=O)(=O)N(C)C)cc2)CC1)c1nc2cc(C)ccc2[nH]1,C11912025_decoy,TRY1,Decoy,0,-9.7914,-8.21,-1.23,-7.680613182141085
CCc1nc2cc(N)cc(C(=O)NC[C@@H](c3ccc(F)cc3)[NH+]3CCCC3)c2n1CCCOC,C12246171_decoy,TRY1,Decoy,0,-8.81472,-7.05,-2.84,-6.361899046190356
CCC(C)(C)NC(=O)C[NH+](CC(=O)Nc1c(C)cccc1C)CC(=O)Nc1c(C)cccc1C,C15418806_decoy,TRY1,Decoy,0,-8.41554,-6.36,-2.18,-7.978188703101336
CCc1cc(C(=O)OC)c(NC(=S)NNC(=O)C2CC[NH+](Cc3ccc(F)cc3Cl)CC2)s1,C16346901_decoy,TRY1,Decoy,0,-9.86306,-6.61,-3.58,-6.257088061638349
Cc1cc(C)c(NC(=O)CNC(=O)C[NH+](C)CC(=O)Nc2c(Cl)cccc2Cl)c(C)c1,C16635994_decoy,TRY1,Decoy,0,-7.4864,-7.3,-1.42,-5.9824409710041095
C/C(=N\NC(N)=S)[C@H](C[NH+]1CCOCC1)[C@H](c1ccccc1)[C@@H]1COc2ccccc2C1=O,C16958089_decoy,TRY1,Decoy,0,-8.89364,-5.58,-1.96,-6.138085064236319
CC[NH+](CC)CCCNC(=O)[C@@]1(O)c2ccccc2NC(=O)N1c1ccc(Cl)c(Cl)c1,C03665836_decoy,TRY1,Decoy,0,-9.72337,-5.71,-2.07,-10.258350409604724
COCCNC(=O)[C@@H](C)[C@H]1CC[C@@]2(C)Cc3s/c(=N\C(=O)C[NH+](C)C)[nH]c3[C@@H](C)[C@@H]2[C@H]1O,C20504573_decoy,TRY1,Decoy,0,-7.70208,-5.57,-2.92,-5.107107626067654
Cc1ccccc1NCc1nnc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1-c1ccccc1,C20831419_decoy,TRY1,Decoy,0,-8.03795,-6.79,-2.47,-7.534452236356209
CC[C@H](CO)[NH2+]Cc1cc(Br)c(OC[C@@H](O)c2ccc3c(c2)OCO3)c(OC)c1,C20877007_decoy,TRY1,Decoy,0,-9.72169,-6.68,-2.51,-6.984315746731294
O=C(C[NH2+]Cc1ccco1)Nc1sc2c(c1C(=O)Nc1ccc(Br)cc1)CCC2,C01160430_decoy,TRY1,Decoy,0,-10.2588,-6.57,-0.81,-8.325788238110578
Cc1ccc([C@](O)(CCNC(=O)NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)C(F)(F)F)o1,C23143516_decoy,TRY1,Decoy,0,-8.55596,-7.81,-1.66,-5.755127825948315
O=C(NCCN1CC[NH2+]CC1)/C(=C/c1ccc(Cl)cc1Cl)NC(=O)c1ccc(Cl)cc1Cl,C26805795_decoy,TRY1,Decoy,0,-11.3884,-5.28,-2.35,-6.65262311477844
Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cccc(NCCN3CCOCC3)[nH+]2)s1,C28394020_decoy,TRY1,Decoy,0,-10.6241,-7.62,-2.79,-7.902496855855935
C=CCNc1nnc(SCC(=O)Nc2sc3c(c2C(=O)OCC)CC(C)(C)[NH2+]C3(C)C)s1,C32847369_decoy,TRY1,Decoy,0,-9.85338,-5.29,-2.64,-6.204744428245391
Cc1ccc2c(c1)=C(NNC(=O)/C(=C/c1ccc(N(C)C)cc1)NC(=O)c1ccccc1)C(=O)[NH+]=2,C08427239_decoy,TRY1,Decoy,0,-8.47705,-8.29,-1.58,-7.339138782831717
CC[NH+](CC)CCNC(=O)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)ccc1N(C)C,C35210317_decoy,TRY1,Decoy,0,-9.72183,-5.13,-3.26,-6.0811722041107625
CC[NH+](CC)CCNC(=O)c1cc(NC(=O)Nc2ccc(Cl)cc2Cl)ccc1N(C)C,C35210318_decoy,TRY1,Decoy,0,-9.21229,-6.99,-1.72,-7.724379293137469
O=C1[NH+]=c2ccccc2=C1NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1,C12570212_decoy,TRY1,Decoy,0,-8.66462,-8.14,-3.07,-10.500062209000768
COc1cc(C(=O)Oc2ccc([C@@H]3[NH+]=C(N)N=C4Nc5ccccc5N43)cc2)cc(OC)c1OC,C12651789_decoy,TRY1,Decoy,0,-6.78003,-6.44,-2.83,-5.871890046340594
O=C1[NH+]=c2ccccc2=C1NNc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-],C20928029_decoy,TRY1,Decoy,0,-7.08641,-7.54,-1.83,-6.457534190580748
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@H]1C=C(c2cccc(OCc3ccc(Cl)cc3)c2)NN1,C38999241_decoy,TRY1,Decoy,0,-10.0302,-7.17,-1.72,-6.150495604257301
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C=C(c2cccc(OCc3ccccc3Cl)c2)NN1,C39000322_decoy,TRY1,Decoy,0,-9.28904,-8.66,-2.9,-8.804644459354925
Cc1ccc([C@@H](C[N-]S(=O)(=O)Oc2ccccc2)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39531585_decoy,TRY1,Decoy,0,-9.27883,-8.26,-2.0,-7.38633215392909
Cc1ccc([C@H](C[N-]S(=O)(=O)Oc2ccccc2)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39531588_decoy,TRY1,Decoy,0,-8.58948,-8.13,-2.41,-8.074034673210198
O=S(=O)(Oc1ccccc1)[C@H]1CN([C@@H](CNF)c2ccc(-c3ccccc3O)cc2)CC[NH2+]1,C39534196_decoy,TRY1,Decoy,0,-8.58838,-6.41,-5.02,-5.447116287605304
O=S(=O)(Oc1ccccc1)c1ccc([C@H](CNF)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534242_decoy,TRY1,Decoy,0,-7.18475,-6.23,-2.05,-5.2275757285209625
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)c1F,C39631649_decoy,TRY1,Decoy,0,-10.6226,-6.14,-2.87,-7.049545349384377
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)c(F)c1F,C39631678_decoy,TRY1,Decoy,0,-9.35348,-6.98,-2.89,-8.00937001848619
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676487_decoy,TRY1,Decoy,0,-10.5226,-7.74,-1.21,-8.151187063919016
COc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685731_decoy,TRY1,Decoy,0,-7.6293,-6.81,-1.62,-8.052686817892372
CC1(C)C[C@H]([NH2+]CC2CCCCC2)[C@@]2(CCC(=O)NCCN3CCOCC3)CC[C@](C)(O)C[C@@H]12,C12531474_decoy,TRY1,Decoy,0,-10.332,-7.38,-2.16,-7.781355218655874
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH2+]C2CC2)cc1Cl,C43074451_decoy,TRY1,Decoy,0,-8.51778,-7.81,-1.76,-6.17459259628617
CCOC(=O)C1=C(CN2CC[NH+]([C@H](C)C(=O)NC3CC3)CC2)NC(=O)N[C@H]1c1ccc(Cl)cc1,C45681908_decoy,TRY1,Decoy,0,-8.79753,-6.08,-1.03,-6.049587462689143
C[NH+](CC(=O)NC(=O)Nc1ccc(C#N)cc1)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C46556833_decoy,TRY1,Decoy,0,-8.09917,-7.82,-3.02,-7.432658669644533
CC[C@@H]([NH2+]C1CCN(c2ccc(NS(=O)(=O)N(C)C)cc2)CC1)c1nc2ccc(C)cc2[nH]1,C39420560_decoy,TRY1,Decoy,0,-9.93542,-5.62,-1.55,-5.338288722685507
CCOC(=O)Nc1ccc2c(COC(=O)c3sc4[nH+]c(C)cc(C)c4c3N)cc(=O)oc2c1,C14151882_decoy,TRY1,Decoy,0,-6.42368,-8.63,-3.55,-5.61645037509817
C[C@@H](C(=O)Nc1ccc(OC(F)F)cc1)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258544_decoy,TRY1,Decoy,0,-7.93627,-7.78,-1.71,-6.668585596499826
CCCNC(=O)C[NH+]1CCC(NC(=O)c2ccsc2NC(=O)c2ccc(C(C)C)cc2)CC1,C59894349_decoy,TRY1,Decoy,0,-8.90703,-7.48,-2.18,-6.6740769487207965
Cc1ccc2c(c1)=C(NNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1)C(=O)[NH+]=2,C15015346_decoy,TRY1,Decoy,0,-7.62386,-6.8,-2.13,-5.773611091834555
Cc1ccc(NS(=O)(=O)c2ccc(NCCCCNc3cccc[nH+]3)c([N+](=O)[O-])c2)c(C)c1,C60369821_decoy,TRY1,Decoy,0,-8.95065,-7.03,-1.78,-6.495499203915958
CCOCC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(Cl)ccc4=[NH+]C3)C2)S1,C63557636_decoy,TRY1,Decoy,0,-7.88369,-7.19,-2.37,-7.163868856433744
CCc1ccccc1N/C(=N\C(=O)c1ccc(NC(C)=O)cc1)NCCC1=c2ccccc2=[NH+]C1,C63589273_decoy,TRY1,Decoy,0,-8.71214,-9.16,-2.85,-8.930508678351524
C[C@@H](NS(=O)(=O)c1c(Cl)cccc1Cl)C(=O)NNC(=O)CC1=c2ccccc2=[NH+]C1,C64340250_decoy,TRY1,Decoy,0,-7.71483,-7.86,-2.36,-5.922150732379294
CSCC[C@@H](NC(=O)N1CC(O)=Nc2ccccc21)C(=O)NCCC1=c2ccccc2=[NH+]C1,C64600205_decoy,TRY1,Decoy,0,-7.44636,-8.17,-4.35,-7.578498500000439
Cc1ccccc1OC[C@@H](O)Cn1c(NCC[NH+](C)C)nc2c1c(=O)[nH]c(=O)n2C,C04134849_decoy,TRY1,Decoy,0,-7.74718,-6.96,-1.35,-6.953142176206916
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2cc(OC)ccc2[nH]c1=O,C04133224_decoy,TRY1,Decoy,0,-7.98135,-6.59,-4.02,-6.767967075387007
Cc1cccc(OC[C@@H](O)Cn2c(NCC[NH+](C)C)nc3c2c(=O)[nH]c(=O)n3C)c1,C02344208_decoy,TRY1,Decoy,0,-7.74263,-6.36,-1.35,-7.008850549303146
COc1ccc(-n2c(C)c([N+](=O)[O-])c3ccc(O)c(C[NH+](CCO)CCO)c32)cc1,C03878769_decoy,TRY1,Decoy,0,-4.6369,-5.19,-3.21,-3.840406553153832
CCCn1c(N)c([C@@H](c2cc(OC)c(OC)c(OC)c2)[NH+]2CCCC2)c(=O)[nH]c1=O,C07777528_decoy,TRY1,Decoy,0,-7.34211,-6.27,-1.96,-6.316842921152805
CCCn1c(N)c([C@H](c2cc(OC)c(OC)c(OC)c2)[NH+]2CCCC2)c(=O)[nH]c1=O,C07777529_decoy,TRY1,Decoy,0,-7.71696,-6.29,-2.35,-6.0229745446225325
COc1cccc(C[NH+](C)[C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)c1OC,C08533828_decoy,TRY1,Decoy,0,-9.1999,-6.34,-2.07,-6.187607251799775
CC(C)NC(=O)C[C@@H]1O[C@H](Cn2cc(C[NH+](C)Cc3ccccc3)nn2)[C@@H](O)[C@H]1O,C08624449_decoy,TRY1,Decoy,0,-5.89099,-7.81,-1.89,-6.458531660147121
COc1ccc(C[NH+](C)CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)c(OC)c1OC,C08745114_decoy,TRY1,Decoy,0,-7.95363,-5.85,-3.96,-5.82337008633729
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NC[C@H](c1cccs1)[NH+]1CCOCC1,C08721152_decoy,TRY1,Decoy,0,-7.6266,-4.98,-3.11,-5.075127794446918
C[C@]1(CSc2ccccc2C(=O)NCc2ccccc2C[NH+]2CCCCC2)NC(=O)NC1=O,C08853264_decoy,TRY1,Decoy,0,-8.60766,-7.28,-1.37,-5.995505892226047
O=C(CCn1c(-c2cccs2)n[nH]c1=S)NCCNc1[nH+]cc(C(F)(F)F)cc1Cl,C08988161_decoy,TRY1,Decoy,0,-8.88594,-6.04,-3.11,-6.544300113830009
CCOc1ccccc1C[NH+]1CCNC(=O)[C@@H]1CC(=O)NCc1cc2cc(F)ccc2[nH]1,C11815109_decoy,TRY1,Decoy,0,-8.17266,-7.33,-1.86,-6.509400625759743
COC[C@@H](O)C[NH2+]Cc1cc2c(-c3cccc(F)c3)nn(-c3ccccc3)c2[nH]c1=O,C12146451_decoy,TRY1,Decoy,0,-7.80092,-7.72,-3.54,-8.089145372824152
O=C(C[C@@H]1C(=O)NCC[NH+]1Cc1cccc(C(F)(F)F)c1)NCCN1CCNC1=O,C12749050_decoy,TRY1,Decoy,0,-8.64323,-7.71,-1.37,-7.330399476437206
Cc1ccc(OC[C@@H](O)Cn2c(NCC[NH+](C)C)nc3c2c(=O)[nH]c(=O)n3C)cc1,C05462173_decoy,TRY1,Decoy,0,-7.49751,-7.24,-2.57,-8.625901506100677
COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)[NH+]1CCCC1,C15128569_decoy,TRY1,Decoy,0,-7.25815,-6.13,-1.73,-5.462064162291333
COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)[NH+]1CCCC1,C15128571_decoy,TRY1,Decoy,0,-7.29378,-6.58,-3.98,-5.752600448025723
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(CNCCc2cccnc2)c1,C19338338_decoy,TRY1,Decoy,0,-9.0868,-5.96,-1.39,-6.782611484044284
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccc(C)s2)nnn1-c1nonc1N,C03633093_decoy,TRY1,Decoy,0,-7.90461,-5.38,-4.88,-6.8380349055024885
COc1cc(C[NH2+]C[C@@H](C)O)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCCO2,C20877159_decoy,TRY1,Decoy,0,-9.33954,-7.06,-2.75,-6.880584910967284
COCCn1c(N)c(C(=O)C[NH+](C)Cc2cccc(Cl)c2Cl)c(=O)[nH]c1=O,C22060194_decoy,TRY1,Decoy,0,-7.60495,-6.57,-1.87,-5.92539372965367
CCOC(=O)C1=C(C[NH+]2CCNC(=O)[C@@H]2CC(=O)OC)NC(=O)N[C@@H]1c1ccco1,C24806600_decoy,TRY1,Decoy,0,-8.28552,-4.76,-1.23,-5.621982258399606
COCCCNC(=O)C[NH+]1CCN(CC(=O)Nc2oc(C)c3c(C)n[nH]c(=O)c23)CC1,C24840203_decoy,TRY1,Decoy,0,-7.6881,-7.42,-2.67,-6.322678161591441
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1cccc(Cl)c1,C02242811_decoy,TRY1,Decoy,0,-8.0442,-6.98,-4.09,-7.92018076527094
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1ccccc1Cl,C02242799_decoy,TRY1,Decoy,0,-9.14796,-7.2,-0.5,-9.32863425950456
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2ccccc2Cl)nnn1-c1nonc1N,C01496821_decoy,TRY1,Decoy,0,-7.35405,-5.15,-3.28,-5.892033179273875
C[NH+](C)CCNC(=O)CN1CC[NH+]([C@@H](C(=O)[O-])c2c[nH]c3cc(Cl)ccc23)CC1,C31815895_decoy,TRY1,Decoy,0,-7.2623,-6.66,-2.05,-5.898233004299032
COCCNc1scc(-c2ccc(O)c(C(N)=O)c2)[n+]1/N=C/c1ccccc1[N+](=O)[O-],C35606835_decoy,TRY1,Decoy,0,-8.01878,-7.29,-1.55,-7.632803579123498
COc1ccccc1[C@H](CNc1nc(N)c([N+](=O)[O-])c(N2CCCCC2)n1)[NH+](C)C,C35681941_decoy,TRY1,Decoy,0,-7.42762,-4.8,-2.33,-5.486930015985177
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1F,C04917686_decoy,TRY1,Decoy,0,-7.17446,-7.23,-1.3,-6.279226601286543
CCOC(=O)c1[nH]c2cc3c(cc2c1NC(=O)C[NH+]1CCN(CCO)CC1)OCO3,C19371760_decoy,TRY1,Decoy,0,-9.02931,-6.21,-1.37,-5.8984831971065415
CCCOc1ccc(N2C(=O)C[C@@H]([NH2+]Cc3ccc(S(N)(=O)=O)cc3)C2=O)cc1,C19731514_decoy,TRY1,Decoy,0,-8.7862,-6.94,-1.58,-5.756020970887527
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC[C@H](c2ccco2)[NH+](C)C)cc1,C06084351_decoy,TRY1,Decoy,0,-7.18386,-7.45,-4.91,-5.866802414881957
CC[NH+](CC(=O)Nc1ccc(OC)cc1)CC(=O)N[C@@H]1O[C@@H](C)c2c(C)n[nH]c(=O)c21,C39462107_decoy,TRY1,Decoy,0,-6.60462,-7.77,-3.21,-5.575361769965929
CCOc1ccccc1C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601735_decoy,TRY1,Decoy,0,-7.76344,-6.43,-3.07,-6.025743326723096
CCCCC(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685704_decoy,TRY1,Decoy,0,-9.65401,-4.24,-1.26,-5.654588452967118
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685883_decoy,TRY1,Decoy,0,-8.85153,-6.12,-3.46,-6.333347017197552
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@H]1NN[C@@H](c2ccc(C)cc2)[NH+]1CC(=O)[O-],C39709366_decoy,TRY1,Decoy,0,-6.92297,-7.32,-2.33,-6.575096466032203
CCN(CC)c1ccc2cc(C(=[NH2+])NNC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)oc2c1,C01500095_decoy,TRY1,Decoy,0,-8.60725,-6.99,-4.52,-7.085006249484647
CSc1ccc(C[NH+]2CCN(CC(=O)Nc3sc(C(N)=O)c(C)c3C(=O)OC(C)C)CC2)cc1,C39972170_decoy,TRY1,Decoy,0,-9.94396,-7.08,-1.33,-7.313678210706883
COc1ccccc1C(=O)NNc1ncnc(NCC[NH+]2CCCCC2)c1[N+](=O)[O-],C40622716_decoy,TRY1,Decoy,0,-7.27887,-7.24,-1.84,-6.389689773580838
CC1(C)CC(Nc2ncnc(NCCCN3CCOCC3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40623011_decoy,TRY1,Decoy,0,-8.95418,-5.21,-1.85,-5.831687847563274
Cn1c(=O)n(C)c2cc([C@H](O)COc3ccc(C[NH2+]CCOCCO)cc3)ccc21,C40722019_decoy,TRY1,Decoy,0,-7.0308,-1.45,-2.49,-2.7066398430273657
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H](C)C(=O)c1[nH]c(C)c(C(C)=O)c1C,C07681373_decoy,TRY1,Decoy,0,-8.20798,-6.46,-1.82,-7.089788683795685
CC[NH+](CC(=O)NC(=O)NCC(F)(F)F)CC(=O)Nc1ccc2c(c1)OCCO2,C07361256_decoy,TRY1,Decoy,0,-7.64814,-6.76,-1.28,-5.998732213491414
O=C(NCCCNc1cccc[nH+]1)Nc1cccc(Cn2nc3ccccn3c2=O)c1,C58086242_decoy,TRY1,Decoy,0,-7.97717,-8.26,-2.09,-6.120707561163283
NC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OCCN1C(=O)c2ccccc2C1=O,C63253377_decoy,TRY1,Decoy,0,-7.78966,-8.56,-2.2,-10.552282919456234
O=C(CCNC(=O)N1CCN(C(=O)CCC2=c3ccccc3=[NH+]C2)CC1)NCCO,C63280098_decoy,TRY1,Decoy,0,-8.07667,-7.5,-1.4,-6.340476240685137
NC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)COC(=O)CCC1=c2ccccc2=[NH+]C1,C63874025_decoy,TRY1,Decoy,0,-8.44072,-7.55,-2.71,-7.334114575023108
N#Cc1ccc(O[C@@H]2C=C(C(=O)NCC(N)=O)C[C@@H](O)[C@H]2O)c(Br)c1,C03839699_decoy,TRY1,Decoy,0,-8.72302,-6.1,-3.77,-5.655030691386608
O=[N+]([O-])c1cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(Sc2ccccc2)c1,C04185181_decoy,TRY1,Decoy,0,-7.4646,-7.05,-1.67,-6.6789321083033295
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2cc(C)c(C(C)=O)c(O)c12,C06070477_decoy,TRY1,Decoy,0,-6.9795,-5.63,-1.14,-5.095305404519837
Cc1ccccc1Nc1nc(N)nc(CSc2nnc(C3CCCCC3)n2N)n1,C08985572_decoy,TRY1,Decoy,0,-8.48286,-7.26,-2.07,-6.948069648458814
N#Cc1c(CCCNC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)n[nH]c1N,C12559562_decoy,TRY1,Decoy,0,-9.94224,-8.96,-3.67,-8.576509145636448
Cc1sc2nc(-c3ccc(C(=O)O[C@@H](C)C(=O)NC(N)=O)cc3)nc(N)c2c1C,C11306189_decoy,TRY1,Decoy,0,-8.05423,-8.48,-2.92,-7.0009490678696205
Cc1ccccc1Nc1nc(N)nc(CSc2nc(C)c(C)c(C)c2C(N)=O)n1,C12558139_decoy,TRY1,Decoy,0,-7.94668,-6.97,-3.79,-6.20367099257651
O=[N+]([O-])c1cc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc(Sc2ccccc2)c1,C15240435_decoy,TRY1,Decoy,0,-6.52831,-5.68,-2.33,-4.5819017884773166
O=[N+]([O-])c1cc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc(Sc2ccccc2)c1,C15240441_decoy,TRY1,Decoy,0,-6.82548,-7.06,-3.64,-5.294788763638626
O=[N+]([O-])c1cc(N[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc(Sc2ccccc2)c1,C03618068_decoy,TRY1,Decoy,0,-6.91174,-6.48,-1.64,-4.748172057515748
O=C(N/N=C(\c1nc2ccccc2[nH]c1=O)[C@H](O)[C@H](O)CO)c1ccccc1Cl,C15774928_decoy,TRY1,Decoy,0,-7.94369,-7.55,-1.54,-6.247977534474189
Nc1nc(SCc2ccc(F)cc2)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c2n1,C16991589_decoy,TRY1,Decoy,0,-7.01508,-6.88,-2.04,-6.214799791186617
Cc1ccc(C)c(NC(=S)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1,C20916951_decoy,TRY1,Decoy,0,-8.2948,-7.99,-3.21,-7.72686299750232
CC(C)[C@@H](Sc1nnc(-c2ccccc2Br)n1N)C(=O)NC(N)=O,C22612270_decoy,TRY1,Decoy,0,-7.52236,-6.01,-1.7,-5.784149079255383
CC(C)[C@H](Sc1nnc(-c2ccccc2Br)n1N)C(=O)NC(N)=O,C22612272_decoy,TRY1,Decoy,0,-8.4405,-4.86,-1.41,-5.389387302294431
CN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36537238_decoy,TRY1,Decoy,0,-8.58713,-6.85,-1.2,-6.746604835390425
NC(=O)CCCNS(=O)(=O)c1c(Br)cc(N)cc1Br,C37658422_decoy,TRY1,Decoy,0,-6.71171,-6.46,-2.12,-7.201680949004416
NC(=O)CCCNS(=O)(=O)c1c(N)cc(Br)cc1Br,C37658423_decoy,TRY1,Decoy,0,-8.85002,-5.64,-4.94,-5.687693069598369
CC1=C[C@H]([C@@H]2NN[C@H](SCC(=O)Nc3ccc(Br)cc3)N2N)N=N1,C38984703_decoy,TRY1,Decoy,0,-8.94518,-6.61,-2.5,-5.787830195467989
O=S(=O)(Nc1ccc(-c2ccccc2[O-])cc1N1CC[NH2+][C@H](O)C1)c1ccccc1O,C39482388_decoy,TRY1,Decoy,0,-8.25496,-8.39,-2.56,-7.576365418612805
Cc1cc(C)cc(Nc2ncnc(NNC(=O)c3ccc(Br)cc3)c2N)c1,C40682075_decoy,TRY1,Decoy,0,-9.68769,-6.76,-3.11,-6.5294411086441695
Cc1cc(C)cc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)c1,C40682100_decoy,TRY1,Decoy,0,-8.4734,-7.9,-2.64,-6.355591673545147
COc1ccccc1C(=O)NNc1ncnc(Nc2cccc3ccc(C)nc23)c1N,C40758666_decoy,TRY1,Decoy,0,-8.04403,-8.29,-2.93,-6.315401870451349
Nc1c(NNC(=O)c2ccccc2Br)ncnc1Nc1ccc(Cl)cn1,C40779440_decoy,TRY1,Decoy,0,-7.93374,-7.81,-2.6,-6.401340907630914
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3ccc(Cl)cn3)c2N)cc1,C40779470_decoy,TRY1,Decoy,0,-8.52794,-8.04,-2.32,-6.555600127347788
Nc1c(NNC(=O)Cc2ccccc2)ncnc1Nc1ccc(Br)cn1,C40779859_decoy,TRY1,Decoy,0,-8.50794,-7.32,-0.54,-5.950186336896222
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1nccs1,C40780849_decoy,TRY1,Decoy,0,-8.43446,-6.4,-1.05,-6.230837153649734
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccc(Cl)cc1,C40782162_decoy,TRY1,Decoy,0,-8.90417,-6.42,-1.35,-6.852692735141057
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1ccc(Br)cc1,C40782262_decoy,TRY1,Decoy,0,-9.38675,-5.77,-3.39,-5.403145088731711
Cc1ccc(C(=O)NNc2ncnc(Nc3nc4c(C)cccc4s3)c2N)cc1,C40783468_decoy,TRY1,Decoy,0,-8.04885,-6.57,-2.08,-6.413718365871346
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccc(F)c(F)c1,C40793485_decoy,TRY1,Decoy,0,-8.47994,-6.63,-3.41,-6.279682897507506
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3cc(F)ccc3F)c2N)cc1,C40794737_decoy,TRY1,Decoy,0,-9.15413,-8.07,-2.56,-7.965214138229173
CC(C)(C)S(=O)(=O)c1ccc2c(c1)C(Nc1cncc(F)c1)=C(C(N)=O)NN2,C45390469_decoy,TRY1,Decoy,0,-7.20562,-6.85,-1.77,-5.0001273768984165
CN(CCO)c1nc(N)c2c(N)nc3c(c2c1C#N)CC(=O)N3Cc1cccs1,C25702832_decoy,TRY1,Decoy,0,-7.95691,-6.33,-3.89,-4.012835380689704
COc1cc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C(F)(F)F)c32)ccc1OCC(N)=O,C00803836_decoy,TRY1,Decoy,0,-7.13055,-6.4,-1.85,-7.689659008287122
COc1cc([C@H]2NC(=S)NC(C)=C2C(=O)N/N=C/c2ccc(O)cc2)ccc1O,C05296323_decoy,TRY1,Decoy,0,-8.77895,-8.39,-2.69,-7.657065609607236
COc1ccccc1/C=N/NC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(O)cc1O,C59384992_decoy,TRY1,Decoy,0,-7.39057,-7.23,-1.11,-7.668103537474261
COc1ccc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)cc2O)cc1,C59384999_decoy,TRY1,Decoy,0,-9.5884,-6.55,-1.54,-6.736479753100723
COc1cc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)cc2)ccc1O,C59385112_decoy,TRY1,Decoy,0,-9.66734,-6.82,-2.71,-6.541461450852262
COc1cc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@@H]2c2ccc(O)cc2)ccc1O,C59385113_decoy,TRY1,Decoy,0,-10.0057,-8.07,-2.75,-9.325356821907564
COc1ccccc1[C@@H]1NC(=S)NC(C)=C1C(=O)N/N=C/c1ccc(O)cc1O,C59385364_decoy,TRY1,Decoy,0,-9.96773,-6.94,-2.62,-8.012136280824908
CCOc1ccc(/C=N/NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)cc2O)cc1,C59385765_decoy,TRY1,Decoy,0,-8.33051,-7.86,-1.77,-7.525033404116951
CC1=C(C(=O)N/N=C/c2ccc(N(C)C)cc2)[C@H](c2ccc(O)cc2O)NC(=O)N1,C59385771_decoy,TRY1,Decoy,0,-9.08174,-7.89,-0.46,-9.334357611179849
CC1=C(C(=O)N/N=C/c2ccc(N(C)C)cc2)[C@@H](c2ccc(O)cc2O)NC(=O)N1,C59385773_decoy,TRY1,Decoy,0,-8.11555,-6.1,-1.35,-5.692243329055414
Nc1nc(SCS(=O)(=O)N(C2CCCCC2)C2CCCCC2)[nH]c(=O)c1N,C59398938_decoy,TRY1,Decoy,0,-8.76394,-8.11,-1.62,-10.992209243047988
Cc1nn(C(N)=S)c(O)c1[C@@H](c1ccc(Br)cc1)[C@H](C#N)C(N)=O,C59461798_decoy,TRY1,Decoy,0,-7.87438,-6.32,-4.48,-8.735557568822507
Cc1nn(C(N)=S)c(O)c1[C@H](c1ccc(Br)cc1)[C@H](C#N)C(N)=O,C59461799_decoy,TRY1,Decoy,0,-7.66383,-4.64,-1.79,-5.070940059800117
C[C@H](OC(=O)c1cc(N)ccc1Cl)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C60380703_decoy,TRY1,Decoy,0,-8.08536,-7.71,-2.98,-7.111791236385558
[NH3+]CC(=O)NCC(=O)Nc1c(Br)cc(Br)cc1C(=O)[O-],C62825400_decoy,TRY1,Decoy,0,-7.05041,-6.8,-3.27,-8.061441163534818
CN(C)S(=O)(=O)c1cccc(NC(=S)N/N=C/c2ccc(O)c(O)c2O)c1,C13638213_decoy,TRY1,Decoy,0,-9.70075,-6.53,-0.96,-5.641879762436841
FC(F)(F)c1ccc(NCCNc2ccc(C(F)(F)F)c[nH+]2)[nH+]c1,C03200717_decoy,TRY1,Decoy,0,-7.17204,-5.06,-3.19,-5.509215219956911
CC(C)[NH2+]Cc1ccccc1Sc1ccccc1C[NH2+]C(C)C,C01559280_decoy,TRY1,Decoy,0,-7.90252,-4.99,-3.21,-6.321707214136063
Cc1ccc(C[NH2+]C[C@H]2C[C@@H](CO)[NH+](C)[C@H]2c2ccccc2F)s1,C20859136_decoy,TRY1,Decoy,0,-8.35964,-4.86,-1.04,-4.741592376985061
CC(C)c1ccccc1Oc1ccc([C@H](C[NH3+])[NH+]2CCCC2)cc1,C32086974_decoy,TRY1,Decoy,0,-7.91723,-5.81,-1.44,-6.302018429734799
C[NH+](C1CCCC1)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37084148_decoy,TRY1,Decoy,0,-8.5626,-4.54,-1.38,-4.727653419241811
CCOc1cc(C[C@H](C)[NH3+])cc(Br)c1OCC[NH+](C)C,C37722371_decoy,TRY1,Decoy,0,-8.35028,-4.62,-1.38,-9.125339319260016
Fc1cc(-c2c[nH+]c(CN3CC[NH2+]CC3)[nH]2)c(Cl)cc1Cl,C37735270_decoy,TRY1,Decoy,0,-8.11869,-5.42,-0.99,-4.577777461513785
Cc1ccc2c(c1)c1c3n2CC[NH+](C[C@H](O)C[NH2+]C(C)C)[C@@H]3CCC1,C03905752_decoy,TRY1,Decoy,0,-7.56623,-6.8,-0.65,-6.477539460323669
Cc1ccc2c(c1)=[NH+][C@H](C1=C(N)N(c3ccc(Cl)cc3)CC1=O)[NH+]=2,C38819026_decoy,TRY1,Decoy,0,-7.65817,-7.87,-0.95,-6.554306769189408
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1c1cc(Cl)cc(Cl)c1,C38827404_decoy,TRY1,Decoy,0,-7.60498,-6.63,-1.69,-4.948049769432511
Nc1ccc(OC(F)(F)F)cc1[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O,C39777266_decoy,TRY1,Decoy,0,-6.09621,-7.02,-2.15,-6.265669846404443
CC(C)[NH2+]C[C@@H](O)C[NH+](C)Cc1csc(Br)c1,C42362010_decoy,TRY1,Decoy,0,-6.92036,-4.38,-3.11,-4.353860825355233
CC(C)CN(CC[NH+](C)C)[C@H](C[NH3+])c1ccc(Br)cc1F,C42744411_decoy,TRY1,Decoy,0,-7.28031,-4.41,-1.94,-4.706451617751231
CC[NH+](Cc1ccco1)[C@H](c1ccc(Br)cc1)[C@@H](C)[NH3+],C42954261_decoy,TRY1,Decoy,0,-7.60574,-4.48,-4.44,-4.586443362192542
COCC[NH+]([C@@H](C)C1CC1)[C@@H](c1ccc(Br)cc1)[C@@H](C)[NH3+],C42955529_decoy,TRY1,Decoy,0,-7.68531,-4.05,-2.01,-5.110781353993221
C[C@H]([NH+](C)[C@@H](c1ccc(Br)cc1)[C@@H](C)[NH3+])C(C)(C)C,C42955620_decoy,TRY1,Decoy,0,-6.69289,-3.62,-1.18,-3.800667429772345
C[C@H]([NH3+])[C@H](c1cccc(Br)c1)[NH+]1CCC(N(C)C)CC1,C43020818_decoy,TRY1,Decoy,0,-7.2755,-4.55,-1.68,-4.384646606140025
C[C@H]([NH3+])[C@@H](c1ccccc1Br)[NH+]1CCCCCCC1,C43091085_decoy,TRY1,Decoy,0,-6.66173,-3.74,-1.67,-3.8181076382947774
CC[C@H]([NH3+])[C@H](c1ccccc1Br)[NH+](C)Cc1ccco1,C43091546_decoy,TRY1,Decoy,0,-6.63815,-3.84,-1.51,-4.188357417606372
C[C@H]([NH+](C)[C@H](c1ccccc1Br)[C@@H](C)[NH3+])C(C)(C)C,C43093535_decoy,TRY1,Decoy,0,-6.34382,-3.66,-1.51,-4.396214711916906
CC[C@@H]([NH3+])[C@@H](c1ccc(Cl)s1)[NH+](Cc1cccs1)C(C)C,C43253560_decoy,TRY1,Decoy,0,-7.40183,-3.85,-1.04,-4.886751143932695
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](C(C)C)CC1,C43260640_decoy,TRY1,Decoy,0,-8.37681,-4.53,-1.22,-5.937368925995727
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)Cc1ccoc1C,C43261576_decoy,TRY1,Decoy,0,-8.28178,-3.88,-1.9,-4.643189710928481
C[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](C(C)(C)C)CC1,C43261693_decoy,TRY1,Decoy,0,-8.18704,-5.12,-1.61,-5.225453267812093
C[C@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](C2CC2)CC1,C43261905_decoy,TRY1,Decoy,0,-8.09692,-4.54,-1.34,-5.10684203511463
C[C@@H]([NH3+])[C@H](c1ccco1)[NH+](C)Cc1ccccc1Br,C43335608_decoy,TRY1,Decoy,0,-6.0742,-4.37,-2.36,-3.822207590619585
CC[C@@H]([NH2+]CCCCn1cc[nH+]c1)c1cc(Br)ccc1O,C45094654_decoy,TRY1,Decoy,0,-6.68808,-5.7,-2.88,-5.796024032986084
CCCN(CC[NH+](C)C)[C@@H](C[NH3+])c1ccc(Br)cc1,C45663683_decoy,TRY1,Decoy,0,-8.61019,-3.55,-1.39,-4.773355849009477
CCCN(CC[NH+](C)C)[C@@H](C[NH3+])c1cc(Br)cs1,C45663784_decoy,TRY1,Decoy,0,-8.33249,-3.48,-4.42,-4.878978915962351
Cc1ccc([C@H](C[NH3+])[NH+](C)Cc2ccc(Br)cc2)o1,C48881849_decoy,TRY1,Decoy,0,-8.19936,-6.46,-1.54,-7.21015884346209
Cc1cc([C@@H](C[NH3+])[NH+](C)Cc2ccccc2Br)c(C)s1,C49687415_decoy,TRY1,Decoy,0,-7.63275,-4.19,-2.0,-4.453416275889631
CCc1ccc(C[NH+](C)[C@H](c2cc(Br)cs2)[C@@H](C)[NH3+])cc1,C43285974_decoy,TRY1,Decoy,0,-8.32772,-5.79,-2.33,-5.264103397416325
O[C@@H](C[NH2+][C@@H]1CC[NH+](C2CC2)C1)c1cccc(Br)c1,C44721884_decoy,TRY1,Decoy,0,-8.06775,-6.19,-1.59,-5.424064635197753
C[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+]1Cc2ccccc2C1,C50910364_decoy,TRY1,Decoy,0,-8.00219,-4.64,-0.51,-4.584925926033382
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+]1CC[C@H](C)C[C@@H]1C,C51729512_decoy,TRY1,Decoy,0,-8.08324,-4.42,-1.67,-4.916014725288358
CC[C@H]([NH3+])[C@H](c1ccc(Br)cc1)n1c[nH+]c(C)c1C,C51925873_decoy,TRY1,Decoy,0,-7.38463,-3.91,-2.58,-4.34892749461186
CC[C@@H]([NH3+])[C@H](c1ccc(Cl)s1)N1CC[NH+]([C@@H](C)CC)CC1,C55063730_decoy,TRY1,Decoy,0,-10.5405,-4.91,-0.87,-6.653060886967181
CC[C@H](C)[NH+]1CCN([C@H](c2ccc(Br)s2)[C@@H](C)[NH3+])CC1,C55063979_decoy,TRY1,Decoy,0,-8.67144,-4.53,-2.28,-5.3054228302359645
CC(C)C[NH+]1CCN(c2ncc(Br)cc2C[NH3+])CC1,C55082625_decoy,TRY1,Decoy,0,-8.45111,-4.5,-1.45,-4.576796934784579
O[C@@H](C[NH2+]CC[NH+]1CCCC1)COc1ccc(Br)cc1,C48298967_decoy,TRY1,Decoy,0,-7.44917,-5.15,-2.07,-5.966567891249454
Cc1cc2n([nH+]1)C[C@H](C[NH2+][C@@H]1CC(C)(C)Cc3oc(C)cc31)CN2,C58341318_decoy,TRY1,Decoy,0,-8.21794,-6.09,-2.44,-5.059218990080727
CC(C)[NH+]1CCC(C[NH3+])(N(C)Cc2csc(Br)c2)CC1,C42361248_decoy,TRY1,Decoy,0,-8.3112,-4.27,-1.94,-4.837154095303693
CN(Cc1csc(Br)c1)C1(C[NH3+])C[C@H]2CC[C@@H](C1)[NH+]2C,C42361438_decoy,TRY1,Decoy,0,-8.0421,-4.06,-2.61,-4.618808284260553
C[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CCN(CC[NH+](C)C)CC1,C61642407_decoy,TRY1,Decoy,0,-8.22595,-4.36,-3.43,-5.067519423255032
CC(C)CN(CC[NH+](C)C)c1ccc([C@H](C)[NH3+])cc1Br,C61697908_decoy,TRY1,Decoy,0,-8.72556,-5.77,-1.95,-12.788160467860546
Oc1ccc(C[NH2+][C@@H]2CCC[C@H]2n2cc[nH+]c2)cc1Br,C62702625_decoy,TRY1,Decoy,0,-8.378,-4.76,-2.22,-4.733680600618816
C[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[C@H]([NH+]2CCCC2)C1,C62977462_decoy,TRY1,Decoy,0,-8.38468,-4.54,-0.94,-4.640894444958537
C[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N(C)CC[NH+]1CCCC1,C63050769_decoy,TRY1,Decoy,0,-7.99587,-3.86,-0.99,-4.574570728941604
CC1(C)CCC[NH+]1[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C63066202_decoy,TRY1,Decoy,0,-6.90376,-4.93,-3.14,-4.541772546085852
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2c(C(C)C)nn(C)c2Cl)CC1,C67122521_decoy,TRY1,Decoy,0,-8.17509,-5.51,-1.99,-5.148493181213646
O=C1NC(=O)[C@@](CCCC[C@]2(c3ccccc3)NC(=O)NC2=O)(c2ccccc2)N1,C02273541_decoy,TRY1,Decoy,0,-7.10364,-6.89,-3.35,-6.6995275936186
COC(=O)C1=C(CSc2nnc(N)s2)NC(=O)N[C@@H]1c1ccccc1C,C05018305_decoy,TRY1,Decoy,0,-9.42166,-5.95,-1.33,-6.778078909159418
COC(=O)C1=C(CSc2nnc(N)s2)NC(=O)N[C@@H]1c1ccc(C)cc1,C05018319_decoy,TRY1,Decoy,0,-8.0311,-5.9,-0.74,-5.846741762648402
COC(=O)C1=C(CSc2nnc(N)s2)NC(=O)N[C@H]1c1ccc(C)cc1,C05018321_decoy,TRY1,Decoy,0,-8.93182,-7.41,-1.43,-10.897822690577794
Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=S)NNc1nc2ccccc2[nH]1,C05694518_decoy,TRY1,Decoy,0,-7.57923,-5.73,-2.13,-5.581605661134673
Cc1cc(C)c(NC(=O)Cn2nnc(C(=O)Nc3cc(C)ccc3C)c2N)c(C)c1,C06753973_decoy,TRY1,Decoy,0,-8.11938,-7.5,-3.1,-6.002331045912646
CCOc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2cc(C)on2)ccc1O,C11551698_decoy,TRY1,Decoy,0,-7.74469,-7.35,-2.03,-5.840557220664136
C[C@@H](NC(=O)NC[C@@H]1COc2ccccc2O1)c1ccc(S(N)(=O)=O)cc1,C12778490_decoy,TRY1,Decoy,0,-8.40578,-7.26,-2.07,-5.863719316318615
C=CCOC(=O)[C@@H]1[C@H](c2ccc(O)c(OCC)c2)c2c(O)n[nH]c2C[C@]1(C)O,C04908852_decoy,TRY1,Decoy,0,-7.81054,-4.75,-2.29,-5.762120754305801
Cc1ccccc1NC(=O)CSc1nnc(N/N=C/c2ccc(F)cc2)n1N,C20528028_decoy,TRY1,Decoy,0,-8.33261,-8.29,-1.92,-9.430874855108978
Cc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cccs2)n1N,C21317732_decoy,TRY1,Decoy,0,-8.54049,-7.77,-1.62,-8.0713747355452
O=C(CNC(=O)c1ccccc1F)NNC(=S)NCc1ccc2c(c1)OCO2,C22617733_decoy,TRY1,Decoy,0,-8.24788,-8.12,-0.46,-8.623332694034028
O=C(Nc1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1O)c1ccc(=O)[nH]c1,C22993287_decoy,TRY1,Decoy,0,-9.47902,-8.99,-4.71,-7.457541427200548
C=CCNC(=O)C1CCN(C(=O)Nc2ccc(NC(=O)NCCC)cc2)CC1,C33310187_decoy,TRY1,Decoy,0,-7.62741,-5.03,-3.49,-6.7144531304713215
COC(=O)[C@@H]1[C@H](c2ccccc2)[C@H](C(=O)OC)[C@@](C)(O)C[C@]12NNC(=S)N2,C35323717_decoy,TRY1,Decoy,0,-8.04178,-4.71,-0.83,-5.620918888038565
CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)CSc1n[nH]c(N)n1,C10716108_decoy,TRY1,Decoy,0,-7.04264,-7.41,-1.97,-7.33186100761651
Cc1ccc2c(CC(=O)NCC(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)coc2c1C,C39558562_decoy,TRY1,Decoy,0,-7.56085,-7.29,-1.07,-5.7798325644720885
Cc1cc(C(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(C)n1-c1ccc(F)cc1,C39559487_decoy,TRY1,Decoy,0,-8.15924,-8.46,-1.82,-5.910209704137204
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)CSc1nnc(C2CCCCC2)n1N,C39578417_decoy,TRY1,Decoy,0,-8.28132,-7.7,-3.14,-6.138892183469007
CC(C)(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1,C42630877_decoy,TRY1,Decoy,0,-8.32259,-8.17,-1.47,-7.9233831456084625
C[C@@H](NC(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl,C42896124_decoy,TRY1,Decoy,0,-7.29152,-5.55,-1.34,-6.349683732345645
Cc1ccc(C(=O)NCCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1F,C45580673_decoy,TRY1,Decoy,0,-8.32912,-8.01,-2.31,-6.583142067374575
Cc1occc1C(=O)Nc1cc(NC(=O)NCCNC(=O)C2CC2)ccc1F,C46011832_decoy,TRY1,Decoy,0,-7.70176,-6.12,-2.88,-5.551564105603875
Cc1cc(C(=O)[C@H](C#N)c2nc(N)nc(N)n2)c(C)n1-c1cccc(C(C)C)c1,C49438087_decoy,TRY1,Decoy,0,-7.36361,-8.08,-2.23,-11.23222382325743
[H]/N=C(\Nc1ccc(F)cc1)Nc1nc(CSc2nnc(C)s2)cc(=O)[nH]1,C20503058_decoy,TRY1,Decoy,0,-8.45591,-8.25,-1.98,-7.208430739652035
CCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC(N)=O)C(=O)Nc2ccc(F)cc21,C20566557_decoy,TRY1,Decoy,0,-7.20137,-5.78,-1.39,-5.283571845064981
O=C(NCCNC(=O)c1ccc(O)cc1)Nc1nnc(-c2ccsc2)s1,C52496112_decoy,TRY1,Decoy,0,-8.77856,-8.47,-2.95,-8.782804330223433
COc1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccccc2Cl)c1O,C54163688_decoy,TRY1,Decoy,0,-8.34317,-7.61,-1.65,-7.576543666179882
CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H](C)C(=O)NC(=O)NC2CC2)cc1,C56159490_decoy,TRY1,Decoy,0,-7.70758,-7.19,-2.14,-6.665000354860865
CC(C)[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C(=O)NC(N)=O,C07790506_decoy,TRY1,Decoy,0,-7.73356,-7.18,-1.93,-7.522775909764767
CNC(=O)NC(=O)[C@H](Sc1nnc(-c2cccs2)n1N)c1ccccc1,C11592283_decoy,TRY1,Decoy,0,-9.37132,-8.21,-2.05,-8.473392111407673
C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)Cc1csc(N2CCNC2=O)n1,C58837446_decoy,TRY1,Decoy,0,-10.0586,-6.69,-1.21,-6.7615547986772215
Cc1cc(S(N)(=O)=O)sc1C(=O)NNC(=O)COc1ccc(F)cc1,C60211565_decoy,TRY1,Decoy,0,-10.4714,-6.15,-3.05,-6.845013437976603
CC(=O)NCC(=O)NCC(=O)NCCC(=O)Nc1ccc(Br)cc1,C60399207_decoy,TRY1,Decoy,0,-7.93925,-6.11,-2.18,-5.560426050892127
COc1ccc(/C=C/C(=O)N[C@H](C)C(=O)NNC(=O)NCC(F)(F)F)cc1,C60414788_decoy,TRY1,Decoy,0,-7.6528,-7.45,-0.93,-6.420987878639186
NC(=O)c1cc(-c2csc(NC(=O)c3ccccc3N3CCOCC3)n2)c[nH]1,C61136454_decoy,TRY1,Decoy,0,-8.94862,-7.71,-0.8,-7.799086731409193
NC(=O)CC[C@H]1N[C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@@H]21,C15968415_decoy,TRY1,Decoy,0,-9.61945,-7.0,-1.46,-6.597259746160499
COc1cccc2cc([C@H](C)NC(=O)C(=O)Nc3ccccc3CC(N)=O)oc12,C62042411_decoy,TRY1,Decoy,0,-7.44582,-7.54,-3.35,-7.798399135203073
Cc1ccc2[nH]c(=O)c(CCNS(=O)(=O)c3ccc4[nH]c(=O)[nH]c4c3)cc2c1,C62094188_decoy,TRY1,Decoy,0,-7.349,-7.68,-1.75,-5.712336093579458
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NC2CCC(C(=O)NC)CC2)c1,C63432559_decoy,TRY1,Decoy,0,-7.36088,-7.26,-4.42,-5.9858030726897296
CC[C@@H](C)S[C@H]1NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1cccc(OC)c1,C63480837_decoy,TRY1,Decoy,0,-8.97546,-7.48,-1.23,-8.305296309337193
COc1cccc(C(=O)NNC(=O)c2ccc(-c3cccc(C)c3)[nH]c2=O)c1O,C65111774_decoy,TRY1,Decoy,0,-7.56369,-8.71,-2.06,-6.779931448045428
C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)NNC(=O)NCCc1ccccn1,C65144265_decoy,TRY1,Decoy,0,-7.30617,-7.66,-2.97,-7.096514090408243
O=C(NCCc1ccccc1Cl)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1,C65502503_decoy,TRY1,Decoy,0,-7.79878,-7.16,-2.71,-5.867800578950902
C=CCn1cc(C(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2ccccc21,C57430913_decoy,TRY1,Decoy,0,-8.22246,-8.76,-1.84,-7.621113864234113
N#Cc1c(F)cccc1NCCNC(=O)Nc1cccc(-c2ccc(=O)[nH]n2)c1,C66679010_decoy,TRY1,Decoy,0,-6.90886,-8.13,-2.08,-7.461105022690222
Cc1ccc([C@H](CNC(=O)Nc2ccc(C)c(C(N)=O)c2)N2CCOCC2)o1,C67312385_decoy,TRY1,Decoy,0,-8.89873,-7.22,-2.17,-7.581018795498783
Cc1ccc([C@@H](CNC(=O)Nc2ccc(C)c(C(N)=O)c2)N2CCOCC2)o1,C67312392_decoy,TRY1,Decoy,0,-8.96566,-6.14,-1.52,-5.976104334391584
COc1ccccc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12,C67439255_decoy,TRY1,Decoy,0,-8.55677,-7.37,-2.79,-6.20172380250597
C[C@H](Cc1ccc(O)cc1)NC(=O)NC[C@H](O)COc1ccc2c(c1)OCO2,C67605881_decoy,TRY1,Decoy,0,-8.43346,-8.31,-1.37,-7.158189458035413
COc1cc(-c2n[nH]c3c2[C@H](c2c[nH]nc2-c2ccc(F)cc2)C(C#N)=C(N)O3)cc(OC)c1OC,C00718386_decoy,TRY1,Decoy,0,-7.28813,-6.02,-1.78,-5.0602677635634805
O=C(Nc1ccn([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)n1)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O,C04352844_decoy,TRY1,Decoy,0,-7.58051,-9.48,-3.22,-7.722864651332991
C#C[C@@]1(O)CC[C@@H]2[C@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CC(N)=O)C(=O)[O-])CC[C@]4(C)[C@H]3CC[C@@]21C,C09033469_decoy,TRY1,Decoy,0,-9.17842,-7.7,-3.1,-8.049880689958162
C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCC(C)CC1)c1ccc(-n2ncnn2)cc1,C09334740_decoy,TRY1,Decoy,0,-9.58103,-7.09,-3.53,-6.60502809274875
CC(C)CCNC(=O)NC(=O)CSc1nnc(SCC(=O)NC(=O)NCCC(C)C)s1,C09562027_decoy,TRY1,Decoy,0,-10.1459,-5.63,-1.8,-7.984213461534662
O=C(CSc1nnc(SCC(=O)NC(=O)NC2CCCC2)s1)NC(=O)NC1CCCC1,C10798289_decoy,TRY1,Decoy,0,-10.5837,-6.71,-2.69,-7.620096786029158
C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CC(N)=O)C(=O)[O-])CC[C@]4(C)[C@H]3CC[C@@]21C,C12661401_decoy,TRY1,Decoy,0,-8.07955,-8.87,-3.45,-9.620071928707292
Cc1cc(O)c2c(c1)C(=O)c1cccc(O[C@@H]3O[C@@H](COC(=O)CC(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)c1C2=O,C15063178_decoy,TRY1,Decoy,0,-5.29177,-8.79,-2.6,-5.954559935892216
Cc1cc(O)c2c(c1)C(=O)c1cccc(O[C@H]3O[C@@H](COC(=O)CC(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)c1C2=O,C15063181_decoy,TRY1,Decoy,0,-6.25654,-8.21,-1.8,-5.850290290622021
Cc1cc(O)c2c(c1)C(=O)c1cccc(O[C@H]3O[C@H](COC(=O)CC(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]3O)c1C2=O,C15063187_decoy,TRY1,Decoy,0,-5.97473,-6.75,-3.07,-4.914289950047516
Nc1c(C(=O)CSc2nnc(Nc3cccc(Br)c3)s2)c(=O)[nH]c(=O)n1C1CC1,C16698858_decoy,TRY1,Decoy,0,-10.0235,-7.14,-3.79,-7.294786585440558
COc1ccc(/C=C2\N=C(SCc3nc(N)nc(N)n3)N(c3ccc(OC(F)F)cc3)C2=O)cc1,C17674372_decoy,TRY1,Decoy,0,-9.03752,-8.52,-1.28,-8.0087981921694
C[C@H](Sc1nnc(S[C@@H](C)C(=O)NC(=O)NC(C)(C)C)s1)C(=O)NC(=O)NC(C)(C)C,C18519598_decoy,TRY1,Decoy,0,-9.93813,-6.57,-3.28,-7.382300031138905
C[C@@H](Sc1nnc(S[C@H](C)C(=O)NC(=O)NC(C)(C)C)s1)C(=O)NC(=O)NC(C)(C)C,C18519599_decoy,TRY1,Decoy,0,-8.08793,-6.31,-2.38,-5.491892415797442
Cc1ccc(NC(=O)C[C@H]2SC(N[C@H](c3cccc(Cl)c3)c3c([O-])[nH]c(=O)[nH]c3=O)=NC2=O)cc1,C20135340_decoy,TRY1,Decoy,0,-9.24391,-8.97,-1.6,-7.213754982513753
O=C(C[C@H]1SC(N[C@H](c2ccccc2F)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccc(F)cc1,C20135348_decoy,TRY1,Decoy,0,-8.19792,-8.91,-2.63,-6.3913955044460575
O=C(C[C@@H]1SC(N[C@H](c2ccccc2F)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccc(F)cc1,C20135354_decoy,TRY1,Decoy,0,-8.63632,-7.08,-1.57,-6.573781080834185
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)C4CCC4)nc3[C@@H](CC(=O)NCCN3CCOCC3)[C@]2(C)CC[C@H]1O,C20504775_decoy,TRY1,Decoy,0,-10.3007,-7.87,-2.79,-7.491686543906772
Cc1ccc([C@@H](NC2=NC(=O)[C@@H](CC(=O)Nc3ccc(F)cc3)S2)c2c([O-])[nH]c(=O)[nH]c2=O)cc1,C20559451_decoy,TRY1,Decoy,0,-8.88063,-9.05,-2.41,-7.355952617703457
Cc1ccc(NC(=O)C[C@H]2SC(N[C@@H](c3ccc(F)cc3)c3c([O-])[nH]c(=O)[nH]c3=O)=NC2=O)cc1,C20559512_decoy,TRY1,Decoy,0,-7.68717,-9.37,-3.32,-6.774745082961339
O=C(C[C@H]1SC(N[C@H](c2ccc(F)cc2)c2c([O-])[nH]c(=O)[nH]c2=O)=NC1=O)Nc1ccc(F)cc1,C20559520_decoy,TRY1,Decoy,0,-8.57856,-6.73,-3.49,-7.951101349681006
CCSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(C(C)C)c2C)n1N,C20911645_decoy,TRY1,Decoy,0,-10.002,-8.41,-2.5,-10.170538965342322
COc1cc([C@H]2[C@H]3CN(C(=O)OC(C)(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)ccc1OCC(N)=O,C04638886_decoy,TRY1,Decoy,0,-7.16873,-4.96,-2.29,-5.705180362248476
COc1cnccc1[C@H]1CCO[P@@](=O)(OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@](C)(O)[C@@H]2O)O1,C28710255_decoy,TRY1,Decoy,0,-8.21217,-8.51,-3.43,-8.25317153653127
CC[C@H](C)n1c(COc2ccc(Cl)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594343_decoy,TRY1,Decoy,0,-7.19251,-5.51,-2.3,-5.112497945194026
COC(=O)C1=c2oc(=O)/c(=C/c3ccc(O)c(OC)c3)n2-c2oc(N)nc2[C@@H]1c1ccc(O)c(OC)c1,C35910732_decoy,TRY1,Decoy,0,-8.88278,-6.41,-1.6,-5.406890832465138
CCCCN1C(=O)N=C([O-])[C@@H](N(Cc2ccccc2)C(=O)CSc2nc(C(C)(C)C)n[nH]2)[C@@H]1[NH3+],C38762947_decoy,TRY1,Decoy,0,-6.77949,-5.74,-2.92,-5.208596361188761
NS(=O)(=O)c1ccc(-n2cccc2/C=N/N=C/c2cccn2-c2ccc(S(N)(=O)=O)cc2)cc1,C02760259_decoy,TRY1,Decoy,0,-8.49873,-7.6,-1.85,-6.919508659269408
Cc1cccc(N2C(SCC(=O)Nc3cccc([N+](=O)[O-])c3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361737_decoy,TRY1,Decoy,0,-8.94888,-7.28,-2.57,-6.7392714608485775
Cc1cccc(N2C(SCC(=O)Nc3cccc([N+](=O)[O-])c3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)c1,C39361738_decoy,TRY1,Decoy,0,-7.69737,-8.16,-1.18,-6.592808752434742
CCOc1ccc(N2C(SCC(=O)Nc3ccc(F)cc3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362551_decoy,TRY1,Decoy,0,-8.57744,-8.35,-1.72,-8.143331045938144
O=C(CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1,C39362824_decoy,TRY1,Decoy,0,-7.88021,-7.58,-2.09,-6.474651408357568
CCCCN1C(=O)N=C([O-])[C@@H](N(C(=O)CSc2nc(-c3cccs3)n[nH]2)C2CCCC2)[C@@H]1[NH3+],C39738029_decoy,TRY1,Decoy,0,-9.04586,-7.31,-3.44,-7.39865305091613
CCCCN1C(=O)N=C([O-])[C@H](N(C(=O)CSc2nc(-c3cccs3)n[nH]2)C2CCCC2)[C@H]1[NH3+],C39738032_decoy,TRY1,Decoy,0,-10.9051,-6.55,-1.61,-8.67201005277363
CCOc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)Nc2nc(Nc3ccc(OC)cc3)[nH]c(=O)c21,C40399975_decoy,TRY1,Decoy,0,-7.99055,-6.4,-1.59,-5.7185627021879615
NC(=O)COc1ccc([C@@H]2c3c(-c4cc(Cl)ccc4O)n[nH]c3C(=O)N2[C@@H]2CCS(=O)(=O)C2)cc1,C38702071_decoy,TRY1,Decoy,0,-8.71864,-7.67,-2.36,-6.705435853909144
NC(=O)COc1ccc([C@@H]2c3c(-c4cc(Cl)ccc4O)n[nH]c3C(=O)N2[C@H]2CCS(=O)(=O)C2)cc1,C40548319_decoy,TRY1,Decoy,0,-8.23098,-7.61,-2.22,-6.634119019204561
C[C@@]12CC/C(=N/OCC(=O)NCc3ccncc3)C=C1CC[C@H]1[C@@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C43741815_decoy,TRY1,Decoy,0,-10.1088,-7.09,-2.66,-6.888750231033815
C[C@@]12CC/C(=N/OCC(=O)NCc3ccncc3)C=C1CC[C@@H]1[C@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C43741817_decoy,TRY1,Decoy,0,-9.30632,-7.59,-3.52,-5.818553003111159
C[C@@H]1CCc2c(sc3nc(CSc4nnc(CCC(N)=O)n4C[C@@H]4CCCO4)nc(N)c23)C1,C45842374_decoy,TRY1,Decoy,0,-10.4588,-8.31,-1.84,-8.714771743327615
C[C@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C45850523_decoy,TRY1,Decoy,0,-8.33448,-8.07,-4.19,-8.206183219176868
C[C@@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2,C45850525_decoy,TRY1,Decoy,0,-9.80413,-7.13,-4.01,-6.5451291617334295
[H]/N=C1\C(=O)c2nc(-c3nc(C(=O)OC)c(C)c(-c4ccc(OC)c(OC)c4O)c3N)ccc2C([O-])=C1OC,C04213833_decoy,TRY1,Decoy,0,-9.29247,-8.13,-1.74,-6.536603691742266
COc1ccc([C@@H]2C3=C(C[C@@H](c4cc(OC)c(OC)c(OC)c4)CC3=O)Nc3[nH]nc(O)c32)cc1O,C20102602_decoy,TRY1,Decoy,0,-7.04954,-5.02,-3.18,-4.83599918716459
COc1cc(NC(=O)[C@@H]2CC(=O)Nc3nc(Nc4ccc(Cl)cc4)[nH]c(=O)c32)cc(OC)c1OC,C54202246_decoy,TRY1,Decoy,0,-9.35323,-7.72,-3.37,-7.181932059039146
COc1cc(NC(=O)[C@H]2CC(=O)Nc3nc(Nc4ccc(Cl)cc4)[nH]c(=O)c32)cc(OC)c1OC,C54202247_decoy,TRY1,Decoy,0,-9.38196,-8.32,-2.82,-7.277925161167673
COc1cccc(/C=N/NC(=O)CCCSc2nnc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2N)c1O,C58990094_decoy,TRY1,Decoy,0,-8.99591,-8.13,-4.49,-8.643047347486174
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3ccccc3[N+](=O)[O-])n2N)sc2c1CCCC2,C59884769_decoy,TRY1,Decoy,0,-7.64733,-8.39,-1.56,-7.000666855751481
COc1cccc([C@@H]2N[C@](Cc3c[nH+]c[nH]3)(C(=O)[O-])[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@H]23)c1O,C15276767_decoy,TRY1,Decoy,0,-8.5697,-6.37,-1.24,-6.3375520202580695
COc1ccc([C@@H](c2c([O-])[nH]c(=S)[nH]c2=O)[C@@H]2C(=O)NC(=S)N=C2[O-])cc1C[NH+]1CCCC1,C38596688_decoy,TRY1,Decoy,0,-7.74147,-5.46,-2.27,-5.3342663650931135
COc1cc2ccc(=O)oc2c(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c1O,C01784491_decoy,TRY1,Decoy,0,-5.61728,-6.37,-1.27,-4.46286945971626
Cc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C04340316_decoy,TRY1,Decoy,0,-5.40739,-7.58,-2.67,-4.840725964052115
COc1cc2c3c(c1)[C@@]1(C(=O)N3C(C)(C)C=C2C)C(C#N)=C(N)NC(=O)[C@H]1C(N)=O,C02412325_decoy,TRY1,Decoy,0,-6.14747,-5.4,-1.27,-4.145260019902977
COc1cc2c3c(c1)[C@]1(C(=O)N3C(C)(C)C=C2C)C(C#N)=C(N)NC(=O)[C@@H]1C(N)=O,C02412322_decoy,TRY1,Decoy,0,-6.13489,-5.22,-0.81,-3.909799355530773
N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C04939456_decoy,TRY1,Decoy,0,-5.9046,-4.98,-2.17,-3.920842928250236
Nc1nc(N2CCCCC2)c2nc(Cl)n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05015054_decoy,TRY1,Decoy,0,-7.02364,-6.37,-1.42,-4.686215467579144
Nc1nc(NCCOCCO)nc(Nc2ccc(Cl)cc2)c1[N+](=O)[O-],C05091241_decoy,TRY1,Decoy,0,-6.92784,-6.09,-1.09,-7.382887492032123
O=c1nc[nH]c2c1nc(NCc1ccccc1)n2[C@@H]1O[C@@H](CO)[C@H](O)[C@H]1O,C05483952_decoy,TRY1,Decoy,0,-6.95962,-7.15,-3.44,-7.340617797167643
Cc1cc(O)c2c(c1)C(=O)c1cc(O[C@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)cc(O)c1C2=O,C05742777_decoy,TRY1,Decoy,0,-7.46505,-8.15,-1.91,-5.929227425517796
COc1cc2ccc(=O)oc2c(O)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C12419742_decoy,TRY1,Decoy,0,-7.20879,-5.29,-0.34,-4.986956162609521
CC(C)=CCNc1ncnc2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c12,C05386538_decoy,TRY1,Decoy,0,-7.32856,-4.9,-2.53,-4.2876323969098
COc1cc([C@@H]2C(C#N)=C(C)Nc3nc(N)nc(N)c32)cc(OC)c1OC,C05501417_decoy,TRY1,Decoy,0,-7.2143,-7.22,-0.7,-8.416616983962987
COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1O,C13424699_decoy,TRY1,Decoy,0,-6.32365,-5.58,-0.65,-5.176118724094043
O=C1c2ccccc2O[C@H]2C=C(O)[C@@H]([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)C(=O)[C@@H]12,C13424757_decoy,TRY1,Decoy,0,-6.34098,-7.76,-2.63,-4.632408106316691
O=C1c2ccccc2O[C@H]2C=C(O)[C@@H]([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)C(=O)[C@H]12,C13424758_decoy,TRY1,Decoy,0,-6.33041,-7.25,-2.1,-4.147093748643308
COc1cc2ccc(=O)oc2c(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c1O,C13424931_decoy,TRY1,Decoy,0,-6.03079,-5.25,-2.37,-4.461170810204621
N#Cc1cnc(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)nc1N,C12534103_decoy,TRY1,Decoy,0,-8.43277,-7.3,-1.59,-9.866481975887432
Cc1cc(O)c2c(c1)C(=O)c1cc(O[C@H]3O[C@H](C)[C@@H](O)[C@H](O)[C@@H]3O)cc(O)c1C2=O,C14814268_decoy,TRY1,Decoy,0,-6.72713,-7.19,-2.12,-4.35160972593991
COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)c1O,C19893931_decoy,TRY1,Decoy,0,-5.67507,-5.57,-0.74,-4.272392134018246
Nc1nc(I)nc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C26504975_decoy,TRY1,Decoy,0,-6.99814,-5.39,-0.9,-4.029130186509832
Nc1nc(I)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C26504979_decoy,TRY1,Decoy,0,-6.74502,-4.78,-0.67,-3.382793215607496
NC(=S)/C(=N/Nc1ccc(S(N)(=O)=O)cc1)C(=O)N1CCOCC1,C08694657_decoy,TRY1,Decoy,0,-8.41604,-5.71,-0.7,-5.312558003877826
O=c1[nH]cnc2c1nc(NCc1ccccc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09209178_decoy,TRY1,Decoy,0,-6.23589,-7.58,-1.06,-7.678021865801833
C/C(=C\C(=O)Nc1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(O)cc1O,C05289225_decoy,TRY1,Decoy,0,-8.26363,-8.69,-0.46,-7.767357200721626
C[C@H]1Cc2c(CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)ccc(O)c2C(=O)O1,C35457540_decoy,TRY1,Decoy,0,-7.0244,-6.1,-1.91,-4.638687936308478
O=c1[nH]cnc2c1nc(NCc1ccccc1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09209177_decoy,TRY1,Decoy,0,-5.81936,-7.56,-2.5,-6.493109789122075
OC[C@H](O)/C=N/Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1,C04181422_decoy,TRY1,Decoy,0,-8.44688,-6.61,-1.16,-7.079263269015399
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1c(Br)nc2c(=O)[nH]c(N)nc21,C38580959_decoy,TRY1,Decoy,0,-6.48343,-4.43,-1.41,-4.50130670783868
COc1cc(/C=N/N=C2\NC(=O)[C@@H](CC(=O)NC(N)=O)S2)ccc1O,C39881906_decoy,TRY1,Decoy,0,-8.36364,-7.02,-1.58,-6.116142249489242
CC[C@@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2cccc3cccnc23)n1,C41334144_decoy,TRY1,Decoy,0,-7.31515,-7.72,-3.41,-7.390032382335284
CC[C@H](CO)Nc1nc(N)c([N+](=O)[O-])c(Nc2cccc3cccnc23)n1,C41334149_decoy,TRY1,Decoy,0,-6.71705,-7.63,-1.32,-6.835584801426488
CC(C)c1nnc(NC(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1,C43696135_decoy,TRY1,Decoy,0,-8.29231,-9.05,-1.68,-11.963730496739638
Nc1ccccc1C1=NC(=O)[C@]2(CC(c3ccc([N+](=O)[O-])cc3)=NN2)NN1,C12534116_decoy,TRY1,Decoy,0,-7.31216,-6.42,-1.54,-4.630948697221882
Nc1ccccc1C1=NC(=O)[C@@]2(CC(c3ccc([N+](=O)[O-])cc3)=NN2)NN1,C12534117_decoy,TRY1,Decoy,0,-7.29063,-5.96,-1.82,-4.178891978181121
C/C(=N\Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(O)cc1O,C12648954_decoy,TRY1,Decoy,0,-9.142,-7.27,-1.21,-7.947389511492125
N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@@H]1c1cccc(OCC(N)=O)c1,C08748294_decoy,TRY1,Decoy,0,-8.52492,-5.34,-2.1,-4.906605433848576
Cc1ccc(C)c(C2=N[C@H]3NC(=O)NC(=O)[C@@H]3[C@@H]2[C@H]2C(=O)NC(=O)N=C2N)c1,C63279477_decoy,TRY1,Decoy,0,-6.33769,-5.65,-0.96,-3.6600079618251775
Cc1ccc(C)c(C2=N[C@@H]3NC(=O)NC(=O)[C@H]3[C@@H]2[C@H]2C(=O)NC(=O)N=C2N)c1,C63279480_decoy,TRY1,Decoy,0,-8.57607,-5.38,-2.79,-4.368912181369361
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2cccc(Cl)c2)=N[C@@H]2NC(=O)NC(=O)[C@H]12,C63279597_decoy,TRY1,Decoy,0,-6.90941,-5.39,-0.8,-4.427413408816026
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2cccc(Cl)c2)=N[C@@H]2NC(=O)NC(=O)[C@@H]12,C63279599_decoy,TRY1,Decoy,0,-8.62614,-5.52,-0.49,-4.686633820613502
CC(C)c1ccc(C2=N[C@H]3NC(=O)NC(=O)[C@@H]3[C@@H]2[C@H]2C(=O)NC(=O)N=C2N)cc1,C63280646_decoy,TRY1,Decoy,0,-7.0665,-5.59,-1.15,-4.787871094400517
CC(C)c1ccc(C2=N[C@H]3NC(=O)NC(=O)[C@H]3[C@@H]2[C@H]2C(=O)NC(=O)N=C2N)cc1,C63280650_decoy,TRY1,Decoy,0,-6.73064,-5.36,-2.03,-3.676462971377642
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(Cl)c(Cl)c2)=N[C@@H]2NC(=O)NC(=O)[C@H]12,C63295755_decoy,TRY1,Decoy,0,-7.66882,-5.15,-0.98,-4.424248882617257
O=C(NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O)Nc1cc(F)cc(F)c1,C63321354_decoy,TRY1,Decoy,0,-7.29602,-6.98,-0.9,-7.9864453667103
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(Cl)cc2)=N[C@H]2NC(=O)NC(=O)[C@H]12,C63529328_decoy,TRY1,Decoy,0,-6.70778,-5.68,-1.2,-4.098606500027938
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(Cl)cc2)=N[C@H]2NC(=O)NC(=O)[C@@H]12,C63529330_decoy,TRY1,Decoy,0,-6.61923,-5.51,-0.77,-4.150250958082729
NC1=NC(=O)NC(=O)[C@@H]1[C@@H]1C(c2ccc(Cl)cc2)=N[C@@H]2NC(=O)NC(=O)[C@@H]12,C63529331_decoy,TRY1,Decoy,0,-7.66169,-5.36,-1.3,-4.553901936890143
Cc1ccc(C2=Nc3[nH]c(=O)[nH]c(=O)c3[C@H]2[C@@H]2C(=O)NC(=O)N=C2N)c(C)c1,C39231986_decoy,TRY1,Decoy,0,-5.81809,-6.05,-2.77,-3.882724385649668
Cc1ccc(C)c(C2=Nc3[nH]c(=O)[nH]c(=O)c3[C@@H]2[C@@H]2C(=O)NC(=O)N=C2N)c1,C39272069_decoy,TRY1,Decoy,0,-6.57024,-5.62,-2.79,-4.123407723787136
C[C@H](NC(=O)Nc1ccc2c(c1)C(=O)NC2=O)c1ccc2[nH]c(=O)[nH]c2c1,C65804463_decoy,TRY1,Decoy,0,-7.32217,-8.65,-0.4,-11.56135105159631
CC(C)C[NH2+]CC(=O)Nc1sc2c(c1C(=O)Nc1ccccc1F)CC[C@H](C)C2,C04554474_decoy,TRY1,Decoy,0,-8.93659,-6.28,-2.5,-6.037988174707967
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)n2)cc1C,C04740292_decoy,TRY1,Decoy,0,-9.94192,-5.83,-1.26,-5.389391964752863
Cc1cc(C)cc(NC(=O)NC2CC[NH+](CC(=O)Nc3c(C)cc(C)cc3C)CC2)c1,C04908743_decoy,TRY1,Decoy,0,-8.80601,-6.82,-2.58,-6.6077817331663065
CSc1nc(NCC[NH3+])c2sc3nc(C(C)C)c4c(c3c2n1)CC(C)(C)OC4,C02397576_decoy,TRY1,Decoy,0,-11.3633,-5.45,-2.43,-6.681023054197382
Nc1nc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)nc(Nc2ccc(Cl)cc2)n1,C04618660_decoy,TRY1,Decoy,0,-9.85114,-5.97,-1.48,-5.520358667799286
C/C(=N\N)[C@H](C[NH+]1CCCCC1)[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O,C05831802_decoy,TRY1,Decoy,0,-7.06092,-6.24,-1.79,-5.5547105682125215
C[NH+]1CCc2nc3sc(C(=O)Nc4ccccc4OC(F)(F)F)c(N)c3cc2C1,C08583717_decoy,TRY1,Decoy,0,-8.04141,-8.01,-1.78,-8.17321389238336
CC(C)[NH+]1CCc2c(sc(NC(=O)c3sc4ccccc4c3Cl)c2C(N)=O)C1,C09390612_decoy,TRY1,Decoy,0,-8.32398,-5.23,-0.46,-5.488284313508936
CC1(C)CC(NC(=O)CCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)CC(C)(C)[NH2+]1,C10812429_decoy,TRY1,Decoy,0,-8.88001,-6.01,-2.56,-6.18978137489449
Oc1ccc[nH+]c1N[C@@H](c1ccc(Br)cc1)c1ccc2cccnc2c1O,C09636268_decoy,TRY1,Decoy,0,-8.82292,-8.23,-1.54,-12.607858951492418
COc1ccc2c([C@@H](O)C[NH+]3CCC4(CC3)C[C@@H](O)c3cc(C)ccc3O4)c[nH]c2c1,C12293236_decoy,TRY1,Decoy,0,-8.31531,-7.02,-1.96,-5.475666236614246
COc1ccc2c([C@@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3cc(C)ccc3O4)c[nH]c2c1,C12293241_decoy,TRY1,Decoy,0,-9.49575,-7.41,-2.74,-5.456537950300217
COc1ccc2c([C@H](O)C[NH+]3CCC4(CC3)C[C@H](O)c3cc(C)ccc3O4)c[nH]c2c1,C12293244_decoy,TRY1,Decoy,0,-8.456,-6.66,-1.33,-4.596083434479739
COc1ccc2[nH]c(C)c([C@@H](O)C[NH+]3CCC4(CC3)C[C@@H](O)c3ccccc3O4)c2c1,C12329186_decoy,TRY1,Decoy,0,-8.05577,-7.01,-1.77,-6.148282093321232
COc1ccc2[nH]c(C)c([C@H](O)C[NH+]3CCC4(CC3)C[C@@H](O)c3ccccc3O4)c2c1,C12329188_decoy,TRY1,Decoy,0,-8.82577,-7.23,-3.08,-6.138450391205012
COc1ccc2c(c1)OC1(CC[NH+](C[C@@H](O)c3c[nH]c4cc(C)ccc34)CC1)C[C@H]2O,C12329701_decoy,TRY1,Decoy,0,-9.2434,-7.19,-1.69,-5.5283207436361
COc1ccc2c(c1)OC1(CC[NH+](C[C@H](O)c3c[nH]c4cc(C)ccc34)CC1)C[C@@H]2O,C12329705_decoy,TRY1,Decoy,0,-9.12196,-7.06,-1.08,-5.551489853821877
COc1ccc2c(c1)OC1(CC[NH+](C[C@H](O)c3c[nH]c4cc(C)ccc34)CC1)C[C@H]2O,C12329708_decoy,TRY1,Decoy,0,-7.84999,-7.8,-2.04,-5.097152709060631
NC(=O)[C@@H]1CN(c2nc(-c3cccs3)nc3scc(-c4ccccc4)c23)CC[NH2+]1,C09414088_decoy,TRY1,Decoy,0,-8.8255,-6.05,-3.43,-4.865795769110248
NC(=O)[C@H]1CN(c2nc(-c3cccs3)nc3scc(-c4ccccc4)c23)CC[NH2+]1,C09414090_decoy,TRY1,Decoy,0,-8.92952,-6.16,-1.58,-5.012548851477466
Cc1c(Cl)cccc1NC(=O)[C@@H](C)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12941307_decoy,TRY1,Decoy,0,-7.88051,-7.26,-0.75,-5.780038239399256
Cc1c(Cl)cccc1NC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C12941314_decoy,TRY1,Decoy,0,-8.05936,-7.18,-2.65,-5.749031491429672
Oc1ccc(Br)c([C@@H](Nc2cccc[nH+]2)c2ccc3cccnc3c2O)c1,C15015559_decoy,TRY1,Decoy,0,-7.73739,-7.96,-1.81,-8.011332982391707
CCc1ccc(-n2c(O)nc(O)c([C@H]3c4[nH]c5ccccc5c4CC[NH+]3CC)c2=O)cc1,C09042844_decoy,TRY1,Decoy,0,-7.34583,-5.8,-2.99,-4.0433190957861385
CC(=O)Nc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2cc(Cl)c(C)cc2O3)cc1,C19125660_decoy,TRY1,Decoy,0,-8.77878,-7.66,-3.31,-9.150437282810618
CC(=O)Nc1ccc([C@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2cc(Cl)c(C)cc2O3)cc1,C19125667_decoy,TRY1,Decoy,0,-9.68404,-6.78,-2.06,-5.193701470332688
COc1ccc2c(c1)[C@H](O)CC1(CC[NH+](C[C@@H](O)c3c[nH]c4ccc(C)cc34)CC1)O2,C19220546_decoy,TRY1,Decoy,0,-8.96562,-8.84,-2.28,-6.2751180348463125
COc1ccc2c(c1)[C@@H](O)CC1(CC[NH+](C[C@@H](O)c3c[nH]c4ccc(C)cc34)CC1)O2,C19220550_decoy,TRY1,Decoy,0,-8.99857,-7.79,-2.07,-5.784123877406544
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCC(c2nc3cc(Cl)ccc3s2)CC1,C25036541_decoy,TRY1,Decoy,0,-8.37723,-4.77,-2.58,-4.640589975633553
C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)[NH+](C)Cc1ccccc1OC(F)(F)F,C25534289_decoy,TRY1,Decoy,0,-7.10594,-7.67,-4.05,-6.7384808739995385
CC[NH+]1CCC(NC(=O)CSc2nc(N)c3c4c(sc3n2)C[C@H](C)CC4)CC1,C27315112_decoy,TRY1,Decoy,0,-8.68359,-7.63,-2.31,-6.3104564023007255
[H]/N=c1\sc(-c2cc(C[NH3+])ccn2)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl,C29467625_decoy,TRY1,Decoy,0,-10.5101,-5.99,-2.3,-7.537265493612913
Cc1cccc(C)c1NC(=O)C[NH+](C)Cc1nc(N)c2c3c(sc2n1)CCCCC3,C31153636_decoy,TRY1,Decoy,0,-8.05702,-7.47,-1.42,-6.202239453266466
C[C@H]1CCc2c(sc3nc(CC[NH+]4CCN(c5ccccc5O)CC4)nc(N)c23)C1,C32850908_decoy,TRY1,Decoy,0,-9.75424,-8.79,-1.51,-6.243811734292188
C[NH+]1CCN(c2cc(NCc3ccco3)c3c(c2N)C(=O)c2ccccc2C3=O)CC1,C06662619_decoy,TRY1,Decoy,0,-8.29412,-1.75,-0.37,-4.1620592160049
Nc1c2c(-c3ccc(F)cc3)nc(N3CCC[NH2+]CC3)nc2nn1Cc1ccccc1,C35929916_decoy,TRY1,Decoy,0,-7.69529,-6.62,-1.77,-5.527913364053946
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@](C)([NH3+])C1CC1,C37769948_decoy,TRY1,Decoy,0,-6.96481,-4.68,-1.25,-4.750917884567167
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@](C)([NH3+])C1CC1,C37769949_decoy,TRY1,Decoy,0,-7.2246,-5.18,-3.59,-5.28952516138207
Cc1ccc(NC(=O)NNC(=O)C2CC[NH+](Cc3ccc(F)cc3Cl)CC2)cc1,C05600489_decoy,TRY1,Decoy,0,-8.16365,-7.63,-2.57,-5.7286100949742575
O=c1[nH]c(CS[C@H]2NN[C@@H]([NH+]3CCCC3)N2c2cccc(Cl)c2)nc2ccc(Cl)cc12,C39462579_decoy,TRY1,Decoy,0,-9.55071,-8.71,-2.24,-7.599818810487882
Nc1c(Nc2cc(Cl)cc(Cl)c2)ncnc1N1CCN(c2cccc[nH+]2)CC1,C40701137_decoy,TRY1,Decoy,0,-8.23201,-6.77,-1.72,-5.135247690957247
Nc1c(N(Cc2ccccc2)c2ccccn2)nc[nH+]c1Nc1cccc2cccnc12,C40758450_decoy,TRY1,Decoy,0,-7.76041,-7.89,-1.02,-8.313209362535847
CC(C)c1ccc2c(c1)CC[C@@H]1[C@@](C)(CNC(=O)c3coc([C@@H](C)[NH3+])n3)CCC[C@]21C,C43209778_decoy,TRY1,Decoy,0,-10.0244,-6.71,-4.31,-6.39413344982854
CC(C)c1ccc2c(c1)CC[C@H]1[C@@](C)(CNC(=O)c3coc([C@@H](C)[NH3+])n3)CCC[C@]21C,C43209780_decoy,TRY1,Decoy,0,-8.65505,-6.89,-4.77,-5.969636633189234
CC(C)c1ccc2c(c1)CC[C@H]1[C@@](C)(CNC(=O)c3coc([C@H](C)[NH3+])n3)CCC[C@]21C,C43213437_decoy,TRY1,Decoy,0,-9.13142,-7.5,-3.04,-7.74677538650345
CCCc1c(N[C@@H]2CCC[NH2+]C2)c(C#N)c2ccnn2c1Nc1ccc(OCC)cc1,C45316016_decoy,TRY1,Decoy,0,-7.75407,-6.75,-1.33,-5.603334977467793
Cc1cc([C@H](n2nnc3ccccc32)C(O)(c2ccccc2)c2ccccc2)c[nH+]c1N,C05379291_decoy,TRY1,Decoy,0,-7.2886,-6.98,-0.73,-5.785296250365965
Cc1cc([C@@H](n2nnc3ccccc32)C(O)(c2ccccc2)c2ccccc2)c[nH+]c1N,C05379301_decoy,TRY1,Decoy,0,-9.34994,-7.25,-1.51,-6.839326702783707
NC1=[NH+]/C(=N\NC(=O)COc2ccc(Br)cc2Br)c2ccccc21,C08659103_decoy,TRY1,Decoy,0,-8.57138,-8.35,-1.49,-9.342639454361883
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1Cc2ccccc2-c2ccccc2C1,C60361360_decoy,TRY1,Decoy,0,-9.891,-8.19,-3.55,-10.1117016281963
Nc1ccc(C(=O)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C12296277_decoy,TRY1,Decoy,0,-6.54211,-7.25,-2.25,-6.802901032829005
Nc1ccc(C(=O)OC[C@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C12296278_decoy,TRY1,Decoy,0,-6.68663,-7.97,-3.05,-7.339122643562224
Nc1ccc(C(=O)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C12296279_decoy,TRY1,Decoy,0,-5.74224,-7.15,-3.37,-5.827333856259116
Cc1cc(N[C@@H]2O[C@H]([C@@H](O)CO)[C@H](O)[C@H]2O)c(N[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C12654621_decoy,TRY1,Decoy,0,-7.27019,-6.37,-3.56,-7.174914901775127
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@@H](O)[C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1O,C14854902_decoy,TRY1,Decoy,0,-8.61924,-8.51,-3.33,-6.860271696044989
O=C(OC[C@@H]1O[C@@H](O)[C@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O)c1cc(O)c(O)c(O)c1,C15657784_decoy,TRY1,Decoy,0,-8.91305,-10.13,-1.81,-8.846051934987269
O=C(NCCCCCCNC(=O)N[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O)N[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O,C16953148_decoy,TRY1,Decoy,0,-4.66236,-8.25,-3.48,-7.034563079233217
Nc1ccc2c(NCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]43)c3ccc(N)cc3[nH+]c2c1,C22047723_decoy,TRY1,Decoy,0,-10.6545,-8.9,-3.04,-8.800691985637103
Nc1ccc2c(NCCNC(=O)CCCC[C@H]3SC[C@@H]4NC(=O)N[C@@H]43)c3ccc(N)cc3[nH+]c2c1,C22047728_decoy,TRY1,Decoy,0,-9.47438,-9.91,-2.64,-8.961756305715287
Nc1ccc2c(NCCNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@H]34)c3ccc(N)cc3[nH+]c2c1,C22047734_decoy,TRY1,Decoy,0,-9.50764,-9.96,-3.24,-8.759591408296691
Nc1ccc2c(NCCNC(=O)CCCC[C@H]3SC[C@H]4NC(=O)N[C@@H]43)c3ccc(N)cc3[nH+]c2c1,C22047739_decoy,TRY1,Decoy,0,-9.18868,-10.1,-4.05,-7.908038373821684
O=C(OC[C@H]1O[C@H](O)[C@@](O)(COC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1O)c1cc(O)c(O)c(O)c1,C25763027_decoy,TRY1,Decoy,0,-8.84766,-10.21,-3.01,-8.942806520814015
Nc1ccc2c(NCCNC(=O)CCCC[C@H]3SC[C@H]4NC(=O)N[C@H]43)c3ccc(N)cc3[nH+]c2c1,C34704431_decoy,TRY1,Decoy,0,-9.04603,-9.17,-3.25,-8.586035793829156
Nc1ccc2c(NCCNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]34)c3ccc(N)cc3[nH+]c2c1,C34704432_decoy,TRY1,Decoy,0,-9.9003,-7.89,-3.19,-8.167908547853926
Cc1cc(N[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)c(N[C@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)cc1C,C08740337_decoy,TRY1,Decoy,0,-6.37764,-8.51,-2.81,-9.579293314768108
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1O[C@@H](OC[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)[C@@H](O)[C@H]1O,C35454592_decoy,TRY1,Decoy,0,-9.19423,-8.76,-2.78,-8.169057733042907
O=C(N/N=C/[C@@H](O)[C@H](O)[C@@H](COC[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33897337_decoy,TRY1,Decoy,0,-7.0477,-6.91,-4.03,-6.551430686506259
O=C(N/N=C/[C@@H](O)[C@@H](O)[C@@H](COC[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)CO)c1ccccc1O,C33957511_decoy,TRY1,Decoy,0,-8.70264,-7.84,-2.81,-7.221846123404266
Nc1ccc(C(=O)OC[C@@H]2O[C@@H](O[C@]3(CO)O[C@@H](CO)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C37262701_decoy,TRY1,Decoy,0,-6.97737,-7.84,-3.08,-7.889334467319891
OC[C@@H]1O[C@H](OC[C@@H]2O[C@@H]([NH2+]CCc3ccc(O)cc3)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C36378615_decoy,TRY1,Decoy,0,-6.93727,-8.13,-2.86,-6.385744641399024
OC[C@@H]1O[C@H](OC[C@@H]2O[C@H]([NH2+]CCc3ccc(O)cc3)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C36378612_decoy,TRY1,Decoy,0,-7.18197,-8.02,-3.42,-5.925906133795143
CN(CC[C@@H]([NH3+])CC(=O)N[C@@H]1C=C[C@H](n2ccc(N)nc2=O)O[C@@H]1C(=O)[O-])C(N)=[NH2+],C03869447_decoy,TRY1,Decoy,0,-9.00617,-7.84,-2.13,-7.881473758882725
CSCC[C@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@@H]1O[C@@H](N2C=NC3=C([NH3+])NC=N[C@@H]32)[C@@H](O)[C@H]1O,C38664793_decoy,TRY1,Decoy,0,-12.3831,-7.36,-2.18,-9.37724100970433
CSCC[C@@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@@H]1O[C@@H](N2C=NC3=C([NH3+])NC=N[C@@H]32)[C@@H](O)[C@H]1O,C38664794_decoy,TRY1,Decoy,0,-12.1415,-7.72,-1.38,-10.141349911173444
N[C@H]1CS(=O)(=O)C[C@H]1NC(=O)NCCCCCCNC(=O)N[C@H]1CS(=O)(=O)C[C@@H]1[NH3+],C37530470_decoy,TRY1,Decoy,0,-10.9364,-5.17,-2.92,-6.637535236022846
NC(=O)c1c(Nc2nc(NCC[NH2+]CCO)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026402_decoy,TRY1,Decoy,0,-8.16975,-6.87,-2.63,-9.35965480266652
NC(=O)c1c(Nc2nc(NCC[NH2+]CCO)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301920_decoy,TRY1,Decoy,0,-8.03773,-6.6,-1.35,-9.172714670622767
Cc1cc(N[C@@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)c(N[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]2O)cc1C,C08740339_decoy,TRY1,Decoy,0,-6.84232,-8.48,-3.25,-8.248369270298362
C[C@H](Cc1ccc(O)c[nH+]1)[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C48998342_decoy,TRY1,Decoy,0,-8.42107,-7.28,-3.63,-6.660862866040807
Nc1ccc(SC[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]2O[C@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)nc1,C48999958_decoy,TRY1,Decoy,0,-5.96252,-7.36,-3.13,-5.206083133111743
C[C@@H](Cc1ccc(O)c[nH+]1)[C@H]([NH3+])C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C49114484_decoy,TRY1,Decoy,0,-6.85306,-8.62,-1.91,-6.820531009194224
OC[C@@H](O)[C@@H]1O[C@H](Nc2cccc(N[C@H]3O[C@@H]([C@H](O)CO)[C@@H](O)[C@@H]3O)c2)[C@H](O)[C@@H]1O,C04254077_decoy,TRY1,Decoy,0,-6.12601,-7.38,-3.63,-5.951954312709727
C[C@@H](C(=O)NC1CCCCC1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCCC1,C04161227_decoy,TRY1,Decoy,0,-7.56874,-7.76,-0.81,-7.566728079518855
C[C@H](C(=O)NC1CCCCC1)N(C(=O)c1snc(C(N)=O)c1N)C1CCCCC1,C04161228_decoy,TRY1,Decoy,0,-8.32655,-6.17,-3.18,-6.018937822931571
C[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C04191465_decoy,TRY1,Decoy,0,-7.03864,-5.48,-1.4,-6.16741757661454
C[C@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C04191475_decoy,TRY1,Decoy,0,-8.43057,-7.1,-3.71,-7.714515673610458
Cc1ccc(Nc2nc(N)nc(CSc3nnc(-c4ccc(C)cc4)n3N)n2)cc1,C05321342_decoy,TRY1,Decoy,0,-8.23668,-7.19,-1.32,-6.193946768389221
CC(=O)Oc1c(OC(C)=O)c(-c2ccc(O)c(O)c2)c(O)c(O)c1-c1ccc(O)cc1,C05808314_decoy,TRY1,Decoy,0,-8.68771,-1.7,-2.64,-4.433855529992565
NC(=O)N[C@H](CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)cc1,C06549498_decoy,TRY1,Decoy,0,-9.43525,-7.87,-0.79,-7.660908537041562
NC(=O)N[C@@H](CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)cc1,C06549500_decoy,TRY1,Decoy,0,-9.14898,-7.67,-1.88,-9.836531270896872
COc1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NCCNC(C)=O)[C@H]32)cc1,C08636372_decoy,TRY1,Decoy,0,-9.60317,-7.16,-1.98,-6.589374856111696
NC(=O)c1c(NC(=O)CSc2nnc(C(F)(F)F)n2N)sc2c1CCCC2,C03317694_decoy,TRY1,Decoy,0,-9.9051,-5.76,-3.52,-5.927262083672657
Nc1nc(N)c(-c2ccc(Cl)c(Cl)c2)c(CNc2ccc(C(=O)CCl)cc2)n1,C13283442_decoy,TRY1,Decoy,0,-7.22927,-9.06,-1.43,-8.281141119586028
C/C(=C\C(=O)Nc1cc(Cl)ccc1Cl)NNC(=O)c1cc(N)cc([N+](=O)[O-])c1,C03090002_decoy,TRY1,Decoy,0,-9.33666,-7.51,-1.53,-7.53219360586502
C[NH2+]CC[C@H](Oc1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c2ccccc12)c1cccs1,C22060630_decoy,TRY1,Decoy,0,-8.48976,-7.68,-3.44,-7.241639117000598
CN(CCO)c1nc(N)c2c(N)nc3c(c2c1C#N)CC(=O)N3CCC1=CCCCC1,C23444267_decoy,TRY1,Decoy,0,-7.85646,-5.2,-1.29,-4.367286525140061
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)CO)c1ccccc1Cl,C36547675_decoy,TRY1,Decoy,0,-7.07103,-5.48,-1.14,-5.562184724136987
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)CO)c1ccccc1Cl,C36547676_decoy,TRY1,Decoy,0,-7.86797,-4.49,-5.11,-5.235536502561129
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)CO)c1cccc(Cl)c1,C36552189_decoy,TRY1,Decoy,0,-7.59758,-5.13,-1.78,-5.541777762809931
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)CO)c1cccc(Cl)c1,C36552190_decoy,TRY1,Decoy,0,-8.48183,-5.1,-1.58,-6.042311623777967
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)C(C)(C)C,C36591384_decoy,TRY1,Decoy,0,-6.74104,-6.21,-1.75,-5.88702156487159
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)C(C)(C)C,C36591385_decoy,TRY1,Decoy,0,-6.46803,-6.29,-1.5,-5.79341303131068
NN1[C@@H](SCC(=O)Nc2nccs2)NN[C@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C39007669_decoy,TRY1,Decoy,0,-8.95237,-8.57,-0.54,-6.945871095853782
NN1[C@@H](SCC(=O)Nc2nccs2)NN[C@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39007670_decoy,TRY1,Decoy,0,-9.75103,-7.82,-1.36,-10.03348580983628
NN1[C@@H](SCC(=O)Nc2nccs2)NN[C@@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C39007671_decoy,TRY1,Decoy,0,-10.7289,-8.16,-2.14,-7.943974825270565
NN1[C@@H](SCC(=O)Nc2nccs2)NN[C@@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39007672_decoy,TRY1,Decoy,0,-10.0235,-8.61,-0.73,-8.394074959903095
Cc1cccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)n1,C39012404_decoy,TRY1,Decoy,0,-9.2765,-8.3,-0.96,-6.715690825870731
CC(C)c1ccc(N2N[NH2+]N[C@H]2SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)cc1,C39647061_decoy,TRY1,Decoy,0,-8.04837,-6.97,-1.96,-5.696054626983199
CC(C)c1ccc(N2N[NH2+]N[C@@H]2SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)cc1,C39647062_decoy,TRY1,Decoy,0,-8.11916,-8.16,-3.57,-6.147989757767894
Nc1nonc1C(=[NH2+])N/N=C/c1ccc(-c2ccc(Br)cc2C(=O)[O-])o1,C02595913_decoy,TRY1,Decoy,0,-8.57233,-5.76,-2.06,-6.500554269034133
Nc1nc(SCC(=O)NN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)n[nH]1,C09502015_decoy,TRY1,Decoy,0,-7.92278,-8.63,-1.3,-7.653159186210189
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3ccc(C)c(Cl)c3)c2N)cc1,C40703797_decoy,TRY1,Decoy,0,-8.43127,-7.8,-3.96,-7.135190343197178
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1N1CCN(CCO)CC1,C40734473_decoy,TRY1,Decoy,0,-8.81338,-5.79,-1.44,-5.622076670781119
COc1ccccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N,C40781541_decoy,TRY1,Decoy,0,-8.68103,-7.64,-1.17,-7.315829267636058
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3ccc(F)c(Cl)c3)c2N)cc1,C40794681_decoy,TRY1,Decoy,0,-9.89575,-7.18,-1.49,-7.150510513392374
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cc(Cl)cc(Cl)c1Cl,C33874513_decoy,TRY1,Decoy,0,-9.32023,-6.16,-1.6,-6.320346586352602
C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1N)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C45481406_decoy,TRY1,Decoy,0,-9.32378,-9.5,-1.37,-8.062290288998396
CN(CNc1ccc([N+](=O)[O-])cc1Br)[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C59378980_decoy,TRY1,Decoy,0,-6.03992,-6.31,-2.5,-4.831526845244644
CN(CNc1ccc([N+](=O)[O-])cc1Br)[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C59378981_decoy,TRY1,Decoy,0,-5.79716,-6.67,-1.03,-5.695036835895345
CCOc1ccc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@@H]2c2ccc(O)cc2O)cc1,C59385001_decoy,TRY1,Decoy,0,-9.97419,-5.17,-1.9,-5.899487080824929
CCOc1ccc(/C=N/NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)cc2O)cc1,C59385002_decoy,TRY1,Decoy,0,-10.2422,-6.53,-1.46,-7.069692185782691
COc1ccc(/C=N/NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(O)cc2O)c(OC)c1,C59385759_decoy,TRY1,Decoy,0,-9.20528,-7.5,-4.0,-9.055816439873196
COc1ccc(/C=N/NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)cc2O)c(OC)c1,C59385760_decoy,TRY1,Decoy,0,-8.0269,-7.82,-1.56,-9.08810646783853
COC(=O)c1ccc(/C=N/NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)cc2O)cc1,C59385769_decoy,TRY1,Decoy,0,-9.04331,-8.29,-1.64,-6.873914388507767
N#C[C@@H](C(N)=O)[C@H](c1ccc(Cl)cc1)c1c(-c2ccccc2)nn(C(N)=S)c1O,C59461812_decoy,TRY1,Decoy,0,-7.70801,-6.46,-2.22,-6.12624845916484
N#C[C@@H](C(N)=O)[C@@H](c1ccc(Cl)cc1)c1c(-c2ccccc2)nn(C(N)=S)c1O,C59461813_decoy,TRY1,Decoy,0,-7.47981,-7.99,-2.39,-9.187882490951647
N#C[C@H](C(N)=O)[C@H](c1ccc(Cl)cc1)c1c(-c2ccccc2)nn(C(N)=S)c1O,C59461814_decoy,TRY1,Decoy,0,-6.94261,-4.82,-2.08,-4.633194625162769
N#C[C@H](C(N)=O)[C@@H](c1ccc(Cl)cc1)c1c(-c2ccccc2)nn(C(N)=S)c1O,C59461815_decoy,TRY1,Decoy,0,-7.9089,-4.5,-1.59,-5.71375854826389
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCc1ccc(Cl)c(Cl)c1,C20292313_decoy,TRY1,Decoy,0,-9.68962,-9.52,-2.93,-8.35214394018976
Nc1nc(OCCc2ccc(Cl)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O,C27564284_decoy,TRY1,Decoy,0,-6.83283,-7.43,-2.56,-6.562794876733725
Nc1nc(OCCc2ccc(Cl)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C28764836_decoy,TRY1,Decoy,0,-6.73411,-6.47,-2.9,-5.50955226194798
Cc1sc(NC(=O)C(F)(F)C(F)(F)C(=O)Nc2sc(C)c(C)c2C(N)=O)c(C(N)=O)c1C,C02098446_decoy,TRY1,Decoy,0,-8.91447,-7.89,-2.85,-7.48875046190169
CCC(C)(C)NC(=O)[C@@H](c1ccc(F)cc1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06462010_decoy,TRY1,Decoy,0,-6.78919,-6.63,-2.0,-7.153429562135161
Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C09090712_decoy,TRY1,Decoy,0,-8.21417,-7.31,-2.47,-6.395794224830366
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1,C12473494_decoy,TRY1,Decoy,0,-8.32917,-7.0,-3.6,-6.360819106402987
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2)cc1,C12477034_decoy,TRY1,Decoy,0,-7.94331,-5.3,-3.24,-5.7662304987677
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2)cc1,C12477044_decoy,TRY1,Decoy,0,-6.59954,-6.41,-0.91,-5.879895037688088
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2)cc1,C12477049_decoy,TRY1,Decoy,0,-7.58185,-5.62,-4.26,-5.45984717116825
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cc(C)ccc2C)cc1,C12477059_decoy,TRY1,Decoy,0,-8.47018,-6.28,-3.22,-6.424267442222325
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12479579_decoy,TRY1,Decoy,0,-8.45824,-5.9,-2.29,-6.075907675365295
Cc1ccc([C@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C(C)C)cc2)cc1,C12479585_decoy,TRY1,Decoy,0,-7.75216,-6.19,-2.22,-6.039287921370972
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1,C12702438_decoy,TRY1,Decoy,0,-6.94078,-7.16,-4.37,-5.804202256870693
NC(=O)c1nsc(C(=O)N(c2cccc(F)c2)[C@H](C(=O)NC2CCCC2)c2cccs2)c1N,C12711074_decoy,TRY1,Decoy,0,-8.53696,-6.51,-1.46,-8.609261895505666
C=C(C)COc1ccc2c(C)c(CC(=O)N(C)C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(=O)oc2c1,C12897218_decoy,TRY1,Decoy,0,-8.38214,-7.04,-4.27,-7.562232924141987
S=C(NNC(=S)Nc1cccc(Cl)c1)NNC(=S)Nc1cccc(Cl)c1,C16399030_decoy,TRY1,Decoy,0,-9.85631,-6.96,-1.54,-8.176228548389421
CC(=O)N[C@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177621_decoy,TRY1,Decoy,0,-11.8885,-6.05,-3.0,-11.635073694373157
CC(C)C(=O)N[C@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177600_decoy,TRY1,Decoy,0,-11.2268,-4.55,-1.95,-6.463159247324883
CC(C)(C)C(=O)N[C@@H](NC(=S)Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl,C04177583_decoy,TRY1,Decoy,0,-11.5276,-6.33,-1.34,-7.002485791571566
NC(=O)c1nsc(C(=O)N(C2CCCC2)[C@@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1N,C19332328_decoy,TRY1,Decoy,0,-8.75138,-8.36,-0.86,-8.538108923892716
Nn1c(N/N=C/c2ccccc2O)nnc1SCC(=O)Nc1ccccc1Br,C20527287_decoy,TRY1,Decoy,0,-8.80965,-8.03,-1.67,-9.733189800188471
CC(C)(C)C(=O)NNC(=O)CSc1n[nH]c(N/N=C/c2c(O)ccc3ccccc23)n1,C20907816_decoy,TRY1,Decoy,0,-8.48165,-8.79,-1.11,-12.26652226222415
Nn1c(N/N=C/c2c(O)ccc3ccccc23)nnc1SCCC(=O)Nc1c(Cl)cccc1Cl,C20916689_decoy,TRY1,Decoy,0,-10.0051,-8.71,-2.97,-7.06708812439472
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)c1O,C20923291_decoy,TRY1,Decoy,0,-9.15852,-5.64,-4.35,-6.5170732407840655
C[NH2+]CC[C@H](Oc1ccc(O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]2O)c2ccccc12)c1cccs1,C22060633_decoy,TRY1,Decoy,0,-8.53963,-7.97,-1.35,-7.251678039191946
CCc1nc(SCC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)nc(N)c1-c1ccc(Cl)cc1,C25589446_decoy,TRY1,Decoy,0,-8.00873,-8.23,-2.11,-6.37256931144223
C/C(=N\NC(=O)c1c(-c2ccccc2)nnn1-c1nonc1N)c1ccc(OCC(N)=O)cc1,C25783512_decoy,TRY1,Decoy,0,-8.73436,-7.85,-3.56,-7.205432648382499
CC(C)=C[C@@H]1OC(=O)/C(=C\CO[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O,C31156607_decoy,TRY1,Decoy,0,-10.0366,-7.4,-2.82,-7.387768241010411
C[C@H](/C=C/NNC1=N[C@@H](c2ccccc2)C(c2ccccc2)=NN1)Sc1ccccc1N,C17210754_decoy,TRY1,Decoy,0,-8.35866,-8.32,-2.08,-7.632568040058912
C[C@@H](/C=C/NNC1=N[C@@H](c2ccccc2)C(c2ccccc2)=NN1)Sc1ccccc1N,C17210760_decoy,TRY1,Decoy,0,-9.05983,-8.14,-1.72,-8.23315800250272
Cc1ccc(C)c([C@@H]2[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(C(C)(C)C)C(=O)[C@H]32)c1,C33703760_decoy,TRY1,Decoy,0,-9.08347,-6.78,-3.46,-8.291468592175315
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)C(C)(C)C,C36584091_decoy,TRY1,Decoy,0,-6.54074,-6.9,-1.08,-6.424735677255127
CCn1c(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)nc2cc(S(N)(=O)=O)ccc21,C08900090_decoy,TRY1,Decoy,0,-9.21145,-7.49,-1.42,-6.34447265744675
O=C(OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12)c1ccccc1,C33832448_decoy,TRY1,Decoy,0,-8.03896,-5.62,-2.7,-5.308439484767637
C[C@H](/C=C/NNC1=N[C@H](c2ccccc2)C(c2ccccc2)=NN1)Sc1ccccc1N,C16957645_decoy,TRY1,Decoy,0,-8.6785,-6.21,-2.06,-5.691410080375316
Cc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccccc4C(C)C)N3N)N=N2)cc1,C38999521_decoy,TRY1,Decoy,0,-9.78503,-6.26,-1.69,-6.272174066591332
COc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccccc4F)N3N)N=N2)cc1,C39000363_decoy,TRY1,Decoy,0,-8.83589,-8.29,-1.06,-6.7100174914640425
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccccc4F)N3N)N=N2)cc1,C39000366_decoy,TRY1,Decoy,0,-8.95951,-9.19,-2.25,-7.491622408000476
COc1ccc(C)cc1NC(=O)CS[C@@H]1NN[C@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C39006936_decoy,TRY1,Decoy,0,-9.95162,-9.0,-2.76,-8.681456298943042
COc1ccc(C2=C[C@@H]([C@H]3NN[C@@H](SCC(=O)Nc4ccc(C)c(Cl)c4)N3N)N=N2)cc1,C39015884_decoy,TRY1,Decoy,0,-9.31625,-6.85,-3.0,-6.5148232151555066
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(C)c(Cl)c4)N3N)N=N2)cc1,C39015887_decoy,TRY1,Decoy,0,-10.6216,-8.72,-1.74,-7.530352099499979
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@@H](SCC(=O)Nc4ccc(C)c(Cl)c4)N3N)N=N2)cc1,C39015889_decoy,TRY1,Decoy,0,-11.7283,-8.24,-0.99,-8.359873231629805
O=C(C[C@H]1CS[C@@H](NC(=O)NCc2cccs2)N1)NCCc1c[nH]c2ccccc12,C39709752_decoy,TRY1,Decoy,0,-9.8228,-8.28,-2.26,-7.826182356744598
Nc1ccc(/C=C/C(=O)N[C@@H](NC(=S)Nc2ccccn2)C(Cl)(Cl)Cl)cc1,C28341376_decoy,TRY1,Decoy,0,-8.85424,-7.77,-1.69,-11.348397197029144
Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1NN(c1ccccc1)c1ccccc1,C40777889_decoy,TRY1,Decoy,0,-7.79038,-7.95,-3.56,-7.088062123013483
Nc1c(NNC(=O)COc2ccc(Cl)cc2Cl)ncnc1Nc1ccc(OC(F)(F)F)cc1,C40795545_decoy,TRY1,Decoy,0,-8.4939,-7.94,-3.64,-7.148337401723699
C/C=C/C(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@@H](O)[C@@H](O)[C@H]1O,C36645754_decoy,TRY1,Decoy,0,-7.58971,-8.08,-3.6,-6.239028205944095
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1cccc(Br)c1,C58994056_decoy,TRY1,Decoy,0,-10.5067,-8.87,-1.64,-9.943947713360544
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1cc(Cl)cc(Cl)c1,C58994329_decoy,TRY1,Decoy,0,-11.6755,-9.56,-4.78,-9.71698505684838
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(/C)c3ccc(N)cc3)n2)s1,C59309572_decoy,TRY1,Decoy,0,-10.3142,-8.26,-2.81,-11.89147115144212
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCC(=O)c1ccc(Br)cc1,C20292295_decoy,TRY1,Decoy,0,-9.97622,-10.03,-1.92,-9.878212685379625
Fc1ccc(N2CC[NH+](C[C@H]3C[NH+]4CC[C@H]3C[C@@H]4CNC(=S)NCC[NH+]3CCOCC3)CC2)cc1,C08635653_decoy,TRY1,Decoy,0,-10.5514,-6.91,-4.28,-6.629552936842192
CSc1cccc(NC(=O)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2CCN(c3cccc[nH+]3)CC2)c1,C08635671_decoy,TRY1,Decoy,0,-11.2906,-7.43,-1.67,-7.1469222127530445
CN(C)c1ccc(NC(=S)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2CCN(c3cccc[nH+]3)CC2)cc1,C08635675_decoy,TRY1,Decoy,0,-10.195,-6.31,-2.76,-6.030418173065397
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@@H]([NH2+]CCNC(C)=O)C[C@@H](c3ccc(Cl)c(F)c3)[NH+]21,C08636005_decoy,TRY1,Decoy,0,-7.27037,-6.53,-2.54,-6.261397185574382
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H]([NH2+]CCNC(C)=O)C[C@@H](c3ccc(Cl)c(F)c3)[NH+]21,C08636006_decoy,TRY1,Decoy,0,-9.84474,-7.95,-2.33,-6.740966741524966
O=C(Nc1ccc[nH+]c1NCCNc1[nH+]cc(C(F)(F)F)cc1Cl)c1ccc(Cl)cc1Cl,C03104269_decoy,TRY1,Decoy,0,-10.5593,-7.5,-1.36,-9.818715639997423
O=C(NCC[NH+]1CCOCC1)c1ccc(N2CCC([NH2+]C[C@@H]3CCC[NH+]4CCCC[C@H]34)CC2)cc1,C11967933_decoy,TRY1,Decoy,0,-8.47004,-7.21,-1.23,-5.349895166217451
COCCNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C,C12467272_decoy,TRY1,Decoy,0,-7.06216,-5.69,-2.11,-5.677609619276748
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(OC)cc1,C12467506_decoy,TRY1,Decoy,0,-6.60588,-6.98,-1.13,-7.5996573295035805
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1C,C12473465_decoy,TRY1,Decoy,0,-7.79272,-7.5,-2.0,-7.50798429838315
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)c(Cl)c2)o1,C12704046_decoy,TRY1,Decoy,0,-8.39745,-5.38,-3.25,-5.580732737604855
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccc(F)cc2)C(=O)c2snc(C(N)=O)c2N)o1,C12715083_decoy,TRY1,Decoy,0,-9.4808,-8.06,-1.81,-9.45531725914528
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccncc2)c1,C06195581_decoy,TRY1,Decoy,0,-7.68061,-6.85,-3.79,-6.675176425695281
S=C(NCCCNc1cccc[nH+]1)NCCCN(Cc1ccc(Br)cc1)c1cccc[nH+]1,C13782012_decoy,TRY1,Decoy,0,-10.588,-6.38,-3.07,-6.6540619611815
NC(=S)NNC(=S)NC(=O)COc1ccc2cc(Br)ccc2c1Br,C13976638_decoy,TRY1,Decoy,0,-10.9615,-6.45,-0.96,-9.801726311174123
S=C(NCC[NH+]1CCOCC1)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCN(c2ccccc2)CC1,C08636249_decoy,TRY1,Decoy,0,-9.18745,-5.85,-2.69,-7.359157374380047
O=C(C[NH+]1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1)NCCNc1[nH+]cc(C(F)(F)F)cc1Cl,C08681037_decoy,TRY1,Decoy,0,-8.514,-6.3,-3.54,-5.321556902741033
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2C[C@H](NCCc3c[nH+]c[nH]3)C[C@@H](c3ccccc3F)[NH+]21,C20504090_decoy,TRY1,Decoy,0,-9.23349,-6.52,-2.98,-6.279433854056808
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@H](NCCc3c[nH+]c[nH]3)C[C@@H](c3ccc(F)cc3)[NH+]12,C20504096_decoy,TRY1,Decoy,0,-9.233,-7.87,-1.58,-6.777840324944892
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]2C[C@@H](NCCc3c[nH+]c[nH]3)C[C@@H](c3ccc(F)cc3)[NH+]12,C20504097_decoy,TRY1,Decoy,0,-11.8689,-6.73,-1.94,-6.886148905818954
CC[C@@H](C)Sc1nnc(NC(=O)CSc2nnc(N/N=C/c3cccc(O)c3)n2N)s1,C20915099_decoy,TRY1,Decoy,0,-10.1322,-8.6,-3.19,-8.826609712303712
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3c(O)ccc4ccccc34)n2N)sc2c1CCC2,C20916154_decoy,TRY1,Decoy,0,-10.7968,-10.34,-1.4,-8.550869595418229
S=C(NCCCN1CC[NH+](CCCNC(=S)NC2CCCCC2)CC1)NC1CCCCC1,C22942328_decoy,TRY1,Decoy,0,-10.8171,-5.42,-3.38,-6.22777509355053
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(C)o2)c(C)c1,C12714894_decoy,TRY1,Decoy,0,-7.75642,-6.02,-2.44,-5.998322302332067
CC(C)S(=O)(=O)c1ccc([C@@H](CNc2ccccc2O)[NH+]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1,C39534415_decoy,TRY1,Decoy,0,-8.90043,-6.37,-4.02,-6.161048970085191
Cc1ccc([C@@H]2NN[C@H](SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)[NH+]2C2CCCCC2)cc1,C39926561_decoy,TRY1,Decoy,0,-8.72495,-6.91,-1.61,-6.677632313317718
C[NH+]1CCC=C(c2nsnc2OCCCC[NH2+]CCCNc2c3c([nH+]c4ccccc24)CCCC3)C1,C45366550_decoy,TRY1,Decoy,0,-9.67763,-7.78,-2.78,-7.588261375910633
C[NH+]1CCC=C(c2nsnc2OCCCC[NH2+]CCCCNc2c3c([nH+]c4ccccc24)CCCC3)C1,C45368836_decoy,TRY1,Decoy,0,-9.4479,-7.21,-3.35,-6.685316635954372
C[NH+]1CCC=C(c2nsnc2OCCCC[NH2+]CCCCCNc2c3c([nH+]c4ccccc24)CCCC3)C1,C45368841_decoy,TRY1,Decoy,0,-9.37595,-7.94,-4.12,-10.119328008720318
CCOc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(Cl)cc4Cl)c32)ccc1OCC(N)=O,C01119454_decoy,TRY1,Decoy,0,-6.98495,-5.75,-3.54,-5.424664158041808
[NH3+][C@@H](COc1cncc(-c2ccc3c(c2)/C(=C/C2=NC=CC2)C(=O)N3)c1)CC1=c2ccccc2=[NH+]C1,C52566084_decoy,TRY1,Decoy,0,-7.9832,-8.61,-4.0,-6.60043252606982
[NH3+][C@H](COc1cncc(-c2ccc3c(c2)[C@@H](c2cccs2)C(=O)N3)c1)CC1=c2ccccc2=[NH+]C1,C52566249_decoy,TRY1,Decoy,0,-8.90037,-8.93,-3.25,-6.378551311338207
Cc1cc([C@@H]2C(=O)Nc3ccc(-c4cncc(OC[C@@H]([NH3+])CC5=c6ccccc6=[NH+]C5)c4)cc32)oc1C,C52566261_decoy,TRY1,Decoy,0,-8.08377,-7.69,-1.61,-6.6536866733311255
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])CC4=c5cccc(F)c5=[NH+]C4)cnc3-c3ccoc3)cc12,C52569911_decoy,TRY1,Decoy,0,-9.46364,-8.62,-1.86,-8.527984321781805
Cc1occc1-c1nc(N)c(OC[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)cc1-c1cnc2[nH]nc(C)c2c1,C52569915_decoy,TRY1,Decoy,0,-9.6067,-8.46,-2.7,-7.86869744672641
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])CC4=c5cc(F)ccc5=[NH+]C4)cnc3-c3ccoc3)cc12,C52569925_decoy,TRY1,Decoy,0,-11.6196,-8.31,-4.41,-8.550115287878135
CC(C)(CC1CC1)[C@@H]1C(=O)Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc21,C52634391_decoy,TRY1,Decoy,0,-8.29894,-7.05,-3.37,-5.388855117948896
COc1cc2c(NC3CC[NH+](C)CC3)nc(N3CCC[NH+](C)CC3)[nH+]c2cc1OCCC[NH+](C)C,C36382580_decoy,TRY1,Decoy,0,-9.1548,-5.94,,99.0
CC(=O)Nc1ccccc1[C@H]1[NH+]=c2ccc(C(=O)NCCC[NH+]3C[C@H](C)C[C@H](C)C3)cc2=[NH+]C1=O,C63502480_decoy,TRY1,Decoy,0,-9.61641,-7.82,-0.89,-6.866090185057231
CC(=O)Nc1ccccc1[C@H]1[NH+]=c2ccc(C(=O)NCCC[NH+]3C[C@H](C)C[C@@H](C)C3)cc2=[NH+]C1=O,C63502483_decoy,TRY1,Decoy,0,-7.87832,-6.06,-1.66,-5.968281749237654
COc1ccc(N2N[NH2+]N[C@H]2[C@H](NCCC2=c3ccccc3=[NH+][C@H]2C)c2ccc(Cl)cc2Cl)cc1,C63513988_decoy,TRY1,Decoy,0,-9.67596,-8.16,-2.17,-8.989968636387639
Cc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1cccc(NC(=O)CS[C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)n1)[NH+]=2,C63562398_decoy,TRY1,Decoy,0,-8.788,-9.95,-2.51,-8.99568655609421
Cc1ccc(CNC(=O)CS[C@@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=c5ccccc5=[NH+]C4)NN32)cc1,C63708091_decoy,TRY1,Decoy,0,-9.27232,-8.34,-3.37,-7.286629057459918
Cc1ccc(CNC(=O)CS[C@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=c5ccccc5=[NH+]C4)NN32)cc1,C63708093_decoy,TRY1,Decoy,0,-9.32427,-9.26,-2.46,-9.596031530572487
CCOc1ccc(NC(=O)CS[C@H]2[NH+]=c3ccccc3=C3[NH+]=C(CCC4=c5ccccc5=[NH+]C4)NN32)cc1,C63708097_decoy,TRY1,Decoy,0,-9.81381,-8.82,-2.01,-8.268045716725696
C[NH+](C)Cc1cc([C@@H]2Nc3ccccc3S2)ccc1OCC(=O)NCC[C@@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1,C64053568_decoy,TRY1,Decoy,0,-9.27086,-8.3,-4.09,-7.029863354686677
C[NH+](C)Cc1cc([C@@H]2Nc3ccccc3S2)ccc1OCC(=O)NCC[C@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1,C64053569_decoy,TRY1,Decoy,0,-9.32482,-8.48,-3.84,-7.230247790036589
C[NH+](C)Cc1cc([C@H]2Nc3ccccc3S2)ccc1OCC(=O)NCC[C@@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1,C64053572_decoy,TRY1,Decoy,0,-8.76948,-8.24,-3.6,-7.282436342706419
C[NH+](C)Cc1cc([C@H]2Nc3ccccc3S2)ccc1OCC(=O)NCC[C@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1,C64053573_decoy,TRY1,Decoy,0,-9.61738,-7.91,-3.71,-6.126238711267911
CC(=O)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@@H]1O,C04557128_decoy,TRY1,Decoy,0,-6.79609,-7.03,-3.6,-5.294296227798805
CC(=O)N[C@@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C04557130_decoy,TRY1,Decoy,0,-5.94911,-8.49,-2.34,-5.696160767389918
O=C([O-])c1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C04497825_decoy,TRY1,Decoy,0,-5.24765,-6.01,-2.68,-4.576962715700998
O=C([O-])c1ccc(N[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C04497827_decoy,TRY1,Decoy,0,-6.58361,-5.33,-2.26,-4.559936598397567
CC(C)(C)NC(=O)[C@@H](c1ccc(Cl)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06074464_decoy,TRY1,Decoy,0,-8.64231,-5.66,-1.0,-6.154467315314454
COc1ccc(CN(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2cccs2)cc1,C06074690_decoy,TRY1,Decoy,0,-9.3353,-5.77,-0.98,-6.710325665666021
CCC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(Cc1ccc(OC)cc1)C(=O)c1snc(C(N)=O)c1N,C06462165_decoy,TRY1,Decoy,0,-8.94192,-8.04,-3.67,-9.956098800411592
Cc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2)cc1,C12477040_decoy,TRY1,Decoy,0,-7.52742,-7.16,-1.35,-7.8457874205101135
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1,C12479492_decoy,TRY1,Decoy,0,-8.88978,-6.14,-1.29,-8.310932830668605
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)c(Cl)c2)o1,C12480057_decoy,TRY1,Decoy,0,-9.03527,-6.97,-0.7,-9.089943839616543
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2)cc1,C12702110_decoy,TRY1,Decoy,0,-7.80379,-6.81,0.55,-7.698766256341679
Cc1ccc([C@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(Cl)cc2)cc1,C12702179_decoy,TRY1,Decoy,0,-6.99567,-5.5,-3.46,-5.095638496209938
NC(=O)N[C@@H](CC(=O)OCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc(Cl)cc1,C13027227_decoy,TRY1,Decoy,0,-9.84852,-7.3,-3.03,-6.786901137173724
O=C([O-])c1ccc(N[C@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)cc1,C13424908_decoy,TRY1,Decoy,0,-5.76193,-7.45,-3.18,-4.805463247135438
O=C([O-])c1ccc(N[C@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)cc1,C13424910_decoy,TRY1,Decoy,0,-5.61393,-5.74,-4.58,-4.611600501429739
CC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@@H]1O,C13526511_decoy,TRY1,Decoy,0,-6.30807,-9.06,-4.25,-6.128629502246236
CC(=O)N[C@H]1[C@H]([C@@H](O)[C@@H](O)CO)O[C@@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C15206156_decoy,TRY1,Decoy,0,-7.11146,-7.1,-3.31,-6.522583020783339
CC(=O)N[C@H]1[C@H]([C@H](O)[C@@H](O)CO)O[C@@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C15206163_decoy,TRY1,Decoy,0,-5.76356,-7.7,-2.48,-5.305866004201863
COc1cc(N)c(Cl)cc1C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C16584108_decoy,TRY1,Decoy,0,-9.4666,-7.62,-2.81,-9.475363076266111
NC(=O)c1nsc(C(=O)N(C2CCCC2)[C@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1N,C19332332_decoy,TRY1,Decoy,0,-8.3357,-6.06,-1.46,-6.359859961271264
Cc1ccc(NC(=O)C[C@@H]2SC(N[C@@H](c3ccc(O)cc3)c3c([O-])[nH]c(=O)[nH]c3=O)=NC2=O)c(C)c1,C20559621_decoy,TRY1,Decoy,0,-9.18462,-9.77,-3.06,-7.641777622614408
Cc1ccc(NC(=O)C[C@H]2SC(N[C@H](c3ccc(O)cc3)c3c([O-])[nH]c(=O)[nH]c3=O)=NC2=O)c(C)c1,C20559627_decoy,TRY1,Decoy,0,-9.16459,-8.97,-2.74,-8.306585466391766
Nn1c(N/N=C/c2ccc(O)cc2)nnc1SCC(=O)Nc1cccc(Cl)c1Cl,C21315620_decoy,TRY1,Decoy,0,-10.1642,-9.69,-2.28,-9.105430911329425
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@@H]1O,C22064017_decoy,TRY1,Decoy,0,-5.57617,-7.9,-1.5,-6.30445809628602
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C02559036_decoy,TRY1,Decoy,0,-6.82938,-7.1,-3.16,-6.118696871073432
C=CCOc1ccc(/C=N/[N-]c2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1,C09886208_decoy2,TRY1,Decoy,0,-8.13012,-6.52,,-7.19076073002697
O=C(Cc1ccc([N+](=O)[O-])cc1)c1c([O-])cc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O,C25557524_decoy,TRY1,Decoy,0,-6.76633,-7.87,-3.12,-5.073500534204388
NNC(=S)N/N=C(/c1nc2ccc(Cl)cc2nc1[O-])[C@H](O)c1ccc([N+](=O)[O-])cc1,C05398924_decoy,TRY1,Decoy,0,-8.52221,-7.71,-1.0,-7.914492783451307
C[NH2+]CC[C@H](Oc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c2ccccc12)c1cccs1,C27103617_decoy,TRY1,Decoy,0,-7.00341,-7.84,-1.19,-7.48471529561903
CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@H](O)COc2ccc3c(C)cc(=O)oc3c2)O[C@@](O)(C(=O)[O-])C[C@H]1O,C35024877_decoy,TRY1,Decoy,0,-6.01842,-8.25,-1.75,-5.350129538937408
CC(=O)N[C@H]1[C@@H]([C@H](O)[C@H](O)COc2ccc3c(C)cc(=O)oc3c2)O[C@@](O)(C(=O)[O-])C[C@H]1O,C35024882_decoy,TRY1,Decoy,0,-5.83251,-6.88,-2.2,-4.906682735158749
CC(C)=C[C@H]1OC(=O)/C(=C\CO[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]1O,C35455150_decoy,TRY1,Decoy,0,-8.318,-9.62,-3.3,-8.421966751524016
CC1=CC(=O)C[C@@](C)(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]1(O)/C=C/C(C)=C/C(=O)[O-],C35465974_decoy,TRY1,Decoy,0,-8.37429,-6.32,-3.26,-5.332947260378954
CC1=CC(=O)C[C@](C)(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]1(O)/C=C/C(C)=C/C(=O)[O-],C35465976_decoy,TRY1,Decoy,0,-7.08322,-6.11,-1.55,-5.2822629242320405
CC1=CC(=O)C[C@@](C)(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@]1(O)/C=C/C(C)=C/C(=O)[O-],C35465978_decoy,TRY1,Decoy,0,-7.01097,-4.66,-3.75,-4.306066806503529
CC1=CC(=O)C[C@](C)(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@]1(O)/C=C/C(C)=C/C(=O)[O-],C35465980_decoy,TRY1,Decoy,0,-6.11294,-5.93,-2.85,-4.535477221425708
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2c(O)cc(O)cc2O)N(C)C(=O)CO)cc1,C36536330_decoy,TRY1,Decoy,0,-8.06479,-8.42,-2.54,-9.446382699579807
O=C(OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12)c1ccccc1,C33832447_decoy,TRY1,Decoy,0,-6.40621,-7.65,-1.15,-5.681747787768164
O=C(N/N=C/c1ccc(O)c(O)c1O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,C08680742_decoy,TRY1,Decoy,0,-9.04107,-6.53,-0.58,-5.97229908479769
NN1[C@@H](SCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)NN[C@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C38990179_decoy,TRY1,Decoy,0,-9.47238,-7.04,-2.39,-6.950295708669183
Cc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4ccccc4C(C)C)N3N)N=N2)cc1,C38999524_decoy,TRY1,Decoy,0,-9.5562,-7.86,-2.0,-6.835100734427663
Nc1c(NNC(=O)COc2ccc(Cl)cc2Cl)ncnc1Nc1cccc2ncccc12,C40795495_decoy,TRY1,Decoy,0,-8.01819,-8.52,-2.88,-6.8273661217552455
NC(=O)NCCC[C@]1(C(=O)[O-])[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)[C@@H]2C(=O)N=C([O-])[C@H]21,C33874710_decoy,TRY1,Decoy,0,-7.35865,-5.71,-2.23,-5.768699585320086
CC(=O)N[C@H]1[C@@H]([C@H](O)[C@@H](O)CO)O[C@@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@@H]1O,C43763987_decoy,TRY1,Decoy,0,-6.61742,-5.98,-2.13,-5.03170119824552
CC(=O)N[C@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C44889073_decoy,TRY1,Decoy,0,-5.95332,-6.81,-4.76,-5.030376999296535
CC(=O)N[C@H]1[C@@H]([C@@H](O)[C@H](O)CO)O[C@@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)[O-])C[C@H]1O,C44889078_decoy,TRY1,Decoy,0,-5.58136,-7.43,-2.0,-5.057810064201544
NC(=O)C(=O)N/N=C(/C[C@@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21)C(=O)c1ccc(Br)cc1,C48553557_decoy,TRY1,Decoy,0,-7.32067,-6.93,-3.2,-6.654039306140263
CC(C)(O)[C@@H]1CC=C(C(=O)OC[C@H]2O[C@@H](Oc3cc(C(=O)[O-])cc(O)c3O)[C@H](O)[C@@H](O)[C@@H]2O)CC1,C49601365_decoy,TRY1,Decoy,0,-8.83447,-8.87,-3.09,-8.148669491973376
C=C1[C@H]2[C@H](O[C@@H]3O[C@H](COC(=O)c4ccc(O)cc4)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)[O-])[C@H]2C[C@H]1O,C49601754_decoy,TRY1,Decoy,0,-7.58438,-8.24,-3.76,-7.047493209032472
COCCNC(=O)C[C@@H]1c2nc(Nc3cccc(O)c3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03841658_decoy,TRY1,Decoy,0,-9.62408,-6.6,-3.37,-7.550544511573396
CC(C)(C)NC(=O)[C@H](c1ccc(Cl)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(Cl)cc1,C06074866_decoy,TRY1,Decoy,0,-8.95361,-6.42,-4.52,-6.51826802063002
CCC(C)(C)NC(=O)[C@H](c1ccc(N(C)C)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06077452_decoy,TRY1,Decoy,0,-8.48124,-7.47,-2.63,-8.50884610275623
CCC[C@@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06501187_decoy,TRY1,Decoy,0,-8.08184,-5.64,-1.61,-6.067338386115351
CCC[C@H](C(=O)NCCC(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06501502_decoy,TRY1,Decoy,0,-8.08582,-7.02,-2.8,-8.19343526261507
CCOC(=O)CNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06546828_decoy,TRY1,Decoy,0,-7.8737,-7.11,-2.61,-7.810482091329546
CCOC(=O)CNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1F,C06547154_decoy,TRY1,Decoy,0,-7.43834,-7.01,-3.38,-8.19044939967487
CC[C@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C,C06821007_decoy,TRY1,Decoy,0,-8.00027,-5.39,-1.1,-6.315359251497498
CC[C@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(Cl)cc1,C06821022_decoy,TRY1,Decoy,0,-8.73299,-6.59,-2.33,-8.529497225679442
CSc1cccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCCNC(C)=O)[C@H]3S2)c1,C08254699_decoy,TRY1,Decoy,0,-10.6155,-7.08,-2.32,-7.174112371697185
C=CCNC(=S)NNC(=O)c1oc2nc(-c3ccccc3)cc(-c3ccco3)c2c1N,C08636937_decoy,TRY1,Decoy,0,-8.3999,-6.51,-1.28,-6.839313336777674
COC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@@H]1c1cc(OC)c(OC)c(OC)c1,C09302617_decoy,TRY1,Decoy,0,-7.96207,-5.57,-0.18,-11.124529987536466
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC2CCCC2)c2ccc(F)cc2)c1,C12473658_decoy,TRY1,Decoy,0,-6.48203,-6.76,-3.63,-7.721419199606958
Cc1ccc([C@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C12477092_decoy,TRY1,Decoy,0,-7.76417,-5.51,-3.77,-5.567381277307143
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(Cl)cc2)cc1,C12477266_decoy,TRY1,Decoy,0,-7.32741,-4.94,-3.7,-5.257055203189485
Cc1ccc([C@@H](C(=O)NCCC(C)C)N(Cc2ccc(F)cc2)C(=O)c2snc(C(N)=O)c2N)cc1,C12479434_decoy,TRY1,Decoy,0,-7.94205,-5.75,-3.16,-5.886623654716696
Cc1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12706167_decoy,TRY1,Decoy,0,-7.94434,-6.21,-1.67,-5.996253807382321
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@H](C(=O)NC2CCCC2)c2cccs2)c1N,C12710967_decoy,TRY1,Decoy,0,-9.03156,-5.83,-0.69,-7.225241633296836
COc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@H]1CCCO1)c1cccs1,C12711303_decoy,TRY1,Decoy,0,-8.41746,-7.36,-1.85,-8.719365684559275
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC1CCCC1)c1ccc(N(C)C)cc1,C06443994_decoy,TRY1,Decoy,0,-8.71323,-7.23,-3.36,-7.955018196863122
Nc1c(C(=O)NCc2cccs2)sc(Nc2ccc(F)cc2)c1C(=O)Nc1ccccc1Cl,C13132142_decoy,TRY1,Decoy,0,-10.3819,-6.6,-1.85,-6.515107748167642
COc1ccccc1-c1nnc(SCc2nc(N)nc(Nc3ccccc3C)n2)n1N,C09163087_decoy,TRY1,Decoy,0,-8.47173,-8.25,-3.84,-7.088724896087662
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC(C)(C)C)c2ccncc2)cc1,C06089832_decoy,TRY1,Decoy,0,-7.74069,-6.88,-0.32,-8.710180595804422
NC(=O)c1c(NC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)sc2c1CCC2,C16371143_decoy,TRY1,Decoy,0,-12.1768,-7.75,-3.3,-11.917633251602954
Nc1ncnc2c1ncn2[C@H](/C=N/Nc1ccccc1)O[C@H](/C=N\Nc1ccccc1)CO,C04824861_decoy,TRY1,Decoy,0,-9.13143,-8.68,-2.07,-8.820816195345492
Nc1ncnc2c1ncn2[C@H](/C=N/Nc1ccccc1)O[C@H](/C=N/Nc1ccccc1)CO,C17429411_decoy,TRY1,Decoy,0,-9.12068,-7.51,-2.03,-9.329436359329415
NS(=O)(=O)c1ccc(NNC(=S)NCCSc2ccc(Cl)cc2)c([N+](=O)[O-])c1,C18138320_decoy,TRY1,Decoy,0,-9.91465,-1.41,-3.77,-4.952035014536641
CCOc1ccccc1NC(=O)CCSc1nnc(N/N=C/c2cccc(O)c2)n1N,C20915271_decoy,TRY1,Decoy,0,-8.15778,-8.47,-2.83,-9.595877920918388
O=C(OCC1=C[C@@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12)c1ccccc1,C31156327_decoy,TRY1,Decoy,0,-8.06487,-6.39,-2.54,-6.254670698952787
Nc1ccccc1C(=O)OCCCCCCOc1cc(O)c2c(c1N)C(=O)c1ccccc1C2=O,C31375135_decoy,TRY1,Decoy,0,-8.17139,-7.42,-3.9,-5.69525105407342
Nc1ccccc1S[C@@H](/C=C/NNC1=N[C@@H](c2ccccc2)C(c2ccccc2)=NN1)c1ccccc1,C17210703_decoy,TRY1,Decoy,0,-8.46976,-5.95,-1.41,-5.147184973500081
Nc1ccccc1S[C@H](/C=C/NNC1=N[C@@H](c2ccccc2)C(c2ccccc2)=NN1)c1ccccc1,C17210712_decoy,TRY1,Decoy,0,-9.17036,-8.72,-2.27,-6.949301110135293
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]3c2cc(C)ccc2C)cc1,C33703737_decoy,TRY1,Decoy,0,-9.57048,-8.31,-1.06,-9.190521873272427
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)c1cccc(Cl)c1,C36483194_decoy,TRY1,Decoy,0,-7.28151,-5.38,-3.59,-5.441231003698353
O=C1CC[C@@H](C(=O)N(Cc2ccco2)[C@@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)N1,C36504532_decoy,TRY1,Decoy,0,-8.08713,-6.66,-3.23,-6.755320353639037
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccccc1O)c1ccccc1Cl,C36543474_decoy,TRY1,Decoy,0,-6.32827,-5.7,-1.48,-5.401010853541105
COc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(=O)Nc4ccc(Br)cc4)N3N)N=N2)cc1,C38994923_decoy,TRY1,Decoy,0,-9.75205,-8.88,-2.96,-7.449885311911685
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4ccccc4F)N3N)N=N2)cc1,C39000371_decoy,TRY1,Decoy,0,-8.75288,-9.39,-2.04,-7.575185838858634
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccc(C)c(Cl)c4)N3N)N=N2)cc1,C39015892_decoy,TRY1,Decoy,0,-10.4212,-6.86,-1.98,-6.512746393700772
O=C(C[C@@H]1CS[C@@H](NC(=O)NCc2cccs2)N1)NCCc1c[nH]c2ccccc12,C39709751_decoy,TRY1,Decoy,0,-8.16642,-7.06,-2.39,-5.753758121604771
Cc1ccc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c(C)c1,C40755477_decoy,TRY1,Decoy,0,-9.09763,-6.69,-1.59,-6.519394712840319
Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1Nc1ccc(OC(F)(F)F)cc1,C40784471_decoy,TRY1,Decoy,0,-7.81535,-6.36,-3.31,-6.161594987993748
Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccc(Oc2ccccc2)cc1,C40793512_decoy,TRY1,Decoy,0,-9.9921,-6.92,-2.34,-6.5790170725795205
O=C(NC1CCCCC1)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cc([N+](=O)[O-])ccc1O)c1ccccc1,C36609343_decoy,TRY1,Decoy,0,-7.30933,-7.06,-1.99,-8.395048845600641
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C[C@@H](NC(N)=O)c1cccs1,C27203058_decoy,TRY1,Decoy,0,-9.22448,-7.02,-3.41,-6.723387226829161
Cc1cc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3O)n2)ccc1Br,C58994338_decoy,TRY1,Decoy,0,-10.4677,-10.11,-2.03,-11.116788064893418
CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4ccc(O)cc4O)n3)cc2s1,C58994379_decoy,TRY1,Decoy,0,-10.807,-9.27,-4.76,-10.407500909282826
C=CCc1cccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(NC(C)=O)c3)n[nH]2)c1O,C58998117_decoy,TRY1,Decoy,0,-9.50206,-8.29,-4.32,-7.212600996484905
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccc(OC(F)(F)F)cc2)S1,C38639752_decoy,TRY1,Decoy,0,-9.0769,-7.6,-2.37,-7.070757236788365
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]CC(C)C)C(=O)[O-])c1,C05258983_decoy,TRY1,Decoy,0,-7.06832,-6.01,-1.84,-5.3782120551166885
COc1ccc(CN(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(F)cc2)cc1,C06134158_decoy,TRY1,Decoy,0,-7.7108,-7.51,-1.94,-8.036037184253644
NS(=O)(=O)c1ccc(NC(=S)N[C@H](NC(=O)c2ccco2)C(Cl)(Cl)Cl)cc1,C02905316_decoy,TRY1,Decoy,0,-8.71365,-6.14,-1.52,-5.692005009513443
CCC(C)(C)NC(=O)[C@@H](c1ccc(C)o1)N(CCc1ccccc1)C(=O)c1snc(C(N)=O)c1N,C06462110_decoy,TRY1,Decoy,0,-9.04663,-7.16,-3.72,-8.734983323866077
CCC(C)(C)NC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1,C06462285_decoy,TRY1,Decoy,0,-8.32363,-7.01,-1.84,-9.148969286165686
CCC[C@@H](C(=O)NC1CCCC1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06501100_decoy,TRY1,Decoy,0,-6.81781,-7.04,-4.18,-7.313429947005107
CCOc1ccc(N(CC(=O)NCCC(C)C)C(=O)c2snc(C(N)=O)c2N)cc1,C06600906_decoy,TRY1,Decoy,0,-8.81838,-7.05,-1.12,-13.0974727432226
CC(C)[C@H]([NH3+])C(=O)NC[C@H](CC(=O)NCCC(=O)[O-])c1ccc(Cl)cc1,C06759397_decoy,TRY1,Decoy,0,-8.84413,-6.47,-1.82,-7.868086846799613
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C)C(=O)NC[C@H]2CCCO2)cc1,C06821936_decoy,TRY1,Decoy,0,-8.18002,-6.51,-0.96,-6.262008074110968
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)cc2)cc1,C06821978_decoy,TRY1,Decoy,0,-7.4583,-5.22,-1.44,-5.593970036921362
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)cc1,C06822161_decoy,TRY1,Decoy,0,-7.31357,-6.92,-1.72,-7.418566769759126
Cc1ccc(OCC(=O)NC(=S)NNC(N)=S)c(Br)c1,C06826453_decoy,TRY1,Decoy,0,-8.48908,-5.82,-3.33,-7.054654474973995
COCCNC(=O)C[C@@H]1O[C@H](CNC(=S)Nc2ccc(N(C)C)cc2)[C@@H](O)[C@H]1O,C08636282_decoy,TRY1,Decoy,0,-7.93424,-6.56,-3.09,-6.301382734661219
Cc1ccc([C@@H](C(=O)NCc2ccccc2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)o1,C12472827_decoy,TRY1,Decoy,0,-7.62084,-7.79,-0.6,-8.122654034547747
NC(=O)c1nsc(C(=O)N(c2ccc(F)c(Cl)c2)[C@@H](C(=O)NC2CCCC2)c2ccco2)c1N,C12703692_decoy,TRY1,Decoy,0,-7.60572,-6.58,-2.5,-7.957068601898322
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@@H]1CCCO1)c1cccs1,C12711197_decoy,TRY1,Decoy,0,-8.34002,-6.35,-1.17,-9.322410223288712
Nn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C13108567_decoy,TRY1,Decoy,0,-9.34847,-8.07,-2.62,-6.852749295890442
COc1ccc(C(=O)N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@H](O)[C@H](O)CO)cc1,C15775291_decoy,TRY1,Decoy,0,-8.58754,-8.66,-1.41,-7.806469483142438
NC(=O)c1c(NC(=O)CSc2nnc(-c3ccc(OC(F)F)cc3)n2N)sc2c1CCC2,C16792194_decoy,TRY1,Decoy,0,-10.8961,-8.15,-1.4,-8.237630795613706
Cc1cccc(C)c1NC(=O)CSc1nnc(N/N=C/c2cccc(O)c2)n1N,C20914777_decoy,TRY1,Decoy,0,-8.05832,-8.3,-1.65,-8.627926292378838
NC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccccc1Cl)c1ccc(Cl)cc1,C20977083_decoy,TRY1,Decoy,0,-8.89036,-8.49,-3.35,-8.585394248082249
O=C([O-])C[C@@H](NC(=O)NNC(=O)CCCCNc1cccc[nH+]1)c1ccccc1,C29563354_decoy,TRY1,Decoy,0,-7.72152,-5.79,-3.87,-6.408162279653493
CCNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C29718055_decoy,TRY1,Decoy,0,-6.64917,-7.25,-2.12,-6.507650323179562
N#Cc1c(CCCNC(=O)CCSCC(N)=O)nn(-c2ccccc2)c1N,C33023990_decoy,TRY1,Decoy,0,-8.07558,-7.1,-1.62,-6.276001535470091
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548372_decoy,TRY1,Decoy,0,-8.28197,-5.18,-1.65,-6.580000811365176
CCC[C@@H](C(=O)NC1CCCC1)N(Cc1ccc(F)cc1)C(=O)c1snc(C(N)=O)c1N,C06501031_decoy,TRY1,Decoy,0,-8.14579,-7.07,-4.07,-8.53360392734981
CCOc1ccc(NC(=O)CS[C@H]2NN[C@H]([C@@H]3C=C(c4ccc(C)cc4)N=N3)N2N)cc1,C39012857_decoy,TRY1,Decoy,0,-9.93032,-8.71,-2.86,-8.37234811043583
CCOc1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(C)cc4)N=N3)N2N)cc1,C39012858_decoy,TRY1,Decoy,0,-9.64931,-8.42,-1.61,-8.10402679658565
C[NH+]1[C@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@H]1c1ccc(C(C)(C)C)cc1,C39692392_decoy,TRY1,Decoy,0,-8.29748,-8.61,-1.58,-6.278398773269832
Cc1cccc(NC(=O)NCC(=O)NNC(=S)N[C@@H]2CCC[C@H](C)[C@@H]2C)c1,C42785534_decoy,TRY1,Decoy,0,-8.46804,-7.98,-3.6,-6.158101014450437
Cc1cccc(NC(=O)NCC(=O)NNC(=S)N[C@H]2CCC[C@H](C)[C@@H]2C)c1,C42785536_decoy,TRY1,Decoy,0,-8.24997,-6.67,-1.89,-5.793701451039954
Cc1cccc(NC(=O)NCC(=O)NNC(=S)N[C@H]2CCC[C@@H](C)[C@@H]2C)c1,C42785540_decoy,TRY1,Decoy,0,-7.9084,-7.73,-3.96,-7.645449145087626
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3cccc4ccccc34)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33880641_decoy,TRY1,Decoy,0,-7.39824,-6.69,-1.15,-6.161040966234921
Cc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1cccc2ccccc12,C43221908_decoy,TRY1,Decoy,0,-8.24385,-8.08,-1.12,-7.792646479278109
CC(C)C[C@H](NC(=O)C[C@H](CNC(=O)[C@H](C)[NH3+])c1ccc(Cl)cc1)C(=O)[O-],C43618903_decoy,TRY1,Decoy,0,-8.33192,-6.28,-0.92,-7.1386953936023705
Cc1ccc(N2C(=O)[C@H]3[C@H](/C=C/c4ccccc4)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C2=O)cc1Cl,C44174565_decoy,TRY1,Decoy,0,-9.12698,-7.72,-2.67,-7.53016052483784
CCCCn1c(N)c(N(C)CC(=O)NC(=O)N[C@@H]2CCCC[C@@H]2C)c(=O)[nH]c1=O,C10044056_decoy,TRY1,Decoy,0,-7.46592,-6.25,-2.38,-6.474615797129205
CC(=O)NNc1nc(C)c([C@@H](/C=C/c2ccccc2O)NNS(=O)(=O)c2ccc(C)cc2)s1,C48548156_decoy,TRY1,Decoy,0,-9.18553,-6.16,-2.32,-7.787400363607476
NS(=O)(=O)c1ccc(CCNC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)cc1,C49244057_decoy,TRY1,Decoy,0,-9.56438,-8.07,-1.58,-6.261263423487978
NC(N)=Nc1nc(-c2cccc(CNC(=O)CSCc3ccco3)n2)cs1,C13600789_decoy,TRY1,Decoy,0,-9.84184,-7.19,-2.85,-7.269382145599967
CCCCn1c(N)c(N(C)CC(=O)NC(=O)NC2CCCC2)c(=O)[nH]c1=O,C11036266_decoy,TRY1,Decoy,0,-7.85775,-6.97,-2.07,-6.369414291362833
CC(C)[C@@H](Sc1nnc(COc2ccc(F)cc2)n1N)C(=O)NC(N)=O,C16371268_decoy,TRY1,Decoy,0,-8.18684,-6.22,-1.2,-7.127536376468588
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C(\C)c2ccccc2O)n1,C59883729_decoy,TRY1,Decoy,0,-7.7393,-7.52,-2.63,-11.028501678558458
C[C@@H](NC(=O)NCCNS(C)(=O)=O)c1ccc(NC(=O)NC2CC2)cc1,C48559743_decoy,TRY1,Decoy,0,-7.47318,-6.62,-4.01,-5.550505976869284
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)NCC(F)(F)F)c1,C64082170_decoy,TRY1,Decoy,0,-8.08151,-5.22,-2.6,-4.992747999522735
Cc1cc(OCC(=O)N[C@H](CO)[C@@H](O)c2ccc(N)cc2)cc(C)c1Cl,C66142097_decoy,TRY1,Decoy,0,-8.68908,-7.64,-2.9,-8.654772564577083
CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)N[C@@H](CO)[C@H](O)c1ccc(N)cc1,C66142812_decoy,TRY1,Decoy,0,-7.77598,-7.13,-1.03,-7.765673399087683
CC[C@@H](Oc1ccccc1[C@@H](C)CC)C(=O)N[C@@H](CO)[C@H](O)c1ccc(N)cc1,C66142816_decoy,TRY1,Decoy,0,-7.39034,-7.05,-1.17,-9.170602298958055
NC(=O)CCOc1ccccc1NC(=O)NC[C@@]1(O)CCCc2ccccc21,C66952421_decoy,TRY1,Decoy,0,-8.21545,-6.29,-2.53,-5.978647324060902
CC[NH+](c1ccc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)cc1)C(C)C,C67537018_decoy,TRY1,Decoy,0,-8.1126,-6.43,-2.81,-5.931868813922494
O=C1c2ccccc2C(=O)c2c(NCC[NH2+]CCO)ccc(NCC[NH2+]CCO)c21,C03871513_decoy,TRY1,Decoy,0,-9.81817,-6.74,-1.48,-7.996072999844224
O=C1c2cccc(NCC[NH2+]CCO)c2C(=O)c2cccc(NCC[NH2+]CCO)c21,C05390507_decoy,TRY1,Decoy,0,-7.53984,-7.16,-1.83,-9.286237017725004
C[C@@H]1C(S[C@H]2C[NH2+][C@@H](CNS(N)(=O)=O)C2)=C(C(=O)[O-])N2C(=O)[C@@H]([C@@H](C)O)[C@@H]12,C01535361_decoy,TRY1,Decoy,0,-9.65117,-4.67,-3.66,-5.723015594487677
COCCNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06190852_decoy,TRY1,Decoy,0,-8.59437,-5.66,-1.54,-6.13655173653431
O[C@H](CNc1cccc[nH+]1)COc1ccc(OC[C@@H](O)CNc2cccc[nH+]2)cc1,C00848889_decoy,TRY1,Decoy,0,-8.3897,-7.36,-2.63,-7.062607892137933
CC/C(Cc1ccccc1)=N\Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975191_decoy,TRY1,Decoy,0,-7.54373,-6.7,-1.9,-6.652365455095948
OC[C@@H]1O[C@H](Nc2ccc(-c3ccc(N[C@@H]4C[C@@H](O)[C@@H](CO)O4)cc3)cc2)C[C@@H]1O,C16121473_decoy,TRY1,Decoy,0,-7.41905,-6.0,-1.96,-5.739678540805424
C[C@H](O)[C@H]1C(=O)N2C(C(=O)[O-])=C(S[C@@H]3C[NH2+][C@H](CNS(N)(=O)=O)C3)[C@H](C)[C@H]12,C21299093_decoy,TRY1,Decoy,0,-8.26746,-5.26,-2.18,-5.7791136480348895
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)[O-])=C(S[C@H]3C[NH2+][C@H](CNS(N)(=O)=O)C3)[C@H](C)[C@H]12,C21985895_decoy,TRY1,Decoy,0,-9.48681,-6.36,-2.77,-6.443020475880867
N#Cc1c(N(CCO)CCO)nc(N)c2c(N)nc3c(c12)CC(=O)N3Cc1ccco1,C13130657_decoy,TRY1,Decoy,0,-6.57501,-5.99,-2.92,-6.3320987535530255
CCCCC[C@@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NC(CO)CO)[C@H](O)C[C@H]1O,C27639021_decoy,TRY1,Decoy,0,-10.76,-6.37,-3.1,-7.307545502273434
COc1ccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c(C[NH+](C)Cc2[nH]c(C)c[nH+]2)c1,C20149064_decoy,TRY1,Decoy,0,-7.13495,-6.36,-2.19,-6.434477716211704
C=CCOC(=O)N[C@H]1[C@@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@@H]1O,C36533574_decoy,TRY1,Decoy,0,-5.67557,-4.7,-1.94,-4.390443913685353
C[C@@H](O)[C@@H]1C(=O)N2C(C(=O)[O-])=C(S[C@H]3C[NH2+][C@@H](CNS(N)(=O)=O)C3)[C@H](C)[C@H]12,C36584727_decoy,TRY1,Decoy,0,-9.07473,-5.98,-3.4,-6.06226241085604
C[C@@H](O)[C@@H]1C(=O)N2C(C(=O)[O-])=C(S[C@H]3C[NH2+][C@@H](CNS(N)(=O)=O)C3)[C@H](C)[C@@H]12,C36584729_decoy,TRY1,Decoy,0,-8.88353,-5.54,-2.02,-5.962710554364016
C[C@@H]1C(S[C@H]2C[NH2+][C@@H](CNS(N)(=O)=O)C2)=C(C(=O)[O-])N2C(=O)[C@@H]([C@@H](C)O)[C@H]12,C36584731_decoy,TRY1,Decoy,0,-8.88293,-6.63,-2.57,-6.231616583423246
C[C@H](O)[C@@H]1C(=O)N2C(C(=O)[O-])=C(S[C@@H]3C[NH2+][C@H](CNS(N)(=O)=O)C3)[C@@H](C)[C@@H]12,C13831148_decoy,TRY1,Decoy,0,-8.82891,-5.14,-3.41,-5.896265657780368
O=C(/C=C/c1ccc(O)cc1)OC[C@@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C35455353_decoy,TRY1,Decoy,0,-10.5066,-10.65,-2.34,-8.495588876626766
C=C[C@@](C)(CCC=C(C)C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C31158225_decoy,TRY1,Decoy,0,-6.10214,-6.35,-3.72,-5.50724452846026
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)[O-])=C(S[C@@H]3C[NH2+][C@H](CNS(N)(=O)=O)C3)[C@H](C)[C@H]12,C03922770_decoy,TRY1,Decoy,0,-8.53074,-4.77,-2.53,-5.379882934172879
Cc1ncc(CO)c(/C=[NH+]\CCCCCC/[NH+]=C\c2c(CO)cnc(C)c2O)c1O,C13704036_decoy,TRY1,Decoy,0,-7.98455,-5.84,-1.66,-7.974128770312657
CC[NH+](CC)C[C@@H]1[C@H](C(=O)N/N=C/C2[NH+]=c3ccccc3=[NH+]2)N=NN1c1nonc1N,C39205133_decoy,TRY1,Decoy,0,-6.82201,-7.9,-1.91,-6.998320296289801
CC[NH+](CC)C[C@@H]1[C@@H](C(=O)N/N=C/C2[NH+]=c3ccccc3=[NH+]2)N=NN1c1nonc1N,C39205135_decoy,TRY1,Decoy,0,-8.73291,-8.22,-0.77,-7.887189392702604
COc1ccc(N/N=C(\[C@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)cc1,C40151189_decoy,TRY1,Decoy,0,-7.79969,-8.1,-1.35,-7.454974866463237
COc1ccc(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]2[NH+]=c3cc(Cl)ccc3=[NH+]C2=O)cc1,C40151193_decoy,TRY1,Decoy,0,-8.66987,-6.97,-0.8,-7.628145850115347
NC(=O)c1c(Nc2nc(NCc3ccco3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301757_decoy,TRY1,Decoy,0,-6.66873,-7.71,-0.62,-8.977769231313733
CCCCC[C@@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)NC(CO)CO)[C@@H](O)C[C@H]1O,C43771995_decoy,TRY1,Decoy,0,-10.5051,-5.17,-3.32,-6.6086607693140165
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C44960129_decoy,TRY1,Decoy,0,-5.5537,-5.52,-2.21,-4.238700419645824
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)ccc1O,C49601483_decoy,TRY1,Decoy,0,-6.43287,-5.9,-3.15,-4.987429203640887
OC[C@@H]1O[C@@H](Nc2ccc(-c3ccc(N[C@@H]4C[C@H](O)[C@H](CO)O4)cc3)cc2)C[C@@H]1O,C04042242_decoy,TRY1,Decoy,0,-6.51628,-8.2,-1.83,-7.943967983004841
NS(=O)(=O)c1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627663_decoy,TRY1,Decoy,0,-9.11297,-6.14,-2.02,-5.776330831105732
C[C@@H](O)[C@@H]1C(=O)N2C(C(=O)[O-])=C(S[C@@H]3C[NH2+][C@H](CNS(N)(=O)=O)C3)[C@H](C)[C@H]12,C55161939_decoy,TRY1,Decoy,0,-8.72814,-4.6,-2.04,-5.795003398950114
O=C(CCSCCC(=O)NC1[NH+]=c2ccccc2=[NH+]1)NC1[NH+]=c2ccccc2=[NH+]1,C63280597_decoy,TRY1,Decoy,0,-7.40907,-8.15,-4.86,-6.2643687222281
c1ccc(N2N[NH2+]N[C@H]2Oc2cccc(C[NH2+]CCC3=c4ccccc4=[NH+]C3)c2)cc1,C63328961_decoy,TRY1,Decoy,0,-7.67174,-7.15,-1.82,-6.1829206935496
c1ccc(N2N[NH2+]N[C@@H]2Oc2cccc(C[NH2+]CCC3=c4ccccc4=[NH+]C3)c2)cc1,C63328962_decoy,TRY1,Decoy,0,-8.43411,-8.34,-1.87,-7.588089499413918
COC(=O)[C@H]1NNN(c2nonc2N)[C@H]1CS[C@@H]1[NH+]=c2ccc([N+](=O)[O-])cc2=[NH+]1,C63503254_decoy,TRY1,Decoy,0,-7.24724,-6.21,-3.22,-7.109170501935473
COC(=O)[C@@H]1NNN(c2nonc2N)[C@H]1CS[C@@H]1[NH+]=c2ccc([N+](=O)[O-])cc2=[NH+]1,C63503255_decoy,TRY1,Decoy,0,-8.25118,-5.72,-2.36,-5.032378441392348
COC(=O)[C@H]1NNN(c2nonc2N)[C@@H]1CS[C@@H]1[NH+]=c2ccc([N+](=O)[O-])cc2=[NH+]1,C63503256_decoy,TRY1,Decoy,0,-7.09916,-5.42,-1.84,-5.227597399583298
COC(=O)[C@@H]1NNN(c2nonc2N)[C@@H]1CS[C@@H]1[NH+]=c2ccc([N+](=O)[O-])cc2=[NH+]1,C63503257_decoy,TRY1,Decoy,0,-7.02226,-5.82,-2.39,-5.621829883317331
CCOC(=O)[C@@H]1NNN(c2nonc2N)[C@@H]1CS[C@@H]1[NH+]=c2ccc(OC)cc2=[NH+]1,C63503261_decoy,TRY1,Decoy,0,-8.50507,-6.6,-2.96,-7.080656703933706
CC[NH+](CC)CCCN1c2nc3ccccc3nc2[C@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1[NH3+],C63766746_decoy,TRY1,Decoy,0,-7.36726,-5.57,-1.49,-5.007466687040025
CC[NH+](CC)CCCN1c2nc3ccccc3nc2[C@@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1[NH3+],C63766747_decoy,TRY1,Decoy,0,-7.62779,-5.17,-1.65,-4.844329673252021
C[C@@H]1CN(C[C@H]2N[NH2+]NN2CC(=O)NCCC2=c3ccccc3=[NH+][C@@H]2C)C[C@H](C)O1,C64083737_decoy,TRY1,Decoy,0,-9.44702,-8.11,-1.26,-7.701446518788134
Cc1cccc(NC(=O)CS[C@@H]2NN[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64097841_decoy,TRY1,Decoy,0,-8.83968,-8.66,-1.47,-7.396815055769439
Cc1cccc(NC(=O)CS[C@H]2NN[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64097850_decoy,TRY1,Decoy,0,-7.33864,-8.11,-1.54,-5.980837281519776
Cc1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c(C)c1,C64098039_decoy,TRY1,Decoy,0,-8.34876,-9.17,-4.99,-8.171533453079372
CC[NH+](CC)CCCN1c2nc(C#N)c(C#N)nc2[C@@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1[NH3+],C64162152_decoy,TRY1,Decoy,0,-7.51164,-6.87,-1.54,-5.702432301442771
C=CCOC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O,C65734160_decoy,TRY1,Decoy,0,-6.32768,-6.16,-1.55,-5.220764405116549
[NH3+]C[C@H](COc1cccc2[nH]c3ccccc3c12)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65734310_decoy,TRY1,Decoy,0,-3.69499,-7.69,-2.19,-7.443961017196846
Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3[NH3+])ccc12,C02387196_decoy,TRY1,Decoy,0,-7.2002,-7.01,-1.97,-4.709454924552404
CC[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC)CCOCCOCC1,C04661811_decoy,TRY1,Decoy,0,-7.48396,-4.4,-2.09,-4.750035226354648
CC[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])CC)CCOCCOCC1,C04661812_decoy,TRY1,Decoy,0,-7.64706,-4.09,-2.22,-4.8462614309768215
CC[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC)CCOCCOCC1,C04661813_decoy,TRY1,Decoy,0,-9.44046,-4.52,-2.54,-5.742185913540437
CC(C)(C)OC(=O)[C@H]([NH3+])CSSC[C@H]([NH3+])C(=O)OC(C)(C)C,C01626949_decoy,TRY1,Decoy,0,-8.3953,-4.18,-3.06,-4.973470194881657
Nc1ncnc2c1c(C1=[NH+]CCCN1)cn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C01606196_decoy,TRY1,Decoy,0,-8.27411,-6.0,0.08,-4.549891420190587
[NH3+]CCCCNc1nc2c(=O)[nH]cnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09886086_decoy,TRY1,Decoy,0,-7.98317,-7.02,-2.27,-7.838237060230078
[NH3+]CCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C12318163_decoy,TRY1,Decoy,0,-8.73046,-7.7,-0.59,-10.474120689641904
Nc1ncnc2c1nnn2[C@H]1O[C@@H](CSCC[NH3+])[C@@H](O)[C@@H]1O,C05011586_decoy,TRY1,Decoy,0,-6.96233,-7.6,-0.96,-7.391195042384537
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13306038_decoy,TRY1,Decoy,0,-6.77465,-4.79,-2.42,-4.3998218999914505
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C13306040_decoy,TRY1,Decoy,0,-6.54861,-4.86,-1.35,-3.800247586125214
CC[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC)CCOCCOCC1,C13633064_decoy,TRY1,Decoy,0,-8.46819,-7.17,-1.95,-7.757710306194666
CSc1nc(O)c2[nH]c(=[NH2+])n([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2n1,C16953328_decoy,TRY1,Decoy,0,-8.71501,-5.23,-1.9,-4.551347818158047
CSc1nc2c([nH]c(=[NH2+])n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)n1C,C16953332_decoy,TRY1,Decoy,0,-7.52393,-4.4,-2.25,-4.667564808214927
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C18995903_decoy,TRY1,Decoy,0,-6.94055,-6.77,-1.02,-7.478740027262862
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C18995907_decoy,TRY1,Decoy,0,-6.572,-5.02,-4.56,-4.204030996758075
CCN(CC)c1ccc(/C=N/[NH+]=C(\N)c2nonc2N)c(O)c1,C17054249_decoy,TRY1,Decoy,0,-7.97071,-7.07,-0.43,-9.02084972120966
Cc1cc(O)oc2cc(=[NH+]C(=O)[C@@H]([NH3+])Cc3ccc(O)cc3)ccc1-2,C25759292_decoy,TRY1,Decoy,0,-9.27515,-8.33,-2.63,-6.065122474643844
[H]/N=C(\Nc1cc(I)ccc1C)[NH+]=C(N)N,C20459052_decoy,TRY1,Decoy,0,-8.54763,-4.11,-0.87,-4.47933531463125
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CC[NH3+])c2C(N)=O)C1,C33521135_decoy,TRY1,Decoy,0,-9.93556,-4.15,-2.26,-5.8195734034909
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C36596709_decoy,TRY1,Decoy,0,-7.18884,-7.07,-2.1,-6.462819315235372
CC(C)(NC(=O)[C@H]([NH3+])CC(N)=O)c1ccc(Br)cc1,C37626843_decoy,TRY1,Decoy,0,-7.59028,-6.11,-0.91,-5.582857056838563
NC(=O)C[C@@H]([NH3+])C(=O)Nc1c(Cl)cc(Cl)c2nsnc12,C37629558_decoy,TRY1,Decoy,0,-8.54078,-5.21,-1.03,-5.73843452393158
C=CCNC(=O)c1oc2c(c1C)/C(=N/NC(N)=[NH2+])CC(C)(C)C2,C39855971_decoy,TRY1,Decoy,0,-9.35175,-6.95,-2.33,-10.156843449715996
CC[C@H](C)Nc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1N,C40760926_decoy,TRY1,Decoy,0,-6.8655,-5.03,-2.66,-4.683509819728179
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)cc1,C42951505_decoy,TRY1,Decoy,0,-8.59409,-6.77,-2.09,-7.198575466386116
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1ccc(Br)cc1,C42959805_decoy,TRY1,Decoy,0,-8.22318,-7.59,-0.78,-13.295815773163
Nc1cc(N)nc(S[C@@H](C[NH3+])c2cccc(Br)c2)n1,C43025213_decoy,TRY1,Decoy,0,-8.03147,-7.6,-1.64,-7.916070500574324
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1cccc(Br)c1,C43025218_decoy,TRY1,Decoy,0,-9.38368,-7.68,-1.56,-9.130649608926268
Nc1cc(=O)[nH]c(S[C@@H](C[NH3+])c2cccc(Br)c2)n1,C43025238_decoy,TRY1,Decoy,0,-7.36935,-6.63,-1.0,-8.96784945250981
CC[NH+](CC)CCC[C@H](C)NC(=O)c1coc([C@@H]([NH3+])[C@@H](C)O)n1,C43217938_decoy,TRY1,Decoy,0,-8.72945,-5.38,-3.74,-7.20618235106524
C[C@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)s1,C43258322_decoy,TRY1,Decoy,0,-9.20215,-6.87,-2.43,-8.139492469216473
C[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccc(Cl)s1,C43258328_decoy,TRY1,Decoy,0,-9.13948,-6.83,-3.21,-8.203342641578056
Nc1cc(N)nc(S[C@H](C[NH3+])c2ccc(Br)s2)n1,C43284203_decoy,TRY1,Decoy,0,-9.08244,-6.36,-1.4,-9.408928396469744
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1cc(Br)cs1,C43291163_decoy,TRY1,Decoy,0,-9.03085,-6.26,-1.07,-7.8945578982609454
CC[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1cc(Br)cs1,C43291187_decoy,TRY1,Decoy,0,-8.72491,-6.44,-1.38,-8.43426376756214
Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3[NH3+])ccc12,C44021575_decoy,TRY1,Decoy,0,-6.34134,-6.18,-2.85,-4.306314628915
NS(=O)(=O)CCNS(=O)(=O)c1cncc(C#CC[NH3+])c1,C44258518_decoy,TRY1,Decoy,0,-9.59338,-5.9,-0.87,-7.263072828349927
NC(=O)COC[C@H]([NH3+])c1cc2[nH]c(=O)[nH]c2cc1Br,C52094757_decoy,TRY1,Decoy,0,-7.50778,-5.24,-1.18,-5.09175333889281
NC(=O)CN(CC(N)=O)[C@H](C[NH3+])c1ccc(Br)cc1,C61805184_decoy,TRY1,Decoy,0,-8.87216,-4.68,-2.31,-8.42571068813941
C[C@H]1CCC[NH+](Cc2c(C(=O)NN)nnn2-c2nonc2N)C1,C62339067_decoy,TRY1,Decoy,0,-7.51244,-4.87,-1.67,-4.928544710212832
CN1NC=C(NC(=O)C(=O)NCCC2=c3ccccc3=[NH+]C2)[C@@H]1C(N)=O,C63281508_decoy,TRY1,Decoy,0,-8.07632,-7.95,-1.42,-6.059464525942666
COc1ccc(Cl)cc1N1NN[C@@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1[NH3+],C63521211_decoy,TRY1,Decoy,0,-5.15995,-6.1,-0.56,-3.854046549578428
[H]/N=C(\NC(N)=[NH2+])Nc1c(Br)cc(F)cc1Br,C20459064_decoy,TRY1,Decoy,0,-8.87631,-4.37,0.21,-5.280238305627144
NN1[C@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@H]1c1ccccc1F,C63619696_decoy,TRY1,Decoy,0,-7.26152,-5.86,-2.51,-5.112652858615569
CCCCS[C@H]1NN[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63761188_decoy,TRY1,Decoy,0,-8.19755,-5.83,-1.95,-5.005367423188257
NS(=O)(=O)c1ccc(C[NH2+]C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)cc1,C63844800_decoy,TRY1,Decoy,0,-8.52116,-5.32,-1.88,-4.984095013474939
COc1ccc2c(c1)=[NH+]CC=2CCN[C@@H]1NN[C@H](C)C(=O)N1N,C63952568_decoy,TRY1,Decoy,0,-7.27749,-6.78,-1.64,-5.6328373572699775
COc1ccc2c(c1)=[NH+]CC=2CCN[C@H]1NN[C@@H](C)C(=O)N1N,C63952571_decoy,TRY1,Decoy,0,-7.75254,-6.97,-2.16,-7.065353333520803
[NH3+]CCc1nc(NCCC[NH+](CCO)CCO)c2ccccc2n1,C65453293_decoy,TRY1,Decoy,0,-9.15323,-5.93,-1.71,-7.826307475381764
CCc1ccc2c(c1)[C@]1([NH2+][C@H](Cc3ccc(O)cc3)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791199_decoy,TRY1,Decoy,0,-9.06264,-9.49,-3.42,-10.923528486556222
COC(C/[NH+]=C/[C@]12CC[C@H](O)C[C@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O)OC,C08914086_decoy,TRY1,Decoy,0,-8.59069,-4.97,-1.85,-6.020361335914368
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H](CCSC)[NH2+][C@]12C(=O)Nc1c(Cl)cccc12,C09130429_decoy,TRY1,Decoy,0,-9.16433,-7.03,-2.28,-9.481618247548145
CCc1ccc(N2C(=O)Nc3ccc(Br)cc3[C@]2(O)C(=O)NC[C@H]2CCC[NH+]2CC)cc1,C09836188_decoy,TRY1,Decoy,0,-10.0342,-7.0,-2.53,-7.790117946074146
CC1CC[NH+](C[C@H](C)CNC(=O)[C@]2(O)c3cc(Br)ccc3NC(=O)N2c2ccccc2)CC1,C03620021_decoy,TRY1,Decoy,0,-9.46355,-6.83,-1.8,-6.954617191913092
CC(C)(O)C#Cc1ccc(C[NH+]2CCC3(CC2)C[C@H]3C(=O)NCCc2c[nH]c3ccccc23)cc1,C12037264_decoy,TRY1,Decoy,0,-8.61503,-7.31,-1.41,-6.197932466621383
COc1ccc([C@@H](C[NH2+]C[C@@H](O)COc2ccc(Br)cc2)c2c[nH]c3ccccc23)cc1,C02639626_decoy,TRY1,Decoy,0,-9.37777,-6.31,-3.06,-6.246520471143698
COc1ccc([C@@H](C[NH2+]C[C@H](O)COc2ccc(Br)cc2)c2c[nH]c3ccccc23)cc1,C02639624_decoy,TRY1,Decoy,0,-8.19734,-8.14,-0.55,-7.949162110871799
COCCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4c(C)cccc43)[C@@H]2C1=O,C12886725_decoy,TRY1,Decoy,0,-7.31013,-6.93,-3.16,-5.4864391183764845
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4c(F)cc(F)cc4Br)c3)cc12,C14961687_decoy,TRY1,Decoy,0,-9.23821,-5.46,-2.14,-5.673765396651032
O=C(NC[C@@H]1COc2ccccc2O1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C14992363_decoy,TRY1,Decoy,0,-9.16235,-6.64,-2.38,-6.515135703991989
CCCC[NH+](CCCC)Cc1ccc(C(=O)NNC(=S)Nc2ccc(Cl)cc2OC)o1,C20734847_decoy,TRY1,Decoy,0,-8.6427,-6.5,-2.39,-6.575160798344981
Cc1cccc(NC(=O)C[NH+]2CCN(CC(=O)NC(=O)Nc3ccc4c(c3)OCO4)CC2)c1C,C23363806_decoy,TRY1,Decoy,0,-9.66823,-10.07,-2.6,-8.87529037386689
C[C@@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)C1,C23372229_decoy,TRY1,Decoy,0,-9.34075,-7.64,-3.4,-6.164163841986273
Cc1ccc(C)c(S(=O)(=O)N2CC[NH+]([C@@H](C)c3nc(N)nc(Nc4ccccc4)n3)CC2)c1,C32850929_decoy,TRY1,Decoy,0,-8.1982,-6.74,-3.29,-5.524186091717677
CCCC[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)co1,C33613023_decoy,TRY1,Decoy,0,-10.228,-6.89,-3.32,-7.0275580409496765
CCC[NH+]1CCc2c(sc(NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c2C(N)=O)C1,C36629331_decoy,TRY1,Decoy,0,-9.04437,-6.25,-2.44,-5.835119115869125
C=CCc1ccccc1OC[C@H](O)C[NH2+][C@]1(C)CCC[C@H](C(C)(C)NC(=O)CBr)C1,C04475094_decoy,TRY1,Decoy,0,-9.35284,-5.7,-2.81,-5.979856928083452
CC(C)(C(=O)NC1[C@@H]2CC3C[C@H]1CC(C(N)=O)(C3)C2)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C34643824_decoy,TRY1,Decoy,0,-8.74369,-6.67,-2.06,-6.371733121538477
O=C(/C=C/[C@@H]1CN(C[C@H](O)C[NH2+]CCc2c[nH]c3ccccc23)c2ccccc21)c1cccs1,C39330700_decoy,TRY1,Decoy,0,-10.8282,-7.64,-1.82,-7.026229370775395
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39631669_decoy,TRY1,Decoy,0,-8.99505,-7.08,-2.45,-7.325073010320609
O=C(NCCNc1ccccc1)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39655574_decoy,TRY1,Decoy,0,-9.26749,-8.6,-2.22,-7.736958505715802
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39673957_decoy,TRY1,Decoy,0,-9.48438,-7.52,-3.09,-6.531631253683865
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685690_decoy,TRY1,Decoy,0,-9.50171,-5.98,-2.45,-6.07447009049647
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)cc1F,C39685791_decoy,TRY1,Decoy,0,-7.89364,-6.72,-1.92,-7.036042859271771
Cc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c(F)c1F,C39685809_decoy,TRY1,Decoy,0,-7.87487,-8.11,-1.9,-6.191119829855545
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685915_decoy,TRY1,Decoy,0,-9.88272,-6.83,-2.24,-9.388542267126212
Cc1cccc(NC(=O)c2ccccc2NC(=O)C(=O)N/N=C/[C@@H]2C=c3ccccc3=[NH+]C2=O)c1,C39948086_decoy,TRY1,Decoy,0,-7.25165,-6.87,-2.72,-6.353778125294185
CC[NH+]1CCN(c2ncnc(Nc3cc(Cl)c([C@H](C#N)c4ccc(Cl)cc4)cc3C)c2N)CC1,C40688650_decoy,TRY1,Decoy,0,-9.95733,-8.41,-1.53,-6.540307177718379
Cc1cc([C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(N(C)C2CC[NH+](C)CC2)c1N,C40688798_decoy,TRY1,Decoy,0,-8.71533,-7.8,-2.41,-6.307334018469799
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1ccc(F)cc1Cl,C40720465_decoy,TRY1,Decoy,0,-9.00975,-6.26,-3.29,-6.854111438842129
CCOc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1ccc(Cl)c(Cl)c1,C40720481_decoy,TRY1,Decoy,0,-10.7311,-5.44,-3.67,-6.149752067049068
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)COc1ccccc1)CCC2,C40816208_decoy,TRY1,Decoy,0,-9.16354,-8.59,-3.68,-6.568554714208761
CC[NH+]1CCN(c2nc(Nc3sc4c(c3C(N)=O)CCC4)c3cnn(-c4ccccc4)c3n2)CC1,C41026352_decoy,TRY1,Decoy,0,-9.29449,-8.23,-2.37,-7.4958872758814845
CC(C)C[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)co1,C43213473_decoy,TRY1,Decoy,0,-9.42944,-7.65,-2.68,-6.8666618996758215
CC[C@@H](C)[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)co1,C43213494_decoy,TRY1,Decoy,0,-9.34421,-6.58,-2.34,-5.923736633406427
CCCC[C@@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)co1,C43218171_decoy,TRY1,Decoy,0,-9.91766,-6.96,-2.42,-6.488631031536649
CSCC[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)co1,C43218174_decoy,TRY1,Decoy,0,-10.7769,-6.45,-2.19,-6.445244956332887
C=CCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)NCCN3CCOCC3)[C@@H](O)[C@H]1[C@@H]2C,C43548280_decoy,TRY1,Decoy,0,-10.7672,-6.4,-2.36,-7.068987158622125
CC(C)(C)c1cc([C@@H]2C[S@+]([O-])C[C@@H](C(=O)NCCc3ccccc3F)[NH2+]2)cc(C(C)(C)C)c1O,C44170678_decoy,TRY1,Decoy,0,-8.54839,-7.27,-3.39,-6.683359668136973
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713972_decoy,TRY1,Decoy,0,-7.47096,-7.04,-1.67,-5.9619579331218615
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44728486_decoy,TRY1,Decoy,0,-8.85168,-8.92,-1.89,-7.887163325361908
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)Nc1nc2c(s1)C[NH+](Cc1ccccc1)CC2,C46914025_decoy,TRY1,Decoy,0,-9.78439,-8.85,-2.1,-7.087862926095848
Cc1cc(C2CC[NH+](C)CC2)cc2[nH]c([C@H]3C(=O)N=CC=C3NC[C@@H](O)c3cccc(Cl)c3)nc12,C52550797_decoy,TRY1,Decoy,0,-9.9069,-7.81,-2.2,-6.709986552919906
CCc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o/c1=[NH+]\c1ccc(S(N)(=O)=O)cc1,C59170651_decoy,TRY1,Decoy,0,-9.57702,-7.56,-1.98,-6.324802037546312
O=C(N[C@H]1NN[C@H](C2CCCCC2)S1)[C@H]1CC(=O)N(CCC2=c3cc(Cl)ccc3=[NH+]C2)C1,C63557059_decoy,TRY1,Decoy,0,-9.98284,-6.45,-2.13,-6.547006080279614
Cc1cc(NC(=O)Nc2ccccc2)c2c(c1)=C(c1ccccc1)[C@@H](C(=O)NCCc1ccco1)[NH+]=2,C63746330_decoy,TRY1,Decoy,0,-8.14521,-9.43,-2.53,-13.151812067470738
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)C1CCC(CN2NNc3ccccc3C2=O)CC1,C63785621_decoy,TRY1,Decoy,0,-8.62756,-8.46,-1.78,-6.654299540253117
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)c1ccccc1NC(=O)[C@H]1NSc2ccccc21,C64540132_decoy,TRY1,Decoy,0,-8.54079,-7.43,-0.51,-7.496904146863493
Cc1ccc(S(=O)(=O)Nc2cnc(N3CC[NH2+]CC3)c(C(=O)NC3CCCCCC3)c2)c(C)c1,C65025218_decoy,TRY1,Decoy,0,-8.99328,-6.38,-3.16,-5.82760013878734
CC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCc1ccco1,C03841071_decoy,TRY1,Decoy,0,-8.83848,-5.79,-3.24,-5.877772200458668
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)c4cccs4)nc3[C@@H](CC(=O)NC3CC3)[C@]2(C)CC[C@H]1O,C03841109_decoy,TRY1,Decoy,0,-10.7326,-7.28,-2.08,-9.07372778946772
COc1c(Cl)cc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CC[C@@H](C(C)(C)C)C3)cc1Cl,C08896551_decoy,TRY1,Decoy,0,-11.1202,-6.5,-3.4,-7.533784232495464
Cc1cccc(NC(=S)NNC(=S)NC(=O)c2cc(Br)ccc2Cl)c1C,C03257429_decoy,TRY1,Decoy,0,-8.85984,-5.48,-1.81,-5.612330345899656
Cc1c(Cc2ccccc2)sc(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1C(N)=O,C10402576_decoy,TRY1,Decoy,0,-8.16197,-7.3,-2.2,-6.221587203715609
Cc1cc(C)c(NC(=O)CSCc2nc(N)nc(Nc3ccc(Cl)cc3)n2)c(Cl)c1,C12917141_decoy,TRY1,Decoy,0,-8.14395,-8.3,-3.83,-6.704250548631738
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NC[C@H]3CCCO3)CCC4)[nH]n2)c(O)c1,C08845583_decoy,TRY1,Decoy,0,-10.7825,-9.23,-0.86,-9.461735527446136
CC(C)(C)[C@@H]1CCc2c(sc(NC(=S)NC(=O)c3ccccc3Br)c2C(N)=O)C1,C14276507_decoy,TRY1,Decoy,0,-9.43185,-6.12,-2.08,-6.539827254191643
CC(C)c1ccc(/N=C2\N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCCN4CCOCC4)[C@H]3S2)cc1,C20504132_decoy,TRY1,Decoy,0,-10.0328,-7.13,-1.48,-7.162421980221026
O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2,C20681416_decoy,TRY1,Decoy,0,-9.21429,-8.78,-1.57,-7.342915287466909
Nn1c(N/N=C/c2c(O)ccc3ccccc23)nnc1SCc1ccc(Br)cc1,C20916769_decoy,TRY1,Decoy,0,-10.0603,-9.35,-1.68,-11.264847306042263
Nn1c(N/N=C/c2cc(Cl)ccc2O)nnc1SCC(=O)C1C2CC3CC(C2)CC1C3,C21320051_decoy,TRY1,Decoy,0,-9.75977,-8.42,-1.86,-11.731388159240964
Cc1c(Cl)cccc1Nc1nnc(S[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1,C24503715_decoy,TRY1,Decoy,0,-9.48435,-8.92,-1.61,-8.686311798769776
COc1ccc(Br)cc1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCCC2,C32125164_decoy,TRY1,Decoy,0,-9.98678,-5.36,-2.88,-5.993007175171147
CC(C)OC(=O)[C@]1(C#N)[C@@H](c2ccc(Cl)c(Cl)c2)[C@@H](C(N)=O)N2C=C(C(N)=O)C=C[C@@H]21,C34701371_decoy,TRY1,Decoy,0,-8.43258,-6.28,-1.58,-5.886415174963168
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)C1CCCCC1)c1cccc(Cl)c1,C36480615_decoy,TRY1,Decoy,0,-9.07483,-6.14,-3.21,-6.570693236683701
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccco1)c1ccccc1Cl,C36543942_decoy,TRY1,Decoy,0,-6.94011,-6.91,-3.42,-5.895718456875206
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(Cl)c1)c1ccccc1Cl,C36544173_decoy,TRY1,Decoy,0,-7.10055,-5.64,-4.44,-5.445683724907706
O=C(NC1CCCCC1)[C@@H](c1cccc(O)c1)N(C(=O)c1c(O)cccc1O)c1ccccc1Cl,C36545149_decoy,TRY1,Decoy,0,-7.55676,-7.59,-1.6,-7.472723848918378
CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1cccc(O)c1O)c1ccccc1Cl,C36545343_decoy,TRY1,Decoy,0,-8.70349,-5.52,-1.86,-6.18083640359232
CCCCNC(=O)[C@@H](c1ccccc1O)N(C(=O)c1cccc(O)c1O)c1ccccc1Cl,C36545389_decoy,TRY1,Decoy,0,-7.91545,-4.96,-3.82,-5.587778654900404
CCCCCC(=O)N(c1ccccc1Cl)[C@@H](C(=O)NCCCC)c1c(O)cc(O)cc1O,C36547954_decoy,TRY1,Decoy,0,-7.64419,-6.42,-2.89,-8.47618268966675
CCCN(C(=O)Cc1ccccc1C)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36561468_decoy,TRY1,Decoy,0,-8.14889,-6.82,-2.38,-8.726467421393115
CCCN(C(=O)CCC1CCCCC1)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36562468_decoy,TRY1,Decoy,0,-9.14555,-5.17,-2.42,-5.969954322923516
COc1cc([C@H]2NC(=S)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2cccs2)cc(OC)c1O,C08684309_decoy,TRY1,Decoy,0,-8.3375,-5.53,-2.44,-5.7195879108778405
COc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCc4ccc(Br)cc4)N3N)N=N2)cc1,C39007552_decoy,TRY1,Decoy,0,-10.9827,-5.47,-1.49,-6.198820563737383
Cc1cc(SCC(=O)NCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(C)cc1Br,C39558954_decoy,TRY1,Decoy,0,-9.7411,-6.49,-3.99,-6.496313111925323
CC1(C)[C@@]2(C(=O)NCCCNC(=O)[C@]34CC[C@](C)(/C(=N/O)C3)C4(C)C)CC[C@]1(C)/C(=N/O)C2,C33957387_decoy,TRY1,Decoy,0,-8.55568,-7.3,-1.65,-7.597716676478624
CC(=O)Nc1ccc(NC(=S)N[C@@H](NC(=O)c2cccs2)C(Cl)(Cl)Cl)cc1,C39859819_decoy,TRY1,Decoy,0,-8.94157,-5.5,-2.26,-5.398970645521247
CCCCCCc1ccnc(C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)c1,C40447380_decoy,TRY1,Decoy,0,-7.07368,-7.22,-4.31,-6.290042329106508
COC[C@@H](C)Nc1ncnc(Nc2cc(Cl)c([C@H](C#N)c3ccc(Cl)cc3)cc2C)c1N,C40688804_decoy,TRY1,Decoy,0,-8.4163,-7.16,-3.19,-5.5462208820660654
Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Sc1ccc(Cl)cc1,C40723078_decoy,TRY1,Decoy,0,-8.78782,-7.81,-3.2,-7.099824062789507
C[C@H](Nc1cc(-c2[nH]c(SC[C@H](O)CO)nc2-c2ccc(F)cc2)ccn1)c1ccccc1,C40872636_decoy,TRY1,Decoy,0,-9.18345,-6.5,-1.05,-6.860106454972427
CC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)NC1CC1,C43553436_decoy,TRY1,Decoy,0,-9.48164,-5.88,-3.35,-6.196146261452749
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)C4CCC4)nc3[C@@H](CC(=O)NC3CCCCC3)[C@@]2(C)CC[C@H]1O,C43553535_decoy,TRY1,Decoy,0,-10.9837,-6.46,-2.53,-7.218299173376303
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)NCc2cccs2)[C@]1(C)CO,C43553896_decoy,TRY1,Decoy,0,-9.48172,-5.74,-3.76,-6.471126442105292
CCCNC(=O)CCC[C@H]1CC[C@@]2(C)[C@H]3[C@H](O)C[C@@]4(C)C[C@H](O)CC[C@@]4(C)[C@@H]3C[C@H](O)[C@@]12C,C44699928_decoy,TRY1,Decoy,0,-9.4592,-7.98,-3.0,-7.23371679465628
CC(C)NS(=O)(=O)c1ccc(/C=C/C(=O)NNC(=S)Nc2ccc(C(C)C)cc2)cc1,C46768283_decoy,TRY1,Decoy,0,-8.59046,-6.8,-4.01,-5.824664091113972
Cc1n[nH]c(O)c1[C@H](c1ccc(OCc2ccccc2C#N)c(Br)c1)c1c(O)n[nH]c1C,C08782324_decoy,TRY1,Decoy,0,-8.17792,-7.38,-4.43,-6.239175957908472
CCCCc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC(N)=O)C(=O)Nc3c2ccc(C)c3C)cc1,C35365918_decoy,TRY1,Decoy,0,-8.99657,-5.88,-1.5,-5.904725719391074
C[C@@H]1CCc2c(sc(NC(=S)NC(=O)/C=C/c3ccc(-c4ccccc4)o3)c2C(N)=O)C1,C57314062_decoy,TRY1,Decoy,0,-9.63282,-8.33,-2.88,-7.547825468384308
NC(=O)c1c(NC(=S)NC(=O)c2ccc(-c3ccc(Br)cc3)o2)sc2c1CCC2,C16429502_decoy,TRY1,Decoy,0,-12.6681,-7.8,-3.77,-7.8482265812613905
Nn1c(SCCCC(=O)N/N=C/c2cccc(Br)c2)nnc1-c1ccccc1O,C58987091_decoy,TRY1,Decoy,0,-9.79968,-8.2,-2.2,-7.780700804049217
Nn1c(SCCCC(=O)N/N=C/c2ccc(Cl)cc2Cl)nnc1-c1ccccc1O,C58989013_decoy,TRY1,Decoy,0,-10.4497,-8.36,-4.03,-7.866343747932169
Cc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59016913_decoy,TRY1,Decoy,0,-10.0926,-8.01,-3.71,-7.934294708994525
Fc1ccccc1NC(=S)Nc1ccc(Oc2ccc(NC(=S)Nc3ccccc3F)cc2)cc1,C59112562_decoy,TRY1,Decoy,0,-10.3272,-9.0,-2.81,-10.548800123766972
C=C1C=C([O-])N2C(=NC(NCCc3c[nH]c4ccc(OC)cc34)=[NH+][C@H]2c2ccc(Cl)cc2)N1,C59605606_decoy,TRY1,Decoy,0,-8.95812,-6.57,-1.16,-5.48006789806496
CCCCn1c(N)c(N(CC)C(=O)CNC2(c3ccc(Cl)cc3)CCCCC2)c(=O)[nH]c1=O,C60343285_decoy,TRY1,Decoy,0,-8.95389,-7.59,-1.98,-6.544648291274531
CCCCc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(N[C@@H]3CC(N)=O)C(=O)Nc3c2ccc(Cl)c3C)cc1,C15957668_decoy,TRY1,Decoy,0,-9.83218,-5.5,-2.0,-5.772804437693564
NC(=O)[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)CSc1nc(-c2ccc(Br)cc2)n[nH]1,C39936249_decoy,TRY1,Decoy,0,-11.3242,-7.27,-1.95,-6.807696920812452
Cc1ccc(N(CC(=O)NCCC(C)C)C(=O)c2snc(C(N)=O)c2N)c(C)c1,C04188479_decoy,TRY1,Decoy,0,-7.80608,-6.86,-2.18,-8.316368752815588
OCC(CO)(CO)NC(=S)Nc1ccc(I)cc1,C01041485_decoy,TRY1,Decoy,0,-7.96719,-4.95,-0.92,-5.578999997071022
C=C(NNC(=O)CONC(=C)c1cccs1)c1ccc(N)cc1,C03173867_decoy,TRY1,Decoy,0,-7.58005,-7.52,-2.81,-7.244518198051445
CCCCOC(=S)N[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C05298308_decoy,TRY1,Decoy,0,-5.69053,-4.94,-4.54,-4.056902643937101
CC(C)C[C@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1,C06190449_decoy,TRY1,Decoy,0,-8.05804,-6.94,-0.2,-9.296718990471916
CCn1cc(N)c(C(=O)NNC(=S)N[C@H](C)c2ccccc2)n1,C02795598_decoy,TRY1,Decoy,0,-7.80846,-7.34,-0.93,-6.665675531221081
C=CCNC(=S)Nc1cccc(NC(=O)C[C@@H]([NH2+]CCc2ccccc2)C(=O)[O-])c1,C09326597_decoy,TRY1,Decoy,0,-7.53579,-6.11,-4.07,-6.264998263525254
COc1ccc(Cl)cc1C(=O)NNC(=O)CCCNC(N)=O,C07988555_decoy,TRY1,Decoy,0,-8.02252,-7.23,-1.08,-7.981872861046771
O=C(/C=C/c1ccccc1)OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO,C12876637_decoy,TRY1,Decoy,0,-8.30718,-5.99,-0.3,-6.981852895636916
Cc1cc(C)c(NC(=O)CNC(=O)CCCCCNC(N)=O)c(C)c1,C14941461_decoy,TRY1,Decoy,0,-6.83182,-5.81,-2.78,-6.120604695456393
CCNc1nc(N[C@H](C)CC)nc(SCC(=O)NN)n1,C16847775_decoy,TRY1,Decoy,0,-7.68038,-5.78,-1.18,-9.073201109416294
CCNc1nc(NC(C)(C)C)nc(S[C@@H](C)C(=O)NN)n1,C16847778_decoy,TRY1,Decoy,0,-7.09636,-6.39,-0.98,-9.347965025455595
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=O)COc1c(C)cccc1C,C25257630_decoy,TRY1,Decoy,0,-7.62508,-7.01,-4.34,-6.993720723166208
C[C@@H](SCCC(N)=O)c1nc(N)nc(Nc2ccccc2)n1,C27189001_decoy,TRY1,Decoy,0,-8.03923,-6.09,-1.69,-6.418321388355768
CC(C)CN(Cc1ccc(C(N)=O)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C31557057_decoy,TRY1,Decoy,0,-7.66155,-5.88,-1.44,-6.669081925661686
COc1cc(CC[C@H](O)C[C@@H](O)CCc2ccc(O)c(O)c2)ccc1O,C13377908_decoy,TRY1,Decoy,0,-8.15562,-8.02,-0.78,-6.504122270787596
NN1[C@@H](SCC(=O)Nc2ccccc2C(F)(F)F)NN[C@H]1[C@@H]1C=C(c2ccccc2)N=N1,C38989581_decoy,TRY1,Decoy,0,-8.33125,-9.08,-2.79,-8.045149743063892
CCCCSC(SCCCC)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C39951581_decoy,TRY1,Decoy,0,-9.44914,-6.12,-3.65,-11.05229788570958
CCN(CCCNC(=O)c1cc(N)cc(N)c1)S(C)(=O)=O,C40335985_decoy,TRY1,Decoy,0,-7.58802,-6.58,-1.66,-9.771754301691171
CCN(CCO)c1ncnc(NNC(=O)c2ccc(F)cc2)c1N,C40736239_decoy,TRY1,Decoy,0,-7.44969,-6.58,-0.3,-6.853030730609374
COCCCNc1ncnc(NNC(=O)c2ccccc2C)c1N,C40757213_decoy,TRY1,Decoy,0,-7.22215,-5.26,-1.09,-5.531487956369319
Nc1c(NCCc2cccs2)ncnc1NNC(=O)c1ccco1,C40794613_decoy,TRY1,Decoy,0,-7.24331,-6.8,-2.51,-5.809869511073558
Cc1ccc(S(=O)(=O)NNc2ncnc(NCCC(C)C)c2N)cc1,C40794684_decoy,TRY1,Decoy,0,-8.0882,-7.16,-2.28,-6.1705372159159815
COC[C@H](C)Nc1ncnc(NNC(=O)Cc2ccccc2)c1N,C40795178_decoy,TRY1,Decoy,0,-7.91486,-5.84,-1.13,-5.401768568036722
Cc1ccc(CSCC(=O)NC(C(N)=O)C(N)=O)cc1,C42788470_decoy,TRY1,Decoy,0,-6.66371,-6.81,-2.89,-6.4763623736999145
CCCC(CCC)(C(=O)Nc1c(C)n[nH]c1C)/C(N)=N/O,C44868753_decoy,TRY1,Decoy,0,-6.595,-5.8,-1.19,-8.449964325432465
CCc1ccc(S(=O)(=O)NCCCS(N)(=O)=O)cc1N,C45068017_decoy,TRY1,Decoy,0,-8.72241,-5.11,-4.18,-5.363212039604163
Cc1ccccc1Nc1nc(N)nc(CSCCC(N)=O)n1,C46835257_decoy,TRY1,Decoy,0,-7.65745,-6.18,-1.95,-7.861033063506623
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=S)NNC(=O)[C@@H](C)NC(=O)Nc1ccccc1,C47872059_decoy,TRY1,Decoy,0,-8.31361,-7.83,-3.87,-6.403344386898495
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)Nc1sccc1C(N)=O,C47969069_decoy,TRY1,Decoy,0,-7.76131,-7.73,-1.88,-6.389206177143631
NC(=O)CCCNC(=O)Cc1ccc(S(N)(=O)=O)s1,C48966223_decoy,TRY1,Decoy,0,-8.99476,-5.61,-2.31,-6.8330212432915545
CCC[NH+]1CCC(NC(=O)N[C@@H](CC(N)=O)C(=O)[O-])CC1,C49560827_decoy,TRY1,Decoy,0,-6.77925,-3.98,-4.41,-3.964378242979885
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)COc1ccccc1F,C08188832_decoy,TRY1,Decoy,0,-6.66979,-6.22,-2.07,-5.521552078698684
CC[C@H](C)[C@H](NC(N)=O)C(=O)NCCCc1cn[nH]c1C,C50183383_decoy,TRY1,Decoy,0,-7.6243,-6.03,-3.23,-5.695074015181909
Cc1[nH]ncc1CCCNS(=O)(=O)c1ccc(NN)nc1,C50183826_decoy,TRY1,Decoy,0,-7.6648,-7.25,-2.32,-8.044351275990616
CS(=O)(=O)c1ccc(N)c(S(=O)(=O)NCCCC(N)=O)c1,C50660361_decoy,TRY1,Decoy,0,-7.35269,-6.24,-2.58,-6.307781123899412
CCCCCNC(=O)C1CCN(Cc2nc(N)nc(N)n2)CC1,C52721971_decoy,TRY1,Decoy,0,-7.40129,-6.93,-2.06,-5.936538116295861
CSCC[C@H](NC(N)=O)C(=O)NC1(CO)CCCCC1,C53095414_decoy,TRY1,Decoy,0,-7.60149,-5.12,-1.7,-5.547118114382223
CSCC[C@@H](NC(N)=O)C(=O)N[C@@]1(CO)CCC[C@@H](C)C1,C53106778_decoy,TRY1,Decoy,0,-8.15325,-5.7,-0.88,-6.126598249436136
NC(=S)NNCC(=O)C[C@](O)(C(F)(F)F)C(F)(F)Cl,C05500713_decoy,TRY1,Decoy,0,-6.73439,-5.69,-1.22,-8.162137931665551
O=C(CNC(=O)NCc1ccco1)NNC(=S)Nc1ccc(F)cc1F,C58868021_decoy,TRY1,Decoy,0,-6.91491,-5.77,-1.84,-5.43895632763544
C/C(=N\Nc1nc(SCCCO)n[nH]1)c1ccc(N)cc1,C59879557_decoy,TRY1,Decoy,0,-7.96126,-7.49,-3.07,-8.683377188055882
CCCCNC(=O)CO/N=C(/N)C1=C(N)C2(CCCC2)N(C)C1=O,C63456368_decoy,TRY1,Decoy,0,-7.53603,-5.65,-1.37,-5.8114991421573
C=CCNC(=O)c1ccccc1NC(=O)[C@@H](CCC)NC(N)=O,C64289811_decoy,TRY1,Decoy,0,-5.92757,-6.7,-2.68,-7.089565474094005
CCCCNC(=O)NC1(C(=O)NNC(=O)NCC)CCCCC1,C65189190_decoy,TRY1,Decoy,0,-7.50241,-5.34,-1.68,-5.099416666859443
Cc1[nH]c2ccc(CNC(=O)Nc3ccccc3OCCC(N)=O)cc2c1C,C65464499_decoy,TRY1,Decoy,0,-8.40821,-5.79,-0.8,-6.276291670243706
Cc1ccccc1[C@@H](CC(=O)NCc1n[nH]c(=S)n1C(C)C)NC(N)=O,C66640576_decoy,TRY1,Decoy,0,-7.11923,-6.55,-1.01,-6.5138400377639964
CCOCC(=O)NNC(=O)C[C@@H](NC(N)=O)c1ccccc1C,C66655535_decoy,TRY1,Decoy,0,-7.67972,-6.4,-2.77,-8.161900204711124
COCCNC(=O)NC(=O)[C@H](C)Nc1ccc(C)c(C(N)=O)c1,C66963332_decoy,TRY1,Decoy,0,-7.2674,-5.8,-1.87,-5.314840367394649
CC(C)CCC(=O)NNC(=O)N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1,C67104367_decoy,TRY1,Decoy,0,-8.59251,-7.39,-3.23,-6.709120552389496
CC(=O)NCCNC(=O)C[C@@H]1c2nc(NC(=O)c3ccnc(Cl)c3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222382_decoy,TRY1,Decoy,0,-12.0456,-6.4,-2.84,-7.504561394862463
S=C(NNC(=S)Nc1ccc2c(c1)OCCO2)NNc1ccccc1,C01045719_decoy,TRY1,Decoy,0,-8.71588,-7.15,-0.54,-5.88637102186613
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C/[C@@H](O)[C@H](O)[C@H](O)[C@@H](C)O,C04763773_decoy,TRY1,Decoy,0,-8.7929,-6.94,-3.54,-6.939517552316229
CC(C)CCNC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1ccc(C(C)C)cc1,C06133989_decoy,TRY1,Decoy,0,-8.31896,-7.65,-4.49,-7.95500214439465
COc1ccc([C@H](C(=O)NCCC(C)C)N(Cc2ccc(F)cc2)C(=O)c2snc(C(N)=O)c2N)cc1,C06134227_decoy,TRY1,Decoy,0,-7.85984,-7.45,-1.33,-7.901226352414373
CN(/N=C/C(=N\Nc1ccccc1)[C@H](O)[C@@H](O)[C@H](O)CO)c1ccccc1,C06178434_decoy,TRY1,Decoy,0,-8.1855,-7.37,-1.55,-9.852354143041888
CCCC[C@@H](C(=O)NC1CCCC1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06481330_decoy,TRY1,Decoy,0,-7.59087,-6.16,-5.15,-6.056822399072007
CCCC[C@H](C(=O)NC1CCCC1)N(Cc1ccccc1Cl)C(=O)c1snc(C(N)=O)c1N,C06481487_decoy,TRY1,Decoy,0,-8.5895,-7.12,-2.68,-8.03057274570309
CCOCCCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCC(C)C)c1ccc(C)cc1,C06600109_decoy,TRY1,Decoy,0,-9.25794,-6.67,-1.68,-8.741760672096078
CCOc1ccc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2)cc1,C06601268_decoy,TRY1,Decoy,0,-8.80516,-5.13,-1.29,-6.821261600182431
COCCNC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1ccc(C2CCCCC2)cc1,C06904909_decoy,TRY1,Decoy,0,-8.3733,-7.31,-2.27,-8.972838835526229
C[C@@H](OC(=O)c1ccccc1NCCO)C(=O)Nc1sccc1C(N)=O,C07132254_decoy,TRY1,Decoy,0,-9.19496,-6.83,-2.15,-8.791797462368269
O=S1(=O)CC[C@H](NC(=S)Nc2ccc(O)c(NC(=S)N[C@H]3CCS(=O)(=O)C3)c2)C1,C12139566_decoy,TRY1,Decoy,0,-10.156,-6.52,-1.81,-6.928978646965599
COCCNC(=O)[C@H](c1ccc(OC)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C12467341_decoy,TRY1,Decoy,0,-7.55814,-6.52,-2.84,-7.715399755588732
Cc1ccccc1CCN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC1CCCC1)c1ccc(F)cc1,C12473695_decoy,TRY1,Decoy,0,-9.30277,-7.48,-3.32,-12.183921788593551
NC(=S)NNC(=S)NC(=O)CCCOc1ccc(Cl)cc1Cl,C06861803_decoy,TRY1,Decoy,0,-8.79968,-6.49,-2.26,-7.317207463847117
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCC(C)C)c2ccc(C)o2)cc1,C12715108_decoy,TRY1,Decoy,0,-8.00028,-5.09,-3.29,-6.920347226005995
NC(=O)c1nsc(C(=O)N(c2ccccc2)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccncc2)c1N,C06446479_decoy,TRY1,Decoy,0,-7.11167,-7.24,-1.83,-7.079737122980463
CCOc1cc(/C=N/NC(N)=S)c(Br)cc1OCC(N)=O,C13747674_decoy,TRY1,Decoy,0,-9.23975,-5.78,-1.42,-9.113895367810462
CCOc1ccc(NC(=S)/N=C(\NCCc2ccc(S(N)(=O)=O)cc2)Nc2nc(C)cc(C)n2)cc1,C14157942_decoy,TRY1,Decoy,0,-9.7747,-7.98,-3.92,-7.036516420379445
CCCNC(=S)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C15559341_decoy,TRY1,Decoy,0,-8.7025,-5.96,-2.99,-6.028416944903765
C=CCc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3cccc(Br)c3)n2N)c1O,C20527512_decoy,TRY1,Decoy,0,-9.59436,-7.17,-3.13,-6.889418861302811
CCc1nnc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n1N,C20843337_decoy,TRY1,Decoy,0,-8.00174,-5.99,-4.0,-5.68875205796265
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cccc(Cl)c3)n2N)c(O)c1,C21325601_decoy,TRY1,Decoy,0,-10.1683,-6.74,-1.57,-6.527327078021741
CCCCn1c(N)c(N(CC)CC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)c(=O)[nH]c1=O,C24956284_decoy,TRY1,Decoy,0,-8.46261,-7.92,-3.52,-7.866800894535067
COc1ccccc1[C@@H]1[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C(=O)N(c3ccc(C)c(Cl)c3)C(=O)[C@H]21,C33638394_decoy,TRY1,Decoy,0,-9.06579,-7.53,-1.47,-8.521754552041232
COc1ccccc1[C@H]1[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C(=O)N(c3ccc(C)c(Cl)c3)C(=O)[C@@H]12,C33638397_decoy,TRY1,Decoy,0,-8.26144,-5.05,-1.21,-5.889912417077038
CCCCn1c(N)c(N(CCC(C)C)C(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)[nH]c1=O,C36396603_decoy,TRY1,Decoy,0,-9.5201,-5.77,-2.73,-5.9724632038702286
CCCCCC(=O)N[C@@H](NC(=S)Nc1ccc(S(N)(=O)=O)cc1)C(Cl)(Cl)Cl,C08672715_decoy,TRY1,Decoy,0,-9.54222,-5.61,-1.94,-6.209773480119186
C=CC[NH+]1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@H]1c1ccc(Cl)cc1,C39692292_decoy,TRY1,Decoy,0,-7.41082,-7.67,-3.07,-6.64637656288537
C=CCNC(=O)N[C@H]1N[C@H](CC(=O)NCCc2c[nH]c3ccccc23)CS1,C39710037_decoy,TRY1,Decoy,0,-8.0288,-7.27,-1.39,-7.291515491694103
C=CCNC(=S)NNC(=O)[C@@H](CCC)NC(=O)NCc1ccc(F)cc1,C42011723_decoy,TRY1,Decoy,0,-7.51403,-6.23,-1.88,-5.705124918627493
NC(=O)CSc1ccccc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1,C45694691_decoy,TRY1,Decoy,0,-7.86256,-4.91,-3.79,-5.457912057702139
Cc1ccc(NC(=S)NNC(=O)CNC(=O)NCc2ccco2)cc1C,C58866107_decoy,TRY1,Decoy,0,-8.09689,-6.24,-3.42,-5.919716043275953
CCOC(=O)C1=C(N)OC(C)=C(C(N)=O)[C@H]1c1ccc([NH+](CC)CC)cc1,C58949338_decoy,TRY1,Decoy,0,-6.04995,-5.2,-0.3,-5.161859974178527
CCOC(=O)C1=C(N)OC(C)=C(C(N)=O)[C@@H]1c1ccc([NH+](CC)CC)cc1,C58949339_decoy,TRY1,Decoy,0,-6.74536,-5.45,-2.38,-5.347189598955343
C/C(=N\Nc1nc(SCCC(=O)NC(C)(C)C)n[nH]1)c1ccc(N)cc1,C59816178_decoy,TRY1,Decoy,0,-7.92039,-8.55,-1.97,-6.938063304842371
COc1ccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(C)=O)n[nH]2)cc1O,C59879289_decoy,TRY1,Decoy,0,-8.50797,-6.78,-1.92,-6.880310200531532
Cc1cc(O)c(C(=O)[O-])cc1S(=O)(=O)NNC(=O)NCCCn1cc[nH+]c1,C64375784_decoy,TRY1,Decoy,0,-8.3414,-8.42,-4.25,-8.813514440185651
CC[C@@]1(c2ccc(NC(=O)CCCCNC(N)=O)cc2)CCC(=O)NC1=O,C54198780_decoy,TRY1,Decoy,0,-7.43451,-6.49,-2.31,-6.038800854979136
CC(C)Cn1c(=O)[nH]c(=O)c2c(C(=O)N(CC(N)=O)CC(N)=O)cc(C3CC3)nc21,C65567387_decoy,TRY1,Decoy,0,-7.06671,-6.2,-1.97,-5.387635406765593
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)NCCc1ccc(O)c(O)c1,C65734838_decoy,TRY1,Decoy,0,-8.87269,-6.43,-1.95,-6.028448780672095
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)NCCc1ccc(O)c(O)c1,C65734844_decoy,TRY1,Decoy,0,-8.7348,-7.4,-2.53,-7.2119887994458
CC(C)(C)c1ccc(OCC(=O)N[C@H](CO)[C@@H](O)c2ccc(N)cc2)cc1,C66142601_decoy,TRY1,Decoy,0,-8.14057,-7.63,-0.83,-6.106963346827775
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](CO)[C@H](O)c1ccc(N)cc1,C66142729_decoy,TRY1,Decoy,0,-7.25946,-7.36,-1.56,-6.974083187356092
COc1ccc(OC[C@@H](O)CSc2nc(N)cc(N)n2)c(C(C)(C)C)c1,C66238849_decoy,TRY1,Decoy,0,-8.43312,-5.31,-1.05,-5.854604352987937
Nc1cc(N)nc(SC[C@@H](O)COC(c2ccccc2)c2ccccc2)n1,C66238872_decoy,TRY1,Decoy,0,-7.37644,-6.65,-3.03,-6.622463627988299
CCOCCCNC(=O)NNC(=O)CCCNC(=O)NC1CCCCC1,C67311923_decoy,TRY1,Decoy,0,-7.96309,-6.27,-1.68,-5.566912837270439
CCOc1ccc(F)cc1NC(=O)C(=O)NCCCc1n[nH]c(N)c1C#N,C67491103_decoy,TRY1,Decoy,0,-7.66883,-8.42,-2.28,-7.069492833501366
CSCc1ccc(NC(=O)C(=O)NCCCc2n[nH]c(N)c2C#N)cc1,C67491115_decoy,TRY1,Decoy,0,-7.93721,-7.95,-2.37,-7.604208936839679
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O,C04349196_decoy,TRY1,Decoy,0,-9.38722,-7.32,-2.56,-5.816477614741048
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C04557191_decoy,TRY1,Decoy,0,-4.48593,-5.41,-1.18,-3.9275079101076575
C[C@H]([NH3+])C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)[O-],C05957367_decoy,TRY1,Decoy,0,-6.74041,-6.9,-1.88,-6.693759840419072
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](C)[NH3+])C(=O)[O-],C05957415_decoy,TRY1,Decoy,0,-8.22474,-6.24,-3.42,-6.821926927488083
C[C@H]([NH3+])C(=O)N[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)[O-],C05957443_decoy,TRY1,Decoy,0,-7.67444,-7.21,-2.34,-7.756219105676628
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H](C)[NH3+])C(=O)[O-],C05957472_decoy,TRY1,Decoy,0,-9.0041,-7.63,-3.69,-7.159012568824237
CCOC(=O)CNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1CC,C06860607_decoy,TRY1,Decoy,0,-7.18585,-5.66,-3.58,-6.451672144119407
Nc1ncnc2c1nc(N/N=C/c1ccc(-c3ccc([N+](=O)[O-])cc3)cc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975204_decoy,TRY1,Decoy,0,-8.46419,-8.18,-1.9,-7.14703543393972
Nc1ncnc2c1nc(N/N=C/C=C/c1ccc([N+](=O)[O-])o1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975210_decoy,TRY1,Decoy,0,-7.95035,-6.47,-3.33,-6.408525032077839
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@H](C(=O)NC2CCCC2)c2ccc3ncccc3c2)c1N,C06445443_decoy,TRY1,Decoy,0,-8.78936,-6.14,-1.33,-6.185389355593367
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)cc1,C13520543_decoy,TRY1,Decoy,0,-5.41215,-6.24,-3.7,-4.4782219458772365
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C14586546_decoy,TRY1,Decoy,0,-5.38577,-8.16,-3.64,-5.406124093304893
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205622_decoy,TRY1,Decoy,0,-4.20454,-5.85,-2.17,-3.771962077438782
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205654_decoy,TRY1,Decoy,0,-5.28788,-6.8,-4.1,-4.223686857675138
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15206265_decoy,TRY1,Decoy,0,-6.80126,-6.11,-2.33,-5.062944488375197
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3c(O)ccc4ccccc34)n2N)n1,C20806816_decoy,TRY1,Decoy,0,-9.16573,-8.32,-1.31,-7.524312797048512
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(F)cc3)n2)s1,C20833280_decoy,TRY1,Decoy,0,-9.91507,-7.99,-1.97,-10.749174875744597
C[C@@H](OC(=O)c1csc(S(N)(=O)=O)c1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C21839517_decoy,TRY1,Decoy,0,-10.3423,-7.3,-3.4,-7.210798557652041
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22064969_decoy,TRY1,Decoy,0,-6.31315,-6.52,-1.72,-5.561298358298981
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C22065067_decoy,TRY1,Decoy,0,-5.0807,-6.93,-3.59,-4.609782788061605
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22065079_decoy,TRY1,Decoy,0,-6.04569,-6.08,-4.23,-4.410700941457115
C[NH2+]CC[C@H](Oc1ccc(O[C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]2O)c2ccccc12)c1cccs1,C27103614_decoy,TRY1,Decoy,0,-7.3947,-6.91,-4.19,-7.187666953579758
COc1cc2oc(=O)ccc2c(OC)c1C[C@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31166210_decoy,TRY1,Decoy,0,-6.27205,-7.08,-3.47,-5.036694539591228
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)cc1,C33770974_decoy,TRY1,Decoy,0,-5.00174,-5.39,-2.71,-4.016324483279681
COc1ccc(Br)cc1[C@H]1[NH2+][C@](CCCC[NH3+])(C(=O)[O-])[C@@H]2C([O-])=NC(=O)[C@@H]12,C34388588_decoy,TRY1,Decoy,0,-8.86867,-5.63,-1.68,-5.988924028056951
COc1ccc(Br)cc1[C@@H]1[NH2+][C@](CCCC[NH3+])(C(=O)[O-])[C@@H]2C([O-])=NC(=O)[C@H]21,C34388589_decoy,TRY1,Decoy,0,-8.3115,-5.89,-2.57,-6.11147340686137
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CS)[C@@H](O)[C@@H]1O,C34920698_decoy,TRY1,Decoy,0,-8.7956,-7.16,-2.24,-7.343991113049463
CC(C)=C[C@@H]1OC(=O)/C(=C\CO[C@H]2O[C@@H](COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O,C35455146_decoy,TRY1,Decoy,0,-9.45984,-9.95,-4.64,-8.744589736204503
O=[N+]([O-])c1cccc(N[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c1,C06444699_decoy,TRY1,Decoy,0,-4.53835,-5.09,-2.13,-3.644560731596944
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645690_decoy,TRY1,Decoy,0,-5.55436,-6.39,-2.54,-5.271854614695577
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C35645739_decoy,TRY1,Decoy,0,-6.05004,-7.25,-1.55,-5.133516697543319
O=C(OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12)c1ccccc1,C33832449_decoy,TRY1,Decoy,0,-6.76593,-6.04,-2.34,-4.909092331677227
CCc1cccc(C)c1NC(=O)CS[C@@H]1NN[C@H]([C@@H]2C=C(c3ccc(F)cc3)N=N2)N1N,C38999114_decoy,TRY1,Decoy,0,-9.40442,-8.18,-1.07,-7.271706154623015
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C39937349_decoy,TRY1,Decoy,0,-5.7109,-9.09,-1.88,-7.48989389016402
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]2O)cc1,C39937358_decoy,TRY1,Decoy,0,-5.91832,-5.87,-2.45,-4.724734084098138
C/C=C/C(=O)OC[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@@H](O)[C@@H](O)[C@H]1O,C36645756_decoy,TRY1,Decoy,0,-7.83809,-8.11,-1.76,-5.826233131273866
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44021709_decoy,TRY1,Decoy,0,-4.86076,-6.52,-3.45,-4.628746959147774
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C44963936_decoy,TRY1,Decoy,0,-5.01861,-7.99,-2.83,-6.151442776243338
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)cc1,C44963942_decoy,TRY1,Decoy,0,-5.61763,-6.68,-2.3,-4.735475802285365
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C44963978_decoy,TRY1,Decoy,0,-4.96771,-8.65,-1.8,-6.859651320918134
N#Cc1c(N(CCO)CCO)nc(N)c2c(N)nc3c(c12)CC(=O)N3Cc1cccs1,C25515747_decoy,TRY1,Decoy,0,-7.88703,-7.0,-2.67,-4.939509652393036
CC(C)C[C@H](NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CC[NH+]=C(N)N1)C(=O)[O-],C15149860_decoy1,TRY1,Decoy,0,-11.3212,-7.23,,-9.902446678820938
CC(=O)NNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59879553_decoy,TRY1,Decoy,0,-9.36271,-6.12,-1.42,-6.820591265581159
CC(=O)Nc1ccc(NC(=O)/C=C(/C)NNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1,C02343192_decoy1,TRY1,Decoy,0,-8.56252,-7.38,,-6.860741309822216
C[C@H](O)[C@H](NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@H]1O)C(=O)[O-],C64020206_decoy,TRY1,Decoy,0,-6.54882,-8.23,-1.67,-8.621454852591613
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64020209_decoy,TRY1,Decoy,0,-7.43128,-7.53,-1.91,-8.046031168796283
C[C@H](O)[C@H](NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)N1C(=O)c2ccccc2N[C@@H]1O)C(=O)[O-],C64198135_decoy,TRY1,Decoy,0,-8.05536,-8.1,-1.6,-7.553123233523522
CC(C)C[C@H](NC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C=O)[C@@H]1CCNC(=[NH2+])N1)C(=O)[O-],C15149860_decoy2,TRY1,Decoy,0,-10.1443,-6.89,,-9.53826913483759
CC(=O)Nc1ccc(NC(=O)/C=C(\C)NNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1,C02343192_decoy2,TRY1,Decoy,0,-10.0071,-5.85,,-7.793624035823782
CC(C)NC(=O)C[C@@H]1c2nc(NC(=O)CC(C)(C)C)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C03841087_decoy,TRY1,Decoy,0,-10.6773,-7.54,-1.33,-7.506631769309911
CCOC(=O)[C@@](NC(=O)c1ccccc1F)(Nc1sc2c(c1C(N)=O)CCCC2)C(F)(F)F,C02050096_decoy,TRY1,Decoy,0,-9.08851,-6.35,-1.91,-7.84573619256349
COc1ccc(Cl)cc1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CC[C@@H](C(C)(C)C)C2,C08896561_decoy,TRY1,Decoy,0,-9.08685,-6.17,-2.39,-6.045022732201013
NC(=O)COc1ccc(/C=N/NC(=O)c2cc(Br)cc(Br)c2O)cc1,C09262014_decoy,TRY1,Decoy,0,-9.92146,-5.59,-2.48,-6.929768677872349
C[C@@H]1CCc2c(sc(NC(=S)NC(=O)c3ccc(-c4ccc(Cl)cc4)o3)c2C(N)=O)C1,C01839687_decoy,TRY1,Decoy,0,-10.038,-7.97,-5.0,-7.640968129744309
O[C@H](CNc1ccc(Cl)cc1)COc1ccc(OC[C@H](O)CNc2ccc(Cl)cc2)cc1,C01227972_decoy,TRY1,Decoy,0,-10.0665,-5.79,-2.44,-6.99988004100011
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)c4cccs4)nc3[C@@H](CC(=O)Nc3ccccc3)[C@]2(C)CC[C@H]1O,C03841114_decoy,TRY1,Decoy,0,-11.1584,-8.28,-1.92,-10.234438386549948
COc1ccc2c(Cl)c(C(=O)NC(=S)Nc3sc4c(c3C(N)=O)CCCC4)sc2c1,C12289711_decoy,TRY1,Decoy,0,-12.4091,-7.54,-4.96,-7.304319090278413
CCOc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccc(O)cc2O)N3)cc1,C13639895_decoy,TRY1,Decoy,0,-8.79545,-8.49,-1.46,-12.102286072164164
CCOc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@H](c2ccc(O)cc2O)N3)cc1,C13639899_decoy,TRY1,Decoy,0,-9.34131,-9.09,-3.08,-12.865448685819128
Cc1ccc(-c2ccc(C(=O)NC(=S)Nc3sc4c(c3C(N)=O)CC[C@H](C)C4)o2)cc1Cl,C14276569_decoy,TRY1,Decoy,0,-10.3977,-8.53,-3.43,-7.6091680315182835
CCOc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccc2OC)cc(Br)c1O,C01126520_decoy,TRY1,Decoy,0,-8.71159,-5.55,-2.51,-5.430566598041349
COc1cc([C@@H]2Nc3c(C(=O)Nc4ccc(Nc5ccccc5)cc4)cccc3[C@@H]3C=CC[C@H]32)ccc1O,C20693274_decoy,TRY1,Decoy,0,-11.5881,-10.35,-0.67,-9.466195482351084
COc1cc([C@@H]2Nc3c(C(=O)Nc4ccc(Nc5ccccc5)cc4)cccc3[C@H]3C=CC[C@H]32)ccc1O,C20693280_decoy,TRY1,Decoy,0,-9.99709,-6.95,-1.43,-6.149891377905263
C[C@H](Sc1nnc(Nc2cccc(Br)c2)s1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C21734852_decoy,TRY1,Decoy,0,-9.98469,-8.48,-1.72,-8.740883829937578
CCCCNC(=S)NNC(=O)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc(C(C)C)cc1)N2,C02793847_decoy,TRY1,Decoy,0,-8.98936,-6.34,-2.47,-5.529469938892077
CCOC(=O)c1sc(N)c(C#N)c1CSc1nnc(-c2ccccc2Br)n1N,C22875176_decoy,TRY1,Decoy,0,-8.79429,-5.18,-2.26,-6.345513956068354
CCOC(=O)c1c(C)oc2nc(CSc3nc(N)c4c5c(sc4n3)CCCC5)nc(N)c12,C23222777_decoy,TRY1,Decoy,0,-8.20491,-8.45,-3.58,-6.207214029408431
CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21OC(=O)c2c1ccc(N)c2N,C25783591_decoy,TRY1,Decoy,0,-7.59882,-7.51,-0.85,-6.019911105845761
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1ccccc1C)c1cccc(Cl)c1,C36481281_decoy,TRY1,Decoy,0,-8.52709,-7.65,-3.0,-8.62484095697842
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)CCC1CCCCC1)c1cccc(Cl)c1,C36481576_decoy,TRY1,Decoy,0,-8.91627,-7.23,-1.51,-6.885750206379933
CCCCNC(=O)[C@@H](c1cccc(O)c1)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484824_decoy,TRY1,Decoy,0,-7.55885,-5.83,-3.85,-5.804805256326871
CC(C)(C)NC(=O)[C@H](c1ccccc1O)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484869_decoy,TRY1,Decoy,0,-9.13217,-5.79,-1.88,-6.5986241159091135
CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1cccc(O)c1O)c1cccc(Cl)c1,C36485031_decoy,TRY1,Decoy,0,-8.99867,-6.03,-2.34,-6.165526536358883
O=C(NC1CCCCC1)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)C1CCCCC1,C36494404_decoy,TRY1,Decoy,0,-9.09698,-7.04,-1.6,-7.172781328740703
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccc(Cl)cc1,C36497364_decoy,TRY1,Decoy,0,-8.12442,-5.13,-1.35,-5.961126437182689
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccccc1Cl,C36505975_decoy,TRY1,Decoy,0,-7.27193,-6.24,-1.91,-6.074204370546016
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc(Cl)cc1)c1ccccc1Cl,C36543185_decoy,TRY1,Decoy,0,-7.26744,-5.5,-1.03,-5.945101460330036
C[C@@H]1[C@H]2C[C@@H](C[C@H]1C(=O)N([C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O)C(C)(C)C)C2(C)C,C36581406_decoy,TRY1,Decoy,0,-6.6965,-5.98,-1.9,-5.254467290420551
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)C#Cc1ccccc1)C(C)(C)C,C36586084_decoy,TRY1,Decoy,0,-6.5431,-6.62,-4.06,-5.595628731994298
C=CCN1[C@H](CC(=O)Nc2ccccc2Cl)NN[C@@H]1SCc1nc2ccccc2c(=O)[nH]1,C39969701_decoy,TRY1,Decoy,0,-8.18748,-8.15,-2.23,-7.279647236072149
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NC[C@@H]3CCCO3)CCCC4)[nH]n2)c(O)c1,C40549173_decoy,TRY1,Decoy,0,-9.19237,-9.46,-2.14,-10.027697870460475
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(NC[C@@H]2CCCO2)c1N,C40686815_decoy,TRY1,Decoy,0,-8.37144,-5.82,-2.15,-5.933029436306236
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2)oc2c1/C(=N/NC(=S)Nc1ccccc1)CCC2,C40825279_decoy,TRY1,Decoy,0,-8.61616,-8.02,-2.31,-7.442857495720843
Cc1ccc(CNc2nc(Nc3sc4c(c3C(N)=O)CCCC4)c3cnn(-c4ccccc4)c3n2)cc1,C41025986_decoy,TRY1,Decoy,0,-9.42408,-8.5,-3.19,-7.621450820841376
CC(C)NC(=O)C[C@@H]1c2nc(NC(=O)c3c(F)cccc3F)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553473_decoy,TRY1,Decoy,0,-11.4659,-7.88,-3.88,-8.909171985883473
C[C@]1(CO)[C@H]2Cc3sc(NC(=O)C4CCC4)nc3[C@@H](CC(=O)NC3CCCC3)[C@@]2(C)CC[C@H]1O,C43553520_decoy,TRY1,Decoy,0,-11.079,-6.22,-1.17,-7.0104566217882285
CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21OC(=O)c2cc(N)c(N)cc21,C43943090_decoy,TRY1,Decoy,0,-8.08751,-7.38,-1.99,-6.360943471370655
Cc1n[nH]c(O)c1[C@H](c1ccc(OC(=O)c2ccccc2Br)cc1)c1c(O)n[nH]c1C,C09109358_decoy,TRY1,Decoy,0,-7.83027,-6.51,-1.83,-5.714883378868708
Cc1n[nH]c(O)c1[C@H](c1ccc(OC(=O)c2ccc(Cl)c(Cl)c2)cc1)c1c(O)n[nH]c1C,C20103508_decoy,TRY1,Decoy,0,-9.39796,-7.38,-2.59,-6.253758375999042
Cc1n[nH]c(O)c1[C@@H](c1c(O)n[nH]c1C)c1c(OCc2ccc(Cl)cc2)ccc2ccccc12,C19823855_decoy,TRY1,Decoy,0,-6.98669,-6.27,-1.82,-5.303839685375773
CCOc1ccc(-c2n[nH]c3c2[C@@H](c2cc(Br)c(O)c(OCC)c2)C(C#N)=C(N)O3)cc1,C09282263_decoy,TRY1,Decoy,0,-7.90116,-6.38,-0.88,-5.872729759118833
CCOC(=O)C1=C(N)n2c(s/c(=C\c3ccc(Cl)cc3Cl)c2=O)=C(C(N)=O)[C@H]1c1ccc(Cl)cc1Cl,C01828170_decoy,TRY1,Decoy,0,-10.3331,-6.95,-2.66,-6.467198048647502
CC[C@@H](C)Cc1c(C)sc2[nH]c(S[C@H](C)C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)nc(=O)c12,C18580963_decoy,TRY1,Decoy,0,-9.19112,-7.3,-2.14,-6.6051271972601855
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1cccc(Cl)c1Cl)c1ccccc1,C36610527_decoy,TRY1,Decoy,0,-9.25132,-6.71,-1.17,-8.202221768007995
Cc1ccc(Nc2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)CC(=O)N3)cc1,C54202184_decoy,TRY1,Decoy,0,-7.21627,-8.33,-2.79,-5.623804902623808
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)Nc1ccc(F)c(F)c1,C59016982_decoy,TRY1,Decoy,0,-9.82696,-8.65,-3.05,-7.397047569525141
CCc1c(C)sc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@H](c2cccs2)N3)c1C(N)=O,C18194751_decoy,TRY1,Decoy,0,-8.98035,-6.46,-1.98,-8.358008032230787
CCCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C(\C)c2ccccc2O)n1,C59830497_decoy,TRY1,Decoy,0,-8.94121,-7.89,-3.68,-7.039712444878467
CC[NH+](CC)c1ccc(NC(=O)C2CCC(C/N=c3/c(O)c(O)c3=[N+]3CCCC3)CC2)c(C)c1,C36118855_decoy,TRY1,Decoy,0,-10.3166,-6.53,-1.66,-8.0959444101674
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C04545362_decoy,TRY1,Decoy,0,-7.32663,-4.56,-3.23,-4.412212300453979
CCCC(=O)c1cc(O)c(O)c(C[NH+](C)Cc2cc(Cl)cc(C)c2O)c1O,C01569520_decoy,TRY1,Decoy,0,-7.92882,-7.03,-1.92,-5.88377534428351
Nc1nc(NCCC[NH+]2CCOCC2)nc(Nc2ccc(F)cc2)c1[N+](=O)[O-],C05026093_decoy,TRY1,Decoy,0,-7.31409,-7.31,-1.86,-7.655815493371665
CC/C(=C(/CC)c1ccc(O)c(C[NH+](CCO)CCO)c1)c1ccc(O)cc1,C01594245_decoy,TRY1,Decoy,0,-9.15219,-5.56,-3.95,-5.768232506212736
NC(=O)C1CC[NH+](CC(=O)Nc2ccccc2C(=O)NCc2ccco2)CC1,C07459511_decoy,TRY1,Decoy,0,-8.52332,-6.93,-1.35,-6.374079385025546
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08791069_decoy,TRY1,Decoy,0,-8.86266,-9.59,-2.2,-9.09719539899156
NC(=O)c1ccsc1NC(=O)C[NH2+][C@@H](c1ccc(F)cc1)c1cccs1,C08922084_decoy,TRY1,Decoy,0,-9.03158,-7.58,-2.32,-8.436636599123538
COc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H]([C@H](C)O)[NH2+][C@]12C(=O)Nc1c(Cl)cccc12,C09130339_decoy,TRY1,Decoy,0,-8.12052,-7.47,-0.4,-9.133077009885074
CC[C@@H](CO)/[NH+]=C/[C@]12CC[C@H](O)C[C@]1(O)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C09167567_decoy,TRY1,Decoy,0,-8.16347,-7.42,-1.67,-6.109908744307186
C[C@@H](CCc1ccccc1)n1c(=O)[nH]c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C12887656_decoy,TRY1,Decoy,0,-8.63751,-8.51,-3.25,-6.704511852186091
C[C@@H](CCc1ccccc1)n1c(=O)[nH]c(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C12887661_decoy,TRY1,Decoy,0,-7.51399,-7.82,-1.92,-6.859209587147218
C[C@@H](c1ccccc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2ccccc21,C12901815_decoy,TRY1,Decoy,0,-9.01614,-7.89,-1.58,-9.174524549752006
CCCn1c(N)c(C(=O)C[NH+](C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c(=O)[nH]c1=O,C13138075_decoy,TRY1,Decoy,0,-8.37563,-6.62,-1.54,-6.072699049153553
CC/C(=C(\CC)c1ccc(O)c(C[NH+](CCO)CCO)c1)c1ccc(O)cc1,C01594244_decoy,TRY1,Decoy,0,-7.18283,-5.78,-3.69,-5.84159805365383
CCCNC(=O)NC(=O)C[NH+](CC(=O)Nc1c(C)cccc1C)CC(=O)Nc1c(C)cccc1C,C21324976_decoy,TRY1,Decoy,0,-8.52671,-6.08,-3.07,-7.469999102665669
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](CC(=O)NC2CC2)CC1,C22789291_decoy,TRY1,Decoy,0,-10.6367,-7.34,-1.56,-6.809545952447145
CCCCn1c(N)c(N(CC)C(=O)C[NH+]2CC=C(c3ccc(O)cc3)CC2)c(=O)[nH]c1=O,C25680154_decoy,TRY1,Decoy,0,-7.63878,-8.03,-2.63,-6.152499387214566
CCOc1ccc(NC(=O)C[NH+](C)[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1OCC,C26477104_decoy,TRY1,Decoy,0,-7.53777,-7.3,-1.83,-6.6802267503573605
OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)C[NH+]1CCCCCOCC12CC3CC(CC(C3)C1)C2,C27646856_decoy,TRY1,Decoy,0,-9.05702,-6.92,-1.8,-6.273563096069493
NS(=O)(=O)c1ccc(CC[NH2+]C[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1,C32682394_decoy,TRY1,Decoy,0,-8.18501,-7.32,-3.17,-6.314048096605611
COc1ccccc1CCNC(=O)Nc1c(C(C)(C)C)[nH+]n(C(C)(C)C)c1N,C34784824_decoy,TRY1,Decoy,0,-7.50103,-5.94,-0.8,-5.3347930936772885
C=CCNC(=O)CN1CC[NH+](Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)CC1,C22935180_decoy,TRY1,Decoy,0,-9.14058,-5.97,-1.89,-6.375377539943745
O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1C[C@@H]2[NH2+][C@@H](c3ccc4c(c3)OCO4)C[C@H](C(F)(F)F)N2N1,C39440409_decoy,TRY1,Decoy,0,-9.25658,-8.31,-1.82,-5.934798697591293
CCCCOc1ccc(Nc2ncnc(NCC[NH+]3CCCCC3)c2N)cc1,C40754714_decoy,TRY1,Decoy,0,-8.12029,-5.94,-1.67,-5.165917727046061
CCOc1ccc(Nc2ncnc(Nc3cccc4[nH+]c(C)ccc34)c2N)cc1,C40782750_decoy,TRY1,Decoy,0,-9.22927,-8.12,0.06,-18.095134392275448
[NH3+]CCCC[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(F)cc2)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C43209332_decoy,TRY1,Decoy,0,-6.9818,-7.34,-1.6,-6.730666447011185
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)NCC[NH+](C)C,C43554256_decoy,TRY1,Decoy,0,-9.43599,-7.41,-2.23,-7.302162256606524
Cc1c(C(N)=O)cc(-c2ccc(F)cc2)n1[C@@H](Cc1ccc(O)cc1)C(=O)NCC[NH+]1CCCC1,C44145176_decoy,TRY1,Decoy,0,-9.85876,-5.17,-1.54,-6.760777977916993
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])Cc4ccccc4)cnc3-c3ccc(O)cc3)cc12,C45350614_decoy,TRY1,Decoy,0,-9.51246,-8.13,-1.91,-8.792836530688644
Cc1cc(C)c(NC(=O)C[NH+](C)CC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)c(C)c1,C45606071_decoy,TRY1,Decoy,0,-7.31753,-7.55,-4.2,-7.068520542697522
COC(=O)c1oc(-c2c3c([nH+]c4sc(C(N)=O)c(N)c24)CCCCCC3)cc1C,C49066854_decoy,TRY1,Decoy,0,-7.52723,-7.56,0.29,-7.724696294135783
COc1cc2ncc3c(N)nc(-c4cncc(OC[C@H](C)[NH3+])c4)cc3c2cc1OC,C49072566_decoy,TRY1,Decoy,0,-10.8141,-7.92,-1.21,-7.107664934202454
Cc1cccnc1Nc1[nH+]cnc(NN(c2ccccc2)c2ccccc2)c1N,C40758002_decoy,TRY1,Decoy,0,-7.05201,-7.3,-1.36,-6.819637101206343
C[C@@H]([NH2+][C@H](C)c1ccc(NC(=O)NC2CC2)cc1)C(=O)Nc1ccccc1C#N,C56159830_decoy,TRY1,Decoy,0,-7.29578,-7.67,-2.97,-6.098460208187337
Cc1ccc(C(=O)NCCC[NH+](CCO)CCO)cc1/N=C1\N[C@H]2CS(=O)(=O)C[C@H]2S1,C20354822_decoy,TRY1,Decoy,0,-8.86567,-6.75,-3.7,-6.771434447843515
C[NH+](CCCNC(=O)Nc1ccccc1SCC(N)=O)Cc1ccccc1,C58156670_decoy,TRY1,Decoy,0,-7.89841,-5.88,-1.8,-5.8564321544090046
Cc1ccccc1NC(=O)c1cc2ccc(O)cc2o/c1=[NH+]\c1ccc(S(N)(=O)=O)cc1,C59170457_decoy,TRY1,Decoy,0,-8.58175,-7.96,-2.6,-6.5307618745844005
C[C@@H]1NN(C)C=C1CNC(=O)C(=O)Nc1ccccc1C(=O)NCCC1=c2ccccc2=[NH+]C1,C63281646_decoy,TRY1,Decoy,0,-8.74953,-9.21,-2.56,-8.96109249001551
CNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C66940745_decoy,TRY1,Decoy,0,-7.38318,-7.34,-3.4,-6.213455798019474
CNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)C[NH+]2CCCCCCC2)cc1,C66940746_decoy,TRY1,Decoy,0,-7.62744,-6.99,-3.61,-5.652811519178387
CC[NH+](CC)[C@H](CNC(=O)C[C@@H](NC(N)=O)c1ccccc1C)c1ccco1,C67275150_decoy,TRY1,Decoy,0,-7.49553,-6.95,-2.36,-8.279283065808116
CC(=O)NC[C@H]1CCC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C1,C67418246_decoy,TRY1,Decoy,0,-10.474,-7.28,-3.12,-8.387476730175527
CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)c1C,C67549865_decoy,TRY1,Decoy,0,-7.68176,-7.22,-1.85,-5.842001470930769
CC[NH+](CC)[C@@H](CNC(=O)C(=O)Nc1ccc(C)c(C(N)=O)c1)c1ccco1,C67557586_decoy,TRY1,Decoy,0,-8.53543,-6.65,-1.44,-6.810336705453835
CC(C)(C#N)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C04097528_decoy,TRY1,Decoy,0,-5.10734,-4.97,-3.62,-4.243860330505685
O=C(N/N=C/c1ccc(O)c(O)c1)c1nc[nH]c1C(=O)N/N=C/c1ccc(O)c(O)c1,C08384524_decoy,TRY1,Decoy,0,-9.84,-9.64,-1.51,-11.553540288241605
Nc1ncnc2c1nc(N/N=C/c1ccc([N+](=O)[O-])o1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636886_decoy,TRY1,Decoy,0,-7.28499,-7.77,-1.27,-7.869864888766118
Nc1ncnc2c1nc(N/N=C/c1ccc([N+](=O)[O-])cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C09554187_decoy,TRY1,Decoy,0,-7.38674,-8.1,-2.47,-8.133581540581648
CN(C)c1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1,C09975180_decoy,TRY1,Decoy,0,-7.22542,-7.79,-2.38,-7.407926238945357
Nc1ncnc2c1nc(N/N=C/c1ccc([N+](=O)[O-])o1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004112_decoy,TRY1,Decoy,0,-7.02264,-8.57,-1.01,-8.492981347635153
CCOc1ccccc1/C=N/Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004124_decoy,TRY1,Decoy,0,-6.88005,-7.84,-3.49,-7.860244770970911
Nc1ncnc2c1nc(N/N=C/c1ccc([N+](=O)[O-])cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004227_decoy,TRY1,Decoy,0,-7.32503,-8.12,-1.18,-6.559189685334947
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1,C12660120_decoy,TRY1,Decoy,0,-8.58186,-7.53,-2.28,-7.773517918754032
O=c1[nH]cnc2c1nc(N1CCN(C[C@H](O)CO)CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C16546184_decoy,TRY1,Decoy,0,-7.73584,-5.53,-3.21,-5.192760618270396
N#Cc1c(N(CCO)CCO)nc(N)c2c(N)nc3c(c12)CC(=O)N3C[C@H]1CCCO1,C25387184_decoy,TRY1,Decoy,0,-7.86853,-5.54,-1.59,-4.965627748323665
O=C(/C=C/c1ccc(O)cc1)c1ccc(O)cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C25692236_decoy,TRY1,Decoy,0,-7.55919,-8.38,-2.35,-7.594098715747846
OC[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C31160820_decoy,TRY1,Decoy,0,-5.16309,-7.49,-3.21,-5.979249376677161
Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@H]2OC[C@](O)(CO)[C@H]2O)occc1=O,C31163178_decoy,TRY1,Decoy,0,-6.05966,-5.07,-3.94,-4.262945607426484
COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@H]2CO)ccc1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O,C31168211_decoy,TRY1,Decoy,0,-8.54245,-6.3,-1.92,-6.173487987648972
CC(C)=CCC/C(C)=C/CO[C@@H]1O[C@H](CO[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C31169930_decoy,TRY1,Decoy,0,-7.13223,-6.68,-2.03,-5.380499706899317
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CO)[C@@H](O)[C@@H]1O,C12503982_decoy,TRY1,Decoy,0,-7.66939,-6.96,-1.52,-6.929863706731386
O=c1[nH]cnc2c1nc(N1CCN(C[C@H](O)CO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C33709098_decoy,TRY1,Decoy,0,-9.10147,-6.28,-1.44,-8.252361352306586
C[C@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C34921291_decoy,TRY1,Decoy,0,-8.01792,-8.91,-1.31,-9.000294151310841
C[C@@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C34921293_decoy,TRY1,Decoy,0,-6.91957,-9.22,-2.03,-8.155361491573094
C[C@@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C34921297_decoy,TRY1,Decoy,0,-7.6659,-7.9,-2.27,-7.575079188481574
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C35636323_decoy,TRY1,Decoy,0,-4.78077,-7.52,-1.4,-6.218275508363391
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C08740488_decoy,TRY1,Decoy,0,-7.70878,-6.99,-1.86,-7.461758700645676
C=CCOC(=O)N[C@H]1[C@@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](CO)O[C@@H]1O,C36533572_decoy,TRY1,Decoy,0,-5.18309,-4.85,-4.24,-3.951305142096331
CCOc1ccccc1/C=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636782_decoy,TRY1,Decoy,0,-7.39419,-7.31,-2.99,-7.537929487805267
COc1cc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)ccc1O,C04098629_decoy,TRY1,Decoy,0,-8.7475,-7.67,-1.68,-7.35692098446205
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CO)[C@@H](O)[C@H]1O,C38665331_decoy,TRY1,Decoy,0,-7.94285,-7.73,-2.29,-7.532181554772278
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CO)[C@@H](O)[C@H]1O,C38665332_decoy,TRY1,Decoy,0,-9.13869,-8.35,-1.38,-10.998966178062634
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CO)[C@@H](O)[C@@H]1O,C38665333_decoy,TRY1,Decoy,0,-9.37324,-6.92,-1.33,-6.748893631760587
C/C(=C\Cc1c(O)ccc2cc(O)c(=O)oc12)CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C39560191_decoy,TRY1,Decoy,0,-8.00248,-6.85,-2.92,-5.51151573846583
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C39937346_decoy,TRY1,Decoy,0,-5.62016,-7.19,-1.64,-5.186858908444957
O=C(N/N=C(\[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(O)cc1,C40151304_decoy,TRY1,Decoy,0,-8.52996,-7.7,-1.63,-8.01387965088502
COC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41302030_decoy,TRY1,Decoy,0,-8.79908,-7.2,-2.47,-8.173505089462907
Nc1ncnc2c1nc(NCCCC[NH3+])n2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1O,C42854002_decoy,TRY1,Decoy,0,-8.8695,-7.91,-2.59,-8.460083539873557
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C44019178_decoy,TRY1,Decoy,0,-5.97295,-6.94,-1.48,-6.280100680444241
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44135701_decoy,TRY1,Decoy,0,-6.00959,-7.76,-1.69,-6.846269154550433
COc1cc(O)cc(/C=C/c2ccc(O)c(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)c1,C44830194_decoy,TRY1,Decoy,0,-8.53388,-8.08,-1.75,-6.680418830200745
COc1cc(O)cc(/C=C/c2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)c1,C44830197_decoy,TRY1,Decoy,0,-8.94554,-8.11,-3.87,-7.856646452294348
C=CCOC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](CO)O[C@@H]1O,C44960128_decoy,TRY1,Decoy,0,-5.95515,-6.44,-2.45,-5.172435021478068
Nc1ccc(S[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2O)cc1,C44960172_decoy,TRY1,Decoy,0,-6.98042,-5.94,-2.34,-5.615426365153945
CC(C)[NH2+]C[C@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]2O)c2ccccc12,C44963623_decoy,TRY1,Decoy,0,-7.02763,-7.77,-3.06,-6.01971351667295
Cc1occc(=O)c1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O,C49181368_decoy,TRY1,Decoy,0,-6.25024,-6.17,-1.36,-4.680168128516794
COc1cccc(/C=N/Nc2nnc(N/N=C/c3cccc(OC)c3O)n2N)c1O,C16228141_decoy,TRY1,Decoy,0,-9.52765,-8.07,-2.21,-9.51325806621056
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NCCNS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O,C59459058_decoy,TRY1,Decoy,0,-7.6374,-8.01,-3.15,-7.994666534116804
CCOC(=O)[C@H]1NNN(c2nonc2N)[C@@H]1CS[C@@H]1[NH+]=c2ccc(OC)cc2=[NH+]1,C63503260_decoy,TRY1,Decoy,0,-8.26593,-7.62,-2.94,-7.718570222748704
O=C(CS[C@@H]1N[C@H](c2ccco2)Nc2cc(=O)[nH]n21)NCC1[NH+]=c2ccccc2=[NH+]1,C63648741_decoy,TRY1,Decoy,0,-8.98403,-7.82,-3.2,-6.218699510080416
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)C1=C([O-])NC(=O)N(CC(C)C)[C@@H]1[NH3+])[NH+]=2,C63742971_decoy,TRY1,Decoy,0,-7.919,-7.25,-1.78,-7.034686988667585
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)C1=C([O-])NC(=O)N(CC(C)C)[C@H]1[NH3+])[NH+]=2,C63742972_decoy,TRY1,Decoy,0,-7.99799,-7.31,-3.71,-7.306051421538368
C=CCOC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O,C65734159_decoy,TRY1,Decoy,0,-5.9371,-5.22,-3.97,-4.859560491876436
CC[C@@H](C)[C@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]2CSSC[C@@H](NC1=O)C(=O)N2,C03874157_decoy,TRY1,Decoy,0,-8.30386,-5.54,-2.72,-5.8312804384793
CC[C@H](C)[C@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]2CSSC[C@@H](NC1=O)C(=O)N2,C03874158_decoy,TRY1,Decoy,0,-8.46311,-5.41,-4.94,-6.007620975321158
CC[C@@H](C)[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]2CSSC[C@@H](NC1=O)C(=O)N2,C03874159_decoy,TRY1,Decoy,0,-8.10212,-4.69,-3.5,-5.035803904376373
Oc1ccc2c3c1O[C@H]1c4[nH]c5c(c4C[C@@]4(O)[C@@H](C2)[NH+](CC2CC2)CC[C@]314)C[C@@]1(O)[C@H]2Cc3ccc(O)c4c3[C@@]1(CC[NH+]2CC1CC1)[C@H]5O4,C03995590_decoy,TRY1,Decoy,0,-10.5534,-8.38,-1.57,-8.160814235415888
CO[C@H]1[C@@H](O)[C@@H](O[C@H]2[C@@H](Oc3cccc4c(O)c5c(=O)oc6ccc(C)c7c(=O)oc(c34)c5c67)O[C@@H](C)[C@@H](O)[C@H]2O)O[C@@H](C)[C@H]1O,C04293352_decoy,TRY1,Decoy,0,-4.92197,-8.05,-3.42,-4.602364419046942
COc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](O[C@@H]1O[C@@H](C)[C@H](O)[C@H](O)[C@@H]1OC)C[C@](C)(O)C3,C04293357_decoy,TRY1,Decoy,0,-8.27796,-7.18,-3.64,-6.071302529963464
COc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](O[C@@H]1O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]1OC)C[C@](C)(O)C3,C04293359_decoy,TRY1,Decoy,0,-6.83929,-8.58,-2.06,-5.439705331429238
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C04349409_decoy,TRY1,Decoy,0,-7.23613,-9.27,-3.6,-6.194742196283638
O=C1NC(=S)NC(=O)C1=CNc1ccc(Oc2ccc(NC=C3C(=O)NC(=S)NC3=O)cc2)cc1,C03067017_decoy,TRY1,Decoy,0,-8.89807,-8.97,-2.82,-6.8564943698083045
Nc1ccc(O)c(-c2nc3cc(S(=O)(=O)c4ccc5oc(-c6cc(N)ccc6O)nc5c4)ccc3o2)c1,C03144454_decoy,TRY1,Decoy,0,-10.3518,-10.15,-2.06,-7.813589236520554
CCOc1ccc([C@@H](C(=O)NC(C)(C)CC)N(Cc2cccs2)C(=O)c2snc(C(N)=O)c2N)cc1,C06462243_decoy,TRY1,Decoy,0,-9.3259,-7.23,-5.01,-9.79240204853422
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C08143604_decoy,TRY1,Decoy,0,-7.0598,-7.62,-3.1,-5.490673111272178
C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08214530_decoy,TRY1,Decoy,0,-8.39578,-8.38,-1.84,-5.4797846717269625
C[C@@H]1O[C@@H](O[C@H]2[C@@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C08214752_decoy,TRY1,Decoy,0,-7.38119,-7.4,-1.78,-5.246769713364533
C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C08681816_decoy,TRY1,Decoy,0,-8.27966,-6.52,-1.87,-5.275018849701996
C[NH+](C)[C@H]1C(O)=C(C(=O)NC[NH+]2CCCC2)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@H]12,C11616329_decoy,TRY1,Decoy,0,-9.71174,-8.46,-3.69,-6.539737113832199
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C06442790_decoy,TRY1,Decoy,0,-8.03777,-6.4,-1.76,-7.396845322603951
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12706150_decoy,TRY1,Decoy,0,-7.98513,-7.29,-2.74,-8.0431477425752
NC(=O)c1nsc(C(=O)N(Cc2cccs2)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(F)cc2)c1N,C12716020_decoy,TRY1,Decoy,0,-10.1481,-6.74,-1.4,-9.434420702307202
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C14727305_decoy,TRY1,Decoy,0,-8.59366,-8.55,-2.74,-8.106536534528045
C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C15449999_decoy,TRY1,Decoy,0,-8.12358,-7.37,-2.1,-5.350862237537927
C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O,C15450001_decoy,TRY1,Decoy,0,-9.64666,-7.17,-2.63,-6.02798899346126
C[NH+](C)[C@@H]1C(=O)C(C(=O)NC[NH+]2CCCC2)=C(O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@H]12,C08674216_decoy,TRY1,Decoy,0,-9.90901,-8.6,-3.1,-7.212602954895656
C[NH+](C)[C@@H]1C(=O)C(C(=O)NC[NH+]2CCCC2)=C(O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@H]12,C08674218_decoy,TRY1,Decoy,0,-10.6174,-10.05,-2.06,-8.402807587576245
Nc1cc(N)cc(-c2nc3cc(S(=O)(=O)c4ccc5oc(-c6cc(N)cc(N)c6)nc5c4)ccc3o2)c1,C20494168_decoy,TRY1,Decoy,0,-9.41773,-11.67,-3.06,-8.329301224917591
[H]/N=C1\O[C@H](c2ccc3c(c2)OCO3)C(=N\NC(=O)c2ccccc2O)/C1=N/NC(=O)c1ccccc1O,C25574585_decoy,TRY1,Decoy,0,-8.96833,-10.53,-3.45,-8.499806898632274
Cc1cccn2c(=O)c(/C=N/c3ccc(S(N)(=O)=O)cc3)c(Nc3ccc(S(N)(=O)=O)cc3)nc12,C25583508_decoy,TRY1,Decoy,0,-10.1482,-7.2,-4.12,-6.358476996674119
CC[C@@H](C)[C@@H]1NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@H](C(C)C)NC(=O)[C@H]2CSSC[C@@H](NC1=O)C(=O)N2,C31158263_decoy,TRY1,Decoy,0,-7.3597,-5.68,-3.37,-5.582211346670269
CC(C)=CCc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc2c(c1O)C(=O)[C@@H](O)[C@@H](c1ccc(O)cc1)O2,C31166800_decoy,TRY1,Decoy,0,-8.81536,-6.3,-2.22,-5.753769152269601
CC(C)C[C@H]1NC(=O)[C@@H](CC(C)C)N[C@@H]2CSSC[C@H](NC2=O)C(=O)NC(=O)[C@@H](C(C)C)NC1=O,C35271012_decoy,TRY1,Decoy,0,-6.53817,-5.58,-2.71,-4.584904589200206
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484848_decoy,TRY1,Decoy,0,-8.6269,-5.3,-2.53,-5.8314265246181245
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1cccc(Cl)c1,C36484849_decoy,TRY1,Decoy,0,-8.8301,-6.55,-2.12,-6.638037212255276
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1cccc(Cl)c1,C36485053_decoy,TRY1,Decoy,0,-9.34922,-6.29,-1.19,-8.230149063564433
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1c(O)cccc1O)c1ccccc1Cl,C36545176_decoy,TRY1,Decoy,0,-7.25099,-5.99,-3.16,-5.7738188772828
NS(=O)(=O)c1ccc(NC2=C[C@@H](c3ccc(F)cc3)N(c3ccc(S(N)(=O)=O)cc3)C2=O)cc1,C02214882_decoy,TRY1,Decoy,0,-11.5455,-7.1,-3.91,-6.942031874081697
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(C)(C)N(CC(O)CN1C(=O)C3(CC(C)(C)[NH2+]C(C)(C)C3)OC1(C)C)C2=O,C38642595_decoy,TRY1,Decoy,0,-8.65203,-7.36,-1.54,-5.792889913195252
CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc1scc(-c2ccc(C)cc2)c1C(N)=O,C40174602_decoy,TRY1,Decoy,0,-7.06915,-7.04,-2.64,-6.846845204712138
CC(=O)OC[C@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@H]1O,C43465459_decoy,TRY1,Decoy,0,-8.07217,-8.91,-2.11,-10.011061586052222
C=CCOC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@]1(C)[C@@H]2CC(=O)N[C@@H](CO)CC(C)C,C43554265_decoy,TRY1,Decoy,0,-10.9995,-5.7,-3.47,-7.519839994862333
O=c1ccc2ccc(O)c(-c3c(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)c(O)cc4ccc(=O)oc34)c2o1,C49181861_decoy,TRY1,Decoy,0,-6.74449,-6.65,-3.47,-4.834108676890192
O=c1ccc2ccc(O)c(-c3c(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)c(O)cc4ccc(=O)oc34)c2o1,C49181864_decoy,TRY1,Decoy,0,-6.6222,-6.93,-2.31,-4.885050573134777
O=c1ccc2ccc(O)c(-c3c(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c(O)cc4ccc(=O)oc34)c2o1,C49181866_decoy,TRY1,Decoy,0,-6.36348,-7.0,-4.36,-4.945133444939686
O=c1ccc2ccc(O)c(-c3c(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)c(O)cc4ccc(=O)oc34)c2o1,C49181869_decoy,TRY1,Decoy,0,-6.48818,-6.06,-1.77,-4.821663227612171
NC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(N[C@@H]3Cc3ccc(O)cc3)C(=O)Nc3ccc(F)cc32)cc1,C16009949_decoy,TRY1,Decoy,0,-9.70476,-6.84,-1.55,-6.273803292430999
NC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccc(O)cc4)N[C@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C16009950_decoy,TRY1,Decoy,0,-8.40038,-8.59,-0.92,-8.499685558043765
NC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3Cc3ccc(O)cc3)C(=O)Nc3ccc(F)cc32)cc1,C13814589_decoy,TRY1,Decoy,0,-7.94718,-7.1,-4.49,-5.823570234249488
NC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccc(O)cc4)N[C@@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C13814593_decoy,TRY1,Decoy,0,-8.02625,-6.68,-3.45,-5.4842415390859545
Nc1ccc(O)c(-c2nc3ccc(S(=O)(=O)c4ccc5nc(-c6cc(N)ccc6O)oc5c4)cc3o2)c1,C59502854_decoy,TRY1,Decoy,0,-9.61006,-7.41,-2.17,-6.759805094159651
NC1=[NH+]C(=S)N=C([O-])[C@@H]1C(c1cn(-c2ccccc2)nc1-c1ccccc1)[C@H]1C([O-])=NC(=S)[NH+]=C1N,C63598725_decoy,TRY1,Decoy,0,-7.08153,-6.65,-0.18,-5.537206764264851
C[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,C04349475_decoy,TRY1,Decoy,0,-7.14948,-9.86,-2.03,-7.699949837493836
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O,C04349627_decoy,TRY1,Decoy,0,-8.36345,-6.47,-3.41,-5.680363758537134
C[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc23)[C@H](O)[C@@H](O)[C@@H]1O,C04349750_decoy,TRY1,Decoy,0,-7.0974,-8.87,-4.02,-7.26106662818253
Nc1nc(SCc2ccc(Br)cc2)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04722777_decoy,TRY1,Decoy,0,-8.31062,-5.49,-2.15,-5.866380964325309
Nc1nc(SCc2cccc(Br)c2)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04722783_decoy,TRY1,Decoy,0,-8.68516,-7.56,-4.08,-6.173734711963114
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCOC)c2ccc(F)cc2)cc1,C06601042_decoy,TRY1,Decoy,0,-7.59143,-5.84,-2.88,-5.716250356284736
C/C(=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)c1ccc(Br)cc1,C09975183_decoy,TRY1,Decoy,0,-7.2597,-6.67,-2.18,-6.915792785973478
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O,C12153095_decoy,TRY1,Decoy,0,-8.422,-8.41,-1.52,-8.403809128381397
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(OC)ccc1OC,C12467529_decoy,TRY1,Decoy,0,-8.27679,-5.19,-1.34,-6.070331955376872
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C12467591_decoy,TRY1,Decoy,0,-8.08531,-7.25,-3.22,-9.536209327971337
OC[C@@H]1O[C@@H](Oc2ccc(-c3n[nH]cc3-c3ccc4c(c3)OCCO4)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C12655653_decoy,TRY1,Decoy,0,-8.49541,-7.0,-2.45,-6.943167066201185
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(C)c2C)cc1,C12706144_decoy,TRY1,Decoy,0,-8.3177,-8.88,-0.89,-9.310017013961644
NC(=O)c1nsc(C(=O)N(C2CCCC2)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1N,C12715958_decoy,TRY1,Decoy,0,-8.24116,-7.71,-2.44,-8.015431461837027
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C13424744_decoy,TRY1,Decoy,0,-9.9997,-8.74,-4.45,-8.574030122032516
NS(=O)(=O)c1ccc(NC2=C[C@H](c3ccc(Cl)cc3)N(c3ccc(S(N)(=O)=O)cc3)C2=O)cc1,C09466076_decoy,TRY1,Decoy,0,-11.9451,-6.11,-1.25,-7.815549638127683
COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)c(-c3ccc(O)c(O)c3)oc2c1,C14760383_decoy,TRY1,Decoy,0,-7.63525,-8.56,-3.2,-9.629673716863502
CCCCC[C@H](O)[C@H]1C(=O)O[C@H](C)[C@H](O)/C=C/C=CC=CC=C/C=C(\C)[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@@H]1O,C15449267_decoy,TRY1,Decoy,0,-10.4256,-6.65,-2.84,-6.639673817280292
O=C(Nc1ccccc1)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCN(c4cccc[nH+]4)CC3)[NH+]2C1,C15708161_decoy,TRY1,Decoy,0,-7.96953,-6.06,-1.09,-5.661929069806567
Nc1nc2c(nc(N/N=C/c3ccc(Cl)cc3Cl)n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16384865_decoy,TRY1,Decoy,0,-9.03458,-9.19,-1.37,-9.051565393655569
COc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccc(Cl)cc3Cl)n2N)n1,C16617932_decoy,TRY1,Decoy,0,-8.27271,-8.68,-1.77,-7.283713903859621
Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]3O)ccc12,C22063942_decoy,TRY1,Decoy,0,-8.11272,-6.41,-2.75,-5.761366425072823
CCc1ccccc1Nc1nc(N)nc(CSc2[nH+]c3ccccc3c(=O)n2-c2ccc(C)c[nH+]2)n1,C22468849_decoy,TRY1,Decoy,0,-9.1661,-9.77,-3.86,-7.801870518103696
N#Cc1c(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)nc(N)c2c(N)nc(SCC(=O)[O-])cc12,C23486805_decoy,TRY1,Decoy,0,-7.07031,-7.48,-3.5,-4.888358141062889
C[C@H]1O[C@@H](O[C@H]2[C@@H](Oc3ccc4ccc(=O)oc4c3)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O,C35271478_decoy,TRY1,Decoy,0,-7.30839,-6.7,-1.78,-5.455351529205326
COc1ccc2nc(/C=N/Nc3nc4c(N)ncnc4n3[C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)ccc2c1,C33957536_decoy,TRY1,Decoy,0,-8.68531,-9.31,-2.18,-7.555291572197701
CC(C)=CCc1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc2c(c1O)C(=O)[C@@H](O)[C@@H](c1ccc(O)cc1)O2,C35464240_decoy,TRY1,Decoy,0,-8.9599,-6.51,-2.64,-6.0980297863663
COc1cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc2c1C(=O)[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O2,C35466127_decoy,TRY1,Decoy,0,-8.77093,-6.41,-1.13,-5.590314014719289
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O[C@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]3O)ccc12,C35645388_decoy,TRY1,Decoy,0,-4.24498,-6.59,-2.04,-4.019537734195301
Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O[C@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@@H]3O)ccc12,C35645443_decoy,TRY1,Decoy,0,-5.93993,-5.52,-2.41,-4.007726994807848
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1cccc(Cl)c1,C36485052_decoy,TRY1,Decoy,0,-7.69106,-5.97,-3.61,-5.980771892718904
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccccc3Br)n2N)n1,C36806329_decoy,TRY1,Decoy,0,-8.62889,-6.44,-2.19,-6.314639932081532
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]2CO)[C@H]2[C@@H]1C=C[C@@]21C=C([C@H](C)O)C(=O)O1,C35459171_decoy,TRY1,Decoy,0,-7.96236,-6.48,-3.4,-6.48145574845967
CC1(C)O[C@@]2(C)CC[C@@H]1C[C@H]2O[C@H]1O[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H](O)[C@H]1O,C36374497_decoy,TRY1,Decoy,0,-7.46755,-7.57,-1.81,-5.764521892876296
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674876_decoy,TRY1,Decoy,0,-8.77409,-7.88,-2.96,-7.857260991997741
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674878_decoy,TRY1,Decoy,0,-9.0763,-7.23,-2.84,-6.8356332437507685
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)Nc2nc(N3CCC(C(N)=O)CC3)[nH]c(=O)c21,C40375708_decoy,TRY1,Decoy,0,-8.52755,-6.83,-1.63,-6.490987708118905
Cc1ccc2nc(Nc3ncnc(NNC(=O)COc4ccc(Cl)cc4Cl)c3N)sc2c1,C40783585_decoy,TRY1,Decoy,0,-9.40767,-8.0,-3.5,-6.221315373983721
COc1cc(OC)c(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)cc1Cl,C40793457_decoy,TRY1,Decoy,0,-10.2348,-6.66,-3.48,-6.628222131688741
CC(=O)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@@H](O)[C@H]1O,C43080071_decoy,TRY1,Decoy,0,-8.60994,-8.95,-4.58,-7.865623702515785
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)ccc1O,C43465439_decoy,TRY1,Decoy,0,-8.459,-9.37,-1.98,-8.635053085378866
COc1c2c(cc3oc(CO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc(=O)c13)O[C@H](C(C)(C)O)C2,C44170734_decoy,TRY1,Decoy,0,-8.51036,-6.7,-2.04,-5.220255490535339
OC[C@@H]1O[C@@H](Oc2ccc(-c3n[nH]cc3-c3ccc4c(c3)OCCO4)c(O)c2)[C@H](O)[C@H](O)[C@@H]1O,C08740086_decoy,TRY1,Decoy,0,-7.99301,-6.49,-2.66,-6.202091889226889
Cc1c(Cl)ccc2c1NC(=O)[C@]21N[C@H](CCC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C15958850_decoy,TRY1,Decoy,0,-8.34702,-8.98,-1.91,-9.094269624450469
N#CC1=C(N)Oc2[nH]nc(-c3ccc4ccccc4c3)c2[C@@H]1c1cn(CC(N)=O)nc1-c1ccccc1,C01113147_decoy,TRY1,Decoy,0,-6.81313,-5.44,-0.97,-4.889669154301154
C[C@H](Sc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1)C(=O)NNC(=O)C1CCC1,C59879545_decoy,TRY1,Decoy,0,-9.37749,-8.26,-1.6,-9.940663632666633
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C1\C(=O)Nc3ccc(Br)cc31)n2C[C@@H](O)CO,C08934151_decoy,TRY1,Decoy,0,-9.36076,-6.3,-2.11,-5.819370476873838
CC1(C)CC(NC(=O)CCNC(=O)N2CCN(C(=O)[C@@H]3C=c4ccccc4=[NH+]3)CC2)CC(C)(C)[NH2+]1,C63271964_decoy,TRY1,Decoy,0,-7.22283,-6.24,-2.05,-5.822963996848212
O=C(NCCC1=c2ccccc2=[NH+]C1)C1=NNS[C@@H]1NC(=O)N1CCN(c2cccc[nH+]2)CC1,C63980151_decoy,TRY1,Decoy,0,-9.73312,-9.55,-1.26,-8.25726462116481
Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@@H](C)[C@@H](O)[C@H](O)[C@H]3O)ccc12,C65747677_decoy,TRY1,Decoy,0,-7.09104,-7.23,-1.9,-5.385048346384294
COc1cc2cc(CCC[NH3+])c(=O)[nH]c2cc1Cl,C11980742_decoy,TRY1,Decoy,0,-7.70895,-6.78,-1.66,-7.759898647549853
CCc1nc(NCC[NH3+])c2c3c(sc2n1)CCCC3,C13998649_decoy,TRY1,Decoy,0,-7.60124,-4.81,-0.5,-4.4024497028829535
Cc1c(N)cccc1NC(=O)CC[NH+]1CCSCC1,C20256869_decoy,TRY1,Decoy,0,-6.59537,-6.5,-1.17,-7.142810001437265
Cc1nc(NCCC[NH3+])c2c3c(sc2n1)CCCC3,C20323797_decoy,TRY1,Decoy,0,-7.49696,-5.9,0.1,-6.532486718689755
NC(=[NH2+])SCc1cc(Cl)cc2c1OCOC2,C07715628_decoy,TRY1,Decoy,0,-7.69355,-5.46,-0.53,-8.808363280075028
[NH3+][C@H](c1ccoc1)c1cc2c(cc1Cl)NC(=O)C2,C35081868_decoy,TRY1,Decoy,0,-6.34532,-5.25,-0.58,-4.4291345162907145
C[NH+]1CCC(Nc2ccc3cc(N)ccc3n2)CC1,C35343700_decoy,TRY1,Decoy,0,-6.62845,-7.56,-0.81,-8.070808666374631
[NH3+][C@@H](c1ccncc1)c1cc2c(cc1Cl)NC(=O)C2,C35359532_decoy,TRY1,Decoy,0,-6.81656,-4.93,-0.76,-3.925899955782997
Nc1cc(C[NH+]2CCC[C@@H]2c2ccncc2)ccc1O,C36127615_decoy,TRY1,Decoy,0,-6.61501,-4.53,0.17,-3.6227260939058414
[NH3+][C@@H]1C[C@H]1NS(=O)(=O)c1cc(Cl)cc(Cl)c1,C36264026_decoy,TRY1,Decoy,0,-9.06476,-6.3,-1.87,-10.424917009779822
Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2[NH3+])c(Cl)c1,C36264189_decoy,TRY1,Decoy,0,-9.50071,-6.45,-0.73,-10.82063057403317
CCCn1cc(Br)cc1C(=O)N[C@@H]1C[C@H]1[NH3+],C36857169_decoy,TRY1,Decoy,0,-7.75406,-5.31,-2.18,-7.125754885598933
CC[C@H]([NH2+][C@@H]1CCCCNC1=O)c1ccccc1O,C36976945_decoy,TRY1,Decoy,0,-5.73629,-6.51,-1.71,-4.563112455619698
Cc1cc(Cl)c(NC(=O)[C@H](C)[NH3+])c2cccnc12,C37008087_decoy,TRY1,Decoy,0,-8.30926,-5.73,-0.6,-4.6546130325152015
CC(C)N1CCC([NH2+]C2CCC(C(N)=O)CC2)CC1,C37152221_decoy,TRY1,Decoy,0,-7.27645,-4.81,-2.72,-4.805064627056165
Cc1cc([C@@H](C)[NH2+]C2CCC(C(N)=O)CC2)c(C)o1,C37152798_decoy,TRY1,Decoy,0,-6.8478,-6.74,-3.2,-6.552458339456817
C[NH+]1CCC(NC(=O)c2ccc(N)cc2Cl)CC1,C37266942_decoy,TRY1,Decoy,0,-7.01889,-7.29,-1.34,-8.516254796059679
N#Cc1ccc(C[NH2+]Cc2ccc(O)c(O)c2)cc1,C37505743_decoy,TRY1,Decoy,0,-7.33573,-5.61,-3.16,-5.850183564730841
Cc1ccc(C(=O)Nc2ncc(C#CC[NH3+])s2)s1,C37550750_decoy,TRY1,Decoy,0,-10.153,-6.86,-4.38,-6.774953333690486
C[NH+]1CCC(NC(=O)c2cc(N)c(F)cc2F)CC1,C40303152_decoy,TRY1,Decoy,0,-6.59589,-5.1,-1.05,-3.5681778402789104
Cc1cc(C)c(C(N)=[NH2+])c(N2CCc3sccc3C2)n1,C40515044_decoy,TRY1,Decoy,0,-7.45644,-5.93,-1.12,-4.415998953077708
Cc1nc(C)c([C@@H](C)NC(=O)[C@](C)([NH3+])C2CC2)s1,C40519118_decoy,TRY1,Decoy,0,-8.91593,-4.29,-2.07,-5.171789967776577
COc1ccc2c(c1)[C@](O)(C[NH3+])CC1(CCCC1)O2,C41356598_decoy,TRY1,Decoy,0,-6.88129,-5.35,-1.14,-4.201657350862502
O=C1Nc2cc(F)cc(F)c2[C@@H]1[NH2+]C1CCC(O)CC1,C42134477_decoy,TRY1,Decoy,0,-7.10629,-6.04,-0.77,-4.006219683571855
[NH3+]C[C@H](Sc1ncn[nH]1)c1ccc(Cl)cc1,C42950058_decoy,TRY1,Decoy,0,-7.82772,-6.23,-1.95,-7.383941695537103
Cc1cc(C[NH2+][C@]2(C)CCS(=O)(=O)C2)ccc1N,C44933677_decoy,TRY1,Decoy,0,-7.03789,-6.33,-1.5,-6.196430805477815
C[C@H](Cn1cc[nH+]c1)Nc1c(F)cc(N)cc1F,C49234815_decoy,TRY1,Decoy,0,-7.22106,-6.79,-0.06,-8.52959750806698
Cc1[nH]ncc1CCC[NH+]1Cc2cccc(N)c2C1,C50183045_decoy,TRY1,Decoy,0,-6.3915,-7.0,-1.15,-6.00192796809196
N#Cc1ccc(NC(=O)[C@H]2C[C@H]2[NH3+])c(C(F)(F)F)c1,C50460860_decoy,TRY1,Decoy,0,-6.97465,-5.92,-2.53,-8.735218226557794
NNc1nc2ccccc2cc1C[NH+]1CCSCC1,C51146495_decoy,TRY1,Decoy,0,-6.85991,-6.79,-0.31,-8.644098121283811
C[C@H]([NH2+][C@@H]1C[C@H]1C)c1ccc(S(N)(=O)=O)cc1,C52273540_decoy,TRY1,Decoy,0,-8.31381,-6.15,-0.18,-5.673798568339735
CC1CCC2(CC1)CSC(N[C@@H](C)C(N)=O)=[NH+]2,C53099994_decoy,TRY1,Decoy,0,-7.07409,-6.68,-0.4,-7.475296051805281
Cc1n[nH]c(C)c1C[NH2+][C@@]1(CO)CCC[C@@H](C)C1,C53116408_decoy,TRY1,Decoy,0,-6.76688,-6.53,-0.76,-8.790287752715063
Nc1cc(Br)cnc1NCC[NH+]1CCCC1,C54112142_decoy,TRY1,Decoy,0,-7.52302,-5.43,-0.22,-8.977547475155593
C[C@@H]1[C@@H](C(=O)N(CCO)C2CCCCC2)CCC[C@@H]1[NH3+],C55133321_decoy,TRY1,Decoy,0,-7.99105,-5.49,-1.99,-5.227078559096259
Cc1sc2[nH]c(SCC[NH3+])nc(=O)c2c1C,C57832278_decoy,TRY1,Decoy,0,-9.21274,-6.31,-0.39,-7.477984341041979
[NH3+]CCc1cc(=O)[nH]c(Cc2ccc(Cl)cc2)n1,C58055857_decoy,TRY1,Decoy,0,-7.93676,-6.48,-0.77,-4.979814744317591
COc1cccc([C@H](C[NH3+])N2C[C@H](C)C[C@H](C)C2)c1O,C32054645_decoy,TRY1,Decoy,0,-7.02671,-4.81,-4.0,-4.184186443927978
CCOc1cc(CN2CCC([NH3+])CC2)cc(Cl)c1O,C32050756_decoy,TRY1,Decoy,0,-8.10243,-5.29,-2.15,-4.824356131924263
NC(=S)c1c[nH+]c2ccccc2c1N1CC[C@H](O)C1,C61712585_decoy,TRY1,Decoy,0,-7.73375,-5.74,-0.37,-4.456954644093221
NC(=O)[C@@]1(NC2CCCCCC2)CC[NH+](C2CC2)C1,C61991106_decoy,TRY1,Decoy,0,-7.1164,-4.89,-0.59,-4.813888137477357
CC(C)(C)N1C(=O)C[C@H]([NH3+])[C@H]1c1c[nH]c2ccccc12,C62210211_decoy,TRY1,Decoy,0,-5.81308,-5.57,-1.66,-3.7746890134771
CCCN1C(=O)CC[C@@H]([NH3+])[C@H]1c1c[nH]c2ccccc12,C62212236_decoy,TRY1,Decoy,0,-8.38172,-4.9,-1.34,-4.95539740161504
CCc1cc(Br)cc2c1O[C@@H](C[NH3+])C(=O)N2,C62559076_decoy,TRY1,Decoy,0,-8.5519,-7.11,-1.56,-10.232072262956574
Cc1cc(F)ccc1NC(=O)[C@H]1C[NH2+][C@@H](C)CN1,C62814076_decoy,TRY1,Decoy,0,-6.52632,-5.35,-0.98,-5.146261536642882
Cc1ccc(F)c(NC(=O)[C@@H]2C[NH2+][C@H](C)CN2)c1,C62814312_decoy,TRY1,Decoy,0,-6.46871,-4.9,-0.76,-4.178205772869745
Cc1ccc(F)c(NC(=O)[C@@H]2C[NH2+][C@@H](C)CN2)c1,C62814314_decoy,TRY1,Decoy,0,-6.91963,-5.4,-0.05,-4.469283815169499
CCCn1cc(Cl)cc1C(=O)N[C@H]1CCC[C@@H]1[NH3+],C63172018_decoy,TRY1,Decoy,0,-7.76967,-5.72,-1.42,-6.953993870921121
C[C@H]([NH3+])[C@H]1CCCCN1[C@H]1C(=O)Nc2cc(F)ccc21,C63191334_decoy,TRY1,Decoy,0,-6.63292,-5.93,-2.44,-4.415524008152238
Cc1ccc2c(c1)[C@@H](N1CCCC[C@@H]1[C@@H](C)[NH3+])C(=O)N2,C63191732_decoy,TRY1,Decoy,0,-7.15716,-4.46,-1.8,-3.980053204092719
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C03995925_decoy,TRY1,Decoy,0,-10.1192,-8.71,-2.6,-6.950556893088442
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1,C03995927_decoy,TRY1,Decoy,0,-7.78848,-8.78,-1.76,-6.698851431552194
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1,C03995929_decoy,TRY1,Decoy,0,-7.88774,-8.98,-5.27,-2.1450231861502465
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@H](C)O1,C03995931_decoy,TRY1,Decoy,0,-10.0816,-9.34,-2.36,-8.283055156387034
NC(=O)CC[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12,C04083956_decoy,TRY1,Decoy,0,-8.19482,-7.97,-0.94,-8.716279755622207
COc1cc2c(cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O)CC[NH+]1CC=C3C=C[C@H](OC)C[C@@]321,C01041984_decoy,TRY1,Decoy,0,-6.75007,-6.65,-1.71,-5.028630952708603
COC1=Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O,C05395628_decoy,TRY1,Decoy,0,-9.90216,-6.98,-1.3,-6.569147896936233
CCC[C@H]1C[C@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C08551996_decoy,TRY1,Decoy,0,-6.26566,-5.31,-3.06,-4.6960398492935305
O=C1[C@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@H]2C(=O)N1C[C@H]1CCCO1,C08876675_decoy,TRY1,Decoy,0,-8.7334,-7.0,-1.22,-6.675554682491539
CC(C)(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)(C)C)C1CCCCC1,C09114381_decoy,TRY1,Decoy,0,-9.81839,-6.4,-1.13,-7.529477841845199
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OCc1ccccc1F,C09194416_decoy,TRY1,Decoy,0,-7.71911,-7.68,-3.37,-6.718533088346059
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](CC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C09353784_decoy,TRY1,Decoy,0,-7.32195,-7.73,-3.42,-6.23441550072109
CCOc1ccc(Nc2nc(NCCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])cc1,C09313162_decoy,TRY1,Decoy,0,-6.64255,-6.59,-2.11,-8.644285221059528
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@H]3O[C@@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C11592927_decoy,TRY1,Decoy,0,-6.02045,-7.96,-3.42,-5.097261547982578
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C11592929_decoy,TRY1,Decoy,0,-7.85945,-7.93,-3.05,-5.489862179133128
Cc1cc(C)cc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NCC[NH+](C)C)[C@H]32)c1,C08636327_decoy,TRY1,Decoy,0,-8.18323,-5.4,-4.02,-5.67254800461306
C[NH+](C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc(-n4cccn4)cc3)S[C@@H]21,C08636329_decoy,TRY1,Decoy,0,-9.25014,-4.93,-1.34,-5.686778694855847
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCc3ccco3)C[NH+]12)NCc1cccs1,C15708019_decoy,TRY1,Decoy,0,-9.99827,-7.34,-1.3,-7.26671194667129
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1c(O)nc(O)n(-c2ccccc2OC)c1=O,C09014039_decoy,TRY1,Decoy,0,-7.43251,-7.84,-3.82,-6.732031065416406
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H]([NH3+])[C@H](O)[C@H](C)O1,C03917708_decoy,TRY1,Decoy,0,-7.24613,-8.1,-1.49,-5.458159866273538
C[C@]12CN3C[C@](c4ccccc4)(C[NH+](C1)[C@@H]3[C@](C)(O)[C@](C)(O)[C@](C)(O)CO)C2=O,C19327369_decoy,TRY1,Decoy,0,-6.6086,-5.23,-2.69,-5.034229892703809
NC(=O)COc1ccc(Cl)cc1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1Cl,C20873354_decoy,TRY1,Decoy,0,-9.82235,-6.66,-2.64,-6.611595918700891
COc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(c3ccc(O)cc3)CC2)n1,C21670723_decoy,TRY1,Decoy,0,-7.97282,-7.89,-2.73,-6.654040472599352
NC(=O)CSc1nc(N2CC[NH+](CC(N)=O)CC2)c2c3c(sc2n1)CCC3,C34757684_decoy,TRY1,Decoy,0,-9.35811,-5.64,-2.29,-5.360964565732795
COc1ccccc1[C@H](CNc1nc(N)c([N+](=O)[O-])c(NC[C@H]2CCCO2)n1)[NH+](C)C,C35681910_decoy,TRY1,Decoy,0,-7.48856,-5.89,-2.16,-6.518581134704373
NC(=O)C1CC[NH+](CCOC2=CC(=O)/C(=C3/NNC=C3c3ccccc3)C=C2)CC1,C32540717_decoy,TRY1,Decoy,0,-9.50573,-7.04,-3.84,-5.577565446884429
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C03830631_decoy,TRY1,Decoy,0,-8.28466,-8.04,-3.26,-5.771183212971918
COc1cccc2c1C(=O)[C@H]1C(O)=C3C(=C(O)[C@H]1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C38337252_decoy,TRY1,Decoy,0,-7.39286,-6.71,-3.53,-5.235992603953728
COc1cccc2c1C(=O)[C@H]1C(O)=C3C(=C(O)[C@H]1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1,C38337253_decoy,TRY1,Decoy,0,-8.92821,-6.71,-4.66,-5.635850441812223
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C38609328_decoy,TRY1,Decoy,0,-7.61847,-5.59,-2.76,-5.36376316291063
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661700_decoy,TRY1,Decoy,0,-9.9667,-8.41,-2.6,-9.0066479894979
C[NH+]1CCN(c2ncnc(NNC(=O)c3ccccc3Br)c2N)CC1,C40726345_decoy,TRY1,Decoy,0,-7.34036,-6.95,-1.77,-6.406593805331209
CC[NH+]1CCN(c2ncnc(NNC(=O)c3ccc(Br)cc3)c2N)CC1,C40726713_decoy,TRY1,Decoy,0,-8.91322,-7.02,-1.98,-6.311513367156316
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2N)CC(C)(C)[NH2+]1,C40760802_decoy,TRY1,Decoy,0,-8.66427,-5.69,-1.82,-5.92318101621337
CN(c1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N)C1CC[NH+](C)CC1,C40793493_decoy,TRY1,Decoy,0,-9.26153,-6.97,-2.56,-6.0131682547905605
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCC4)n2)CC1,C41301753_decoy,TRY1,Decoy,0,-7.4974,-7.64,-1.34,-6.932120931679664
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44136613_decoy,TRY1,Decoy,0,-8.40044,-6.49,-2.99,-6.076563888683132
O=C1CN(c2ccc(NC(=O)Nc3ccc(N4CCNC(=O)C4)[nH+]c3)cn2)CCN1,C48287300_decoy,TRY1,Decoy,0,-9.21459,-6.9,-1.85,-6.761353225236156
C[C@]([NH3+])(CCCOc1c(Br)cc([N+](=O)[O-])cc1Br)C(N)=O,C50441534_decoy,TRY1,Decoy,0,-8.29126,-4.07,-2.12,-4.649246889134934
Nc1cc2cnc(Nc3ccc(N4CC[NH2+]CC4)cn3)nc2n(C2CCCC2)c1=O,C13641590_decoy,TRY1,Decoy,0,-9.34781,-5.56,-3.82,-4.966832949965736
C[C@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258692_decoy,TRY1,Decoy,0,-7.37029,-6.06,-1.52,-5.36131094963601
NS(=O)(=O)c1ccc(N/N=C2\C(=[NH2+])Nn3c2nc(-c2ccccc2)cc3=O)cc1,C15961957_decoy,TRY1,Decoy,0,-10.1171,-6.0,-0.35,-5.858884724082352
C[C@H](NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccc(S(N)(=O)=O)cc1,C39933392_decoy,TRY1,Decoy,0,-9.46032,-7.79,-3.81,-7.1752464399054405
NC(=O)[C@H]1N[C@@H](Nc2ccccc2)S[C@H]1NC(=O)[C@@H]1C=c2cc(Cl)ccc2=[NH+]1,C63686320_decoy,TRY1,Decoy,0,-8.64894,-5.93,-0.92,-5.587820034991312
CCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccc(Cl)cc21,C08791424_decoy,TRY1,Decoy,0,-8.7178,-7.72,-1.34,-7.333749897027849
CCCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C08791536_decoy,TRY1,Decoy,0,-7.63303,-8.4,-2.3,-6.011345481582222
COCCN1C(=O)[C@@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C08791651_decoy,TRY1,Decoy,0,-7.07914,-6.21,-1.06,-5.2571245891747616
COc1ccc(N2CC[NH+](Cc3nc(N)nc(Nc4ccc(Cl)c(Cl)c4)n3)CC2)cc1,C09489191_decoy,TRY1,Decoy,0,-10.0278,-5.66,-1.12,-5.501709271201073
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C09595751_decoy,TRY1,Decoy,0,-7.82621,-8.1,-3.59,-7.211189358466831
Cc1ccc2c(c1)[C@@]1([NH2+][C@H](Cc3ccc(O)cc3)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C12881521_decoy,TRY1,Decoy,0,-10.3462,-8.25,-1.17,-8.304088161968693
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@H](Cc2ccc(O)cc2)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C12882512_decoy,TRY1,Decoy,0,-8.59684,-8.44,-2.77,-6.891936156791775
CCOc1cccc(C[NH+]2CCC(O)(c3ccc4oc(C(=O)NC[C@@H]5CCCO5)cc4c3)CC2)c1O,C14961060_decoy,TRY1,Decoy,0,-10.7613,-6.64,-2.56,-6.071343705390045
COc1cc2c(cc1OC)[C@@H](c1c(O)nc(O)n(-c3cccc(C(F)(F)F)c3)c1=O)[NH2+]CC2,C09330782_decoy,TRY1,Decoy,0,-7.55459,-7.45,-2.76,-5.958763300599774
COCCN1C(=O)[C@H]2[C@H](Cc3c[nH]c4ccccc34)[NH2+][C@@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O,C08995693_decoy,TRY1,Decoy,0,-9.05457,-8.77,-1.18,-7.008412069278241
COc1cc([C@H]2[NH+]=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)ccc1OCc1c(C)noc1C,C19354145_decoy,TRY1,Decoy,0,-9.43628,-6.43,-3.32,-5.824969543392868
Nc1nonc1-n1nnc(C[NH+]2CCCC2)c1C(=O)N/N=C/c1cccc(Br)c1,C19927166_decoy,TRY1,Decoy,0,-7.91294,-7.71,-0.9,-8.169611371324436
CSc1nc(NCC[NH3+])c2sc3nc(N4CCOCC4)c4c(c3c2n1)CC(C)(C)OC4,C20442216_decoy,TRY1,Decoy,0,-11.3726,-6.55,-1.9,-8.191397871005051
Cc1nc(N2CCOCC2)cc(Nc2ccc(NC(=O)Nc3ccc4c(c3)OCCO4)cc2)[nH+]1,C21795838_decoy,TRY1,Decoy,0,-9.4051,-7.44,-1.69,-5.711077205824787
CC1=C[C@H](C(=O)N2C[C@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)[C@H](C(F)(F)F)O1,C39671550_decoy,TRY1,Decoy,0,-8.67853,-6.89,-2.32,-5.854816443710674
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39674068_decoy,TRY1,Decoy,0,-7.05734,-8.32,-1.03,-6.547809189493857
Cn1cccc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676455_decoy,TRY1,Decoy,0,-9.4543,-8.4,-0.34,-8.503658249780342
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)[C@H]4COc5ccccc5O4)CC34CC[NH2+]CC4)c[nH]c12,C39684198_decoy,TRY1,Decoy,0,-8.78555,-9.94,-2.03,-7.0848420083670725
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685788_decoy,TRY1,Decoy,0,-9.35042,-5.38,-1.35,-6.1619463039451405
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c(C)c1,C39685872_decoy,TRY1,Decoy,0,-9.57345,-5.46,-3.6,-5.866118303360484
Nc1c(/N=N/c2ccc(/C=C\C3[NH+]=c4ccccc4=[NH+]3)cc2)cc(S(=O)(=O)[O-])c2ccccc12,C39738098_decoy,TRY1,Decoy,0,-8.91259,-8.71,-2.36,-6.87112506135806
Nc1c(/N=N/c2ccc(/C=C/C3[NH+]=c4ccccc4=[NH+]3)cc2)cc(S(=O)(=O)[O-])c2ccccc12,C39738099_decoy,TRY1,Decoy,0,-7.30375,-7.05,-3.21,-5.0451622810689765
Nc1c(Nc2cc(Cl)cc(Cl)c2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40701140_decoy,TRY1,Decoy,0,-8.69646,-6.54,-2.72,-5.229724778661159
Nc1c(Nc2ccc3c(c2)OCCO3)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40762197_decoy,TRY1,Decoy,0,-9.19788,-8.96,-1.48,-6.438762689509505
Nc1c(Nc2cccc(Cl)c2Cl)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40778769_decoy,TRY1,Decoy,0,-9.99061,-6.51,-2.95,-5.871998244266881
Nc1c(Nc2ccc(Br)cc2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40782304_decoy,TRY1,Decoy,0,-8.89096,-7.23,-2.72,-5.754656621852934
Cc1ccc(S(=O)(=O)N/N=C2\CCCc3oc(C(=O)NC4CC(C)(C)[NH2+]C(C)(C)C4)c(C)c32)cc1,C40815355_decoy,TRY1,Decoy,0,-9.64928,-7.86,-0.87,-6.244965044576008
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2,C40815888_decoy,TRY1,Decoy,0,-8.38265,-8.13,-0.99,-7.1597686724779175
Cc1cc(C(=O)N2C[C@@H](C(=O)NCc3cc4ccccc4[nH]3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44713574_decoy,TRY1,Decoy,0,-9.34695,-7.06,-3.31,-7.7011762214477955
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)cc1,C44714372_decoy,TRY1,Decoy,0,-8.05376,-7.33,-1.96,-6.139899787810919
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C44714419_decoy,TRY1,Decoy,0,-9.17666,-8.02,-1.46,-6.406443913119795
Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)c1F,C44714525_decoy,TRY1,Decoy,0,-9.69481,-7.02,-2.79,-6.314966959047519
Cc1[nH]c2ccc(C#N)cc2c1CCNC(=O)[C@@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C44714585_decoy,TRY1,Decoy,0,-9.13846,-7.42,-1.83,-6.657061966899442
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)nn1C,C44714713_decoy,TRY1,Decoy,0,-10.5582,-6.98,-0.61,-6.636232486945074
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C(F)(F)F)cc4)CC34CC[NH2+]CC4)[nH]c2c1,C39695713_decoy,TRY1,Decoy,0,-8.50875,-8.61,-2.0,-6.8684568416203495
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C(F)(F)F)cc4)CC34CC[NH2+]CC4)[nH]c2c1,C39695712_decoy,TRY1,Decoy,0,-8.51699,-7.85,-2.16,-5.916174530060438
COc1ccccc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C44737103_decoy,TRY1,Decoy,0,-8.77278,-7.37,-1.65,-6.66385256827169
COc1c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)csc1Cl,C39695815_decoy,TRY1,Decoy,0,-11.3102,-8.46,-1.47,-9.368884391564476
NC(=O)C1CC[NH+]([C@H](c2ccc(Cl)cc2Cl)c2sc3nc(-c4ccco4)nn3c2O)CC1,C09808541_decoy,TRY1,Decoy,0,-7.4271,-5.86,-0.6,-4.831499684951809
NC(=O)C1CC[NH+]([C@@H](c2ccc(Cl)cc2Cl)c2sc3nc(-c4ccco4)nn3c2O)CC1,C09808543_decoy,TRY1,Decoy,0,-9.47035,-5.54,-1.59,-5.518996462694377
CCc1nc2sc([C@@H](c3ccc(Br)cc3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C10166991_decoy,TRY1,Decoy,0,-8.38819,-6.05,-1.85,-6.91434109205553
CCc1nc2sc([C@H](c3ccc(Br)cc3)[NH+]3CCC(C(N)=O)CC3)c(O)n2n1,C10166992_decoy,TRY1,Decoy,0,-9.00629,-6.85,-1.66,-6.9819110679205245
C[C@@H](O)c1cc2c(cc1NC(=O)C1=CNN3C1=[NH+][C@H](c1ccco1)C[C@H]3C(F)(F)F)OCO2,C12468315_decoy,TRY1,Decoy,0,-8.43258,-6.84,-2.34,-7.306541416269815
C[C@H](O)c1cc2c(cc1NC(=O)C1=CNN3C1=[NH+][C@H](c1ccco1)C[C@H]3C(F)(F)F)OCO2,C12468318_decoy,TRY1,Decoy,0,-7.72058,-6.7,-1.12,-6.917771780218031
NC1=[NH+]c2nc3cc4c(cc3n2[C@@H](c2ccc(OC(F)F)cc2OC(F)F)N1)OCCCO4,C12507754_decoy,TRY1,Decoy,0,-7.49794,-5.4,-2.77,-4.5872216283754526
CSCC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C13550998_decoy,TRY1,Decoy,0,-9.97293,-7.85,-1.48,-7.210736762955721
C[C@H](O)c1cc2c(cc1NC(=O)C1=CNN3C1=[NH+][C@H](c1ccco1)C[C@@H]3C(F)(F)F)OCO2,C12468310_decoy,TRY1,Decoy,0,-8.32788,-6.8,-2.41,-7.115524286951396
C[C@H](O)c1cc2c(cc1NC(=O)C1=CNN3C1=[NH+][C@@H](c1ccco1)C[C@@H]3C(F)(F)F)OCO2,C04195622_decoy,TRY1,Decoy,0,-8.07694,-8.74,-3.06,-7.701434579825666
O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Cl)cc1)[C@@](CC1=c3ccccc3=[NH+]C1)(C(=O)[O-])[NH2+][C@H]2c1ccccc1O,C63472899_decoy,TRY1,Decoy,0,-9.0604,-7.84,-1.18,-7.05367823994931
O=C(N[C@@H]1NN[C@H](C(F)(F)F)S1)[C@H]1CC(=O)N(CCC2=c3cc(Cl)ccc3=[NH+]C2)C1,C63557466_decoy,TRY1,Decoy,0,-10.1006,-6.61,-2.17,-7.937822223473403
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)C[NH3+],C04083929_decoy,TRY1,Decoy,0,-10.4187,-7.32,-2.53,-6.580682333414828
Cc1[nH]c(=O)[nH]c(=O)c1CSc1nnc([C@@H]([NH3+])Cc2c[nH]c3ccccc23)o1,C02359316_decoy,TRY1,Decoy,0,-6.85909,-8.29,-2.31,-6.156310788026121
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)CC1,C12658564_decoy,TRY1,Decoy,0,-6.97199,-7.8,-0.94,-8.491323182720416
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)CC1,C12658566_decoy,TRY1,Decoy,0,-7.03907,-7.44,-1.82,-8.622005413643697
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC1,C12658568_decoy,TRY1,Decoy,0,-6.89532,-7.51,-1.66,-7.976756606358005
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)CC1,C12658570_decoy,TRY1,Decoy,0,-6.03209,-7.28,-0.62,-7.854795384302015
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C13298314_decoy,TRY1,Decoy,0,-7.87302,-6.74,-2.42,-6.385181611740276
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C16036223_decoy,TRY1,Decoy,0,-7.06043,-7.91,-1.72,-8.722973192699556
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)CC1,C16036224_decoy,TRY1,Decoy,0,-6.71019,-8.52,-1.81,-8.870972087242215
CC(=O)/C(=C\c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1)C(=O)CC[NH+](C)C,C17142077_decoy,TRY1,Decoy,0,-7.30186,-6.98,-2.82,-5.943289266887325
Nc1nonc1-n1nnc(C[NH+]2CCCC2)c1C(=O)N/N=C/c1ccccc1O,C19808468_decoy,TRY1,Decoy,0,-7.85174,-6.88,-1.16,-6.922466094669441
Nc1nonc1-n1nnc(C[NH+]2CCCC2)c1C(=O)N/N=C/c1ccc(O)cc1,C19808474_decoy,TRY1,Decoy,0,-8.30135,-6.66,-1.87,-6.442960874487905
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(N4CCOCC4)nc3)C[NH+]12,C15707449_decoy,TRY1,Decoy,0,-9.47597,-5.74,-3.77,-5.756382525250353
COc1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cc(OC)c1OC,C20909946_decoy,TRY1,Decoy,0,-10.1248,-6.49,-3.2,-6.564888936641322
NC1=NON[C@@H]1N1N=N[C@H](C(=O)N/N=C/c2ccncc2)[C@@H]1C[NH+]1CCCCC1,C28529847_decoy,TRY1,Decoy,0,-8.55479,-4.61,-1.18,-5.327718527599626
CC(C)(C)NC(=O)NC(=O)C[NH+](CC(=O)NC(=O)NC(C)(C)C)C1CCCC1,C28974256_decoy,TRY1,Decoy,0,-10.2543,-6.66,-2.49,-7.738461663989377
NC1=C(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)C[NH+]1CCc1ccc(S(N)(=O)=O)cc1,C18209651_decoy,TRY1,Decoy,0,-10.5521,-7.19,-1.84,-6.223563036277199
CN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCC[NH3+])(C(=O)[O-])[NH2+][C@H]2c1cc(Cl)ccc1O,C34387437_decoy,TRY1,Decoy,0,-9.12244,-4.62,-2.35,-6.08178961016775
NC1=NON[C@@H]1N1N=N[C@@H](C(=O)N/N=C/c2ccncc2)[C@H]1C[NH+]1CCCCC1,C35983669_decoy,TRY1,Decoy,0,-7.50478,-7.34,-0.99,-6.801126863940524
Cc1ccc(CNc2[nH+]c3c(n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)N[C@H](N)NC3=O)cc1,C36281912_decoy,TRY1,Decoy,0,-8.15616,-5.88,-1.47,-5.185299401067045
C[NH+]1CCN(Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)CC1,C36593229_decoy,TRY1,Decoy,0,-6.66046,-7.24,-1.43,-8.8499835034168
C[C@@H]1C[NH+](CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CC[C@]1(O)c1ccc(F)cc1,C36734930_decoy,TRY1,Decoy,0,-8.36034,-8.41,-1.44,-9.02129368218669
Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc(O)c2)c1C[NH+]1CCCC1,C02801514_decoy,TRY1,Decoy,0,-8.81339,-7.14,-3.58,-6.33000345303489
CCC[C@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C38609330_decoy,TRY1,Decoy,0,-7.48316,-5.75,-1.14,-5.765109763069039
CC(=O)Nc1ccc(NC(=O)C[C@H]2C(=O)NCCN2C(=O)C[NH+]2CCN(CCO)CC2)cc1,C22933511_decoy,TRY1,Decoy,0,-7.71129,-6.78,-1.4,-6.00428018684883
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661701_decoy,TRY1,Decoy,0,-8.9794,-5.05,-2.25,-5.809070185157444
COc1ccc2nc(CCNC(=O)[C@H]3CN(C(=O)[C@@H]4C=C(C)N(C)N4)CC34CC[NH2+]CC4)[nH]c2c1,C39669991_decoy,TRY1,Decoy,0,-9.30503,-7.85,-1.64,-6.433908736133797
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OCCCC[NH3+])c21,C40429488_decoy,TRY1,Decoy,0,-9.81465,-6.42,-1.62,-7.388380071343868
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44136616_decoy,TRY1,Decoy,0,-8.67779,-5.13,-2.89,-5.832583710481135
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@@H](C)O1,C44672328_decoy,TRY1,Decoy,0,-8.99901,-7.34,-1.78,-5.513656853594067
CC(C)([NH2+]Cc1ncc[nH]1)c1nc(-c2ccc(Cl)c(O)c2)c(-c2ccncc2)[nH]1,C45191228_decoy,TRY1,Decoy,0,-8.99381,-7.22,-2.26,-7.665122681139795
Cc1cc(NC(=O)CSCC(=O)NCCC[NH+]2CCC(C(N)=O)CC2)no1,C46919643_decoy,TRY1,Decoy,0,-9.33527,-5.44,-2.78,-5.798249894995834
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1sccc1C(N)=O)c1ccccc1Cl,C47964715_decoy,TRY1,Decoy,0,-9.20766,-6.78,-1.24,-5.93462932133828
C[NH+]1CCC(NS(=O)(=O)c2sccc2Br)(/C(N)=N/O)CC1,C49060997_decoy,TRY1,Decoy,0,-7.38504,-5.68,-1.79,-5.3028716702748655
CC[C@H]([NH3+])COc1cncc(-c2cc3c(cnc4cc(OC)c(OC)cc43)c(N)n2)c1,C49784558_decoy,TRY1,Decoy,0,-9.81596,-7.93,-1.68,-6.864162299550728
C#CCNC(=O)CCNC(=O)Nc1nc(CN2CC[NH2+]CC2)nc2ccccc12,C50136695_decoy,TRY1,Decoy,0,-9.39176,-5.29,-1.0,-5.332787830974385
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C54581142_decoy,TRY1,Decoy,0,-6.93425,-6.12,-2.61,-4.812002261224066
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55028572_decoy,TRY1,Decoy,0,-8.09145,-5.39,-2.2,-6.01970963476114
O=C(NNC(=O)NC1CC[NH+](C2CC2)CC1)Nc1ccc(Br)cc1,C56595167_decoy,TRY1,Decoy,0,-8.32266,-5.98,-2.84,-4.883089726689319
Cc1[nH+]ccn1CCCNC(=O)NNC(=O)Nc1ccc(Br)cc1,C56728369_decoy,TRY1,Decoy,0,-7.83697,-6.57,-1.4,-6.567449202694124
CCOc1cc(/C=N/[NH+]=C(\N)c2nonc2N)cc(Br)c1OCC,C04689330_decoy,TRY1,Decoy,0,-9.7992,-5.61,-1.85,-6.532214209978166
C[C@@H](NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccc(S(N)(=O)=O)cc1,C39933393_decoy,TRY1,Decoy,0,-11.1966,-7.19,-1.52,-8.00478986170179
N[C@@H]1C2=CC=C(c3cc[nH+]cc3)N[C@@H]2S[C@@H]1C(=O)Nc1nnc(SCc2ccc(Cl)cc2)s1,C38999178_decoy2,TRY1,Decoy,0,-10.1268,-7.22,,-6.669898074755517
CC(C)Cn1c(CCC(N)=O)nn(C[NH+]2CCC[C@@H](CCC(N)=O)C2)c1=S,C66080391_decoy,TRY1,Decoy,0,-8.34101,-5.97,-2.61,-5.781267932337033
C[C@]12CCCC[C@H]1CC[C@@H]1[C@H]3CC[C@@](O)(C[NH2+]CCO)[C@@]3(C)CC[C@@H]12,C04011479_decoy,TRY1,Decoy,0,-7.02455,-4.7,-2.08,-5.044934269249038
CCOc1ccc2[nH+]c3cc(NCc4ccco4)ccc3c(N)c2c1,C04819533_decoy,TRY1,Decoy,0,-6.88257,-7.19,-0.88,-4.946984203030321
CC(C)(CO)[NH2+]C[C@@H](O)CON=C1c2ccccc2-c2ccccc21,C02707481_decoy,TRY1,Decoy,0,-6.23126,-7.21,-1.86,-6.417230611989034
CC(C)C[C@H]([NH3+])C(=O)Nc1c(Cl)cc(Br)cc1Cl,C20505968_decoy,TRY1,Decoy,0,-7.82405,-4.64,-3.13,-4.725000610883897
CCC[NH+](CCC)[C@H](C)C(=O)Nc1c(N)cc(Cl)cc1Cl,C21017466_decoy,TRY1,Decoy,0,-7.66058,-4.75,-3.97,-4.616780851070669
C[C@@H](C(=O)Nc1c(Cl)cc(N)cc1Cl)[NH+]1CCCCCC1,C21819808_decoy,TRY1,Decoy,0,-7.6386,-6.27,-1.35,-5.10289117813189
COc1ccc(OC[C@@H](O)CNC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C19202424_decoy,TRY1,Decoy,0,-6.98329,-5.79,-1.78,-5.236794240460736
CCc1cccc(OC[C@@H](O)CNC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C25562313_decoy,TRY1,Decoy,0,-8.50613,-6.94,-3.81,-7.5466419048050755
[NH3+]C[C@H](O)COC(c1ccccc1)(c1ccccc1)c1ccccc1,C26896463_decoy,TRY1,Decoy,0,-6.32801,-5.51,-1.37,-5.285519072981414
[NH3+]C1(CNS(=O)(=O)/C=C/c2ccc(Cl)cc2)CCCCC1,C36266700_decoy,TRY1,Decoy,0,-8.1479,-6.27,-0.51,-5.448452647401003
CCC[C@@H](C)[NH+](C)CCC(=O)Nc1c(N)cc(Cl)cc1Cl,C36789794_decoy,TRY1,Decoy,0,-9.37967,-4.94,-0.58,-5.820698861333881
C[C@H]([NH2+][C@H](C)c1ccccc1Br)c1cc(O)ccc1O,C36945532_decoy,TRY1,Decoy,0,-6.98865,-7.35,-0.92,-11.138890083761568
CC(C)[C@H]([NH3+])C(=O)Nc1cc(Br)ccc1Br,C37047039_decoy,TRY1,Decoy,0,-8.32824,-5.19,-2.31,-7.621189549650167
C[C@@H](Nc1cc(S(N)(=O)=O)ccc1Cl)C1CC[NH+](C)CC1,C37138110_decoy,TRY1,Decoy,0,-9.44909,-4.93,-2.61,-5.30570466359214
C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1Nc1cc(S(N)(=O)=O)ccc1Cl,C37138279_decoy,TRY1,Decoy,0,-8.13025,-4.52,-2.87,-4.474533259253605
C[C@@]([NH3+])(C(=O)Nc1c(Cl)cc(Br)cc1Cl)C1CC1,C37614451_decoy,TRY1,Decoy,0,-8.45365,-5.48,-3.03,-4.827061620459904
CCC[C@@](C)([NH3+])C(=O)N[C@@H](CC)c1ccc(Br)cc1,C37622113_decoy,TRY1,Decoy,0,-7.78728,-4.62,-4.68,-4.883015066994456
CCC[C@](C)([NH3+])C(=O)Nc1c(Cl)cc(Cl)c2nsnc12,C37622448_decoy,TRY1,Decoy,0,-8.3736,-5.25,-2.52,-4.615651669526431
CCCNC(=O)[C@H](C)Oc1c(Cl)cc(Cl)cc1C[C@H](C)[NH3+],C37728979_decoy,TRY1,Decoy,0,-9.18228,-5.31,-2.57,-5.325035091312424
C[C@]12CCCC[C@@H]1CC[C@H]1[C@H]2CC[C@@]2(C)[C@@H]1CC[C@@]2(O)C[NH2+]CCO,C04026707_decoy,TRY1,Decoy,0,-8.16708,-6.1,-2.37,-6.009004639398317
CCC[NH+]1CCC(Nc2ccccc2Br)(C(N)=O)CC1,C37944010_decoy,TRY1,Decoy,0,-6.71519,-3.67,-0.39,-3.9140564568431615
CC(C)CNC(=O)[C@H](C)Oc1c(Cl)cc(Cl)cc1CC[NH3+],C37722127_decoy,TRY1,Decoy,0,-8.71329,-5.32,-2.76,-6.07708187701235
CCN1C=C([C@@H](C)[NH2+]Cc2cc(-c3ccc(F)cc3)[nH]n2)[C@H](C)N1,C39305650_decoy,TRY1,Decoy,0,-7.60494,-7.11,-3.74,-5.918187327576096
CCCc1ccc([C@H](CNBr)N2CC[NH2+][C@H](O)C2)cc1,C39532857_decoy,TRY1,Decoy,0,-8.23819,-5.42,-1.24,-6.022069354544836
CCO[C@H]1C[NH+]([C@@H](CNO)c2ccc(-c3ccccc3)cc2)CCN1,C39533857_decoy,TRY1,Decoy,0,-6.8694,-5.15,-2.06,-4.681171628911699
CC(C)(C)[C@H]([NH3+])C(=O)Nc1c(Cl)cc(Br)cc1Cl,C40459261_decoy,TRY1,Decoy,0,-7.4243,-4.38,-2.45,-4.6244088503724665
CC[C@H]([NH2+][C@@H](CO)CC(C)C)c1cc(Br)ccc1O,C40774023_decoy,TRY1,Decoy,0,-7.3703,-4.96,-1.53,-5.258045942221682
N/[NH+]=C(/NC1CCCCC1)c1ccc(Br)cc1Cl,C42037840_decoy,TRY1,Decoy,0,-8.50429,-5.34,-1.02,-4.594849142149627
CCCNC(=O)[C@@H](C)[NH2+]CC(=O)Nc1c(Cl)cccc1Cl,C42314109_decoy,TRY1,Decoy,0,-8.70317,-5.9,-3.53,-5.703369275217975
C[C@@H](C(=O)Nc1c(Cl)cc(N)cc1Cl)[NH+](C)CC(C)(C)C,C45064782_decoy,TRY1,Decoy,0,-7.10141,-5.86,-1.34,-5.465427755139862
C[C@H](C(=O)Nc1c(Cl)cc(N)cc1Cl)[NH+](C)CC(C)(C)C,C45064785_decoy,TRY1,Decoy,0,-7.47071,-5.66,-3.46,-4.8686901757566
CC(C)[NH+]1CC[C@@H](Nc2cc3[nH]c(=O)[nH]c3cc2Br)C1,C45654469_decoy,TRY1,Decoy,0,-7.43345,-4.54,-0.44,-4.917832084872923
CC(C)[C@@H](NS(=O)(=O)c1ccc(CC[NH3+])s1)c1cccs1,C49560675_decoy,TRY1,Decoy,0,-9.47748,-5.91,-1.54,-11.180544522865302
C[NH+](Cc1nc(NN)c2ccsc2n1)Cc1ccc(Cl)s1,C51144897_decoy,TRY1,Decoy,0,-8.62769,-6.53,-1.11,-6.351610195550365
O[C@H](C[NH2+][C@@H]1CCCC[C@@H]1O)COc1ccc(Cl)cc1Cl,C52013962_decoy,TRY1,Decoy,0,-8.40458,-6.43,-0.82,-5.341069337345409
CC[NH2+][C@@H](C)c1cc(Br)ccc1OC[C@@H](C)C(N)=O,C52067394_decoy,TRY1,Decoy,0,-8.31528,-5.67,-2.48,-7.102762521922611
CC[NH2+][C@H](C)c1cc(Br)ccc1OC[C@@H](C)C(N)=O,C52067395_decoy,TRY1,Decoy,0,-8.32809,-5.71,-1.27,-7.532013884351969
C[NH2+][C@@H](CC1CCCC1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094507_decoy,TRY1,Decoy,0,-7.34982,-5.87,-0.83,-4.6189225658988855
C[NH2+][C@H](CC1CCCC1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094508_decoy,TRY1,Decoy,0,-6.98328,-4.59,-0.68,-4.969105048551033
C[NH2+][C@@H](c1ccccc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094543_decoy,TRY1,Decoy,0,-7.23994,-5.65,-0.88,-4.536326988231956
C[NH2+][C@H](c1ccc(F)cc1)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094552_decoy,TRY1,Decoy,0,-7.90044,-5.02,-0.94,-4.826390558210662
C[NH2+][C@H](c1cc2[nH]c(=O)[nH]c2cc1Br)C1CCCCC1,C52094570_decoy,TRY1,Decoy,0,-7.34587,-5.86,-0.19,-4.471462376266936
CC1CCC(CO)([NH2+]C[C@@H](O)c2cccc(Br)c2)CC1,C53118366_decoy,TRY1,Decoy,0,-8.16703,-5.31,-0.87,-5.492929554367084
C[C@H]1CCC[C@](CO)([NH2+]C[C@H](O)c2cc(Cl)ccc2Cl)C1,C53125923_decoy,TRY1,Decoy,0,-8.01504,-5.24,-1.07,-5.546139674741492
CC[NH+](CC(=O)Nc1ccccc1C(N)=O)Cc1ccc(Cl)s1,C53096566_decoy,TRY1,Decoy,0,-6.95518,-5.96,-0.59,-6.130824644607477
CC1(C)CC(NC(=S)Nc2ccccc2C(F)(F)F)CC(C)(C)[NH2+]1,C59112933_decoy,TRY1,Decoy,0,-8.17671,-4.63,-1.5,-5.354953006743238
CC[NH2+][C@@H](C)c1cc(Br)ccc1O[C@@H](CC)C(N)=O,C61676078_decoy,TRY1,Decoy,0,-7.56279,-5.27,-2.13,-4.998598747425945
NS(=O)(=O)c1ccc(Nc2cc[nH+]c3ccc(Cl)cc23)cc1,C41495576_decoy,TRY1,Decoy,0,-8.18638,-5.88,-0.98,-5.349729982416136
Cc1sc2nc(CC[NH3+])nc(N[C@H](C)CCc3ccco3)c2c1C,C65396849_decoy,TRY1,Decoy,0,-8.13134,-6.47,-1.07,-8.37368655853943
N/C(NCC1(c2c(F)cccc2F)CCCC1)=[NH+]\C[C@@H]1CCCO1,C66244395_decoy,TRY1,Decoy,0,-7.96287,-5.77,-2.94,-5.466793711317127
CCCCCNC(=O)C(=O)NC[C@H](c1ccco1)[NH+]1CCN(c2ccccc2F)CC1,C04272993_decoy,TRY1,Decoy,0,-7.2947,-7.52,-1.66,-5.986394814225977
CCC[C@@H](C(=O)Nc1cc(C)on1)[NH+](CCC)CC(=O)Nc1ccc(F)c(F)c1F,C09911188_decoy,TRY1,Decoy,0,-7.31559,-6.16,-1.71,-5.991348548984151
CC(C)C[C@@H](CNc1ccc(S(=O)(=O)NC(C)C)cc1[N+](=O)[O-])[NH+]1CCCC1,C12562684_decoy,TRY1,Decoy,0,-6.53084,-6.44,-3.15,-5.265093536210609
COc1ccc(-c2nnc(SCC[NH2+]CCO)n2-c2ccc(OC)cc2)cc1,C03312564_decoy,TRY1,Decoy,0,-8.83654,-5.31,-2.02,-6.82922155210333
CCCCc1nc(C[NH+]2CCC[C@H](CCC(=O)Nc3cc(OC)cc(OC)c3)C2)c[nH]1,C12307181_decoy,TRY1,Decoy,0,-8.66642,-5.48,-2.25,-5.67718194791679
CC(C)CCNC(=O)c1cn(C2CCCC2)cc(C(=O)NCC(C)(C)C[NH+](C)C)c1=O,C15004487_decoy,TRY1,Decoy,0,-9.62833,-6.22,-3.27,-6.420783246387958
Cc1ccccc1OCC[NH+](C)CC(=O)Nc1ccccc1C(=O)NCc1ccco1,C15099900_decoy,TRY1,Decoy,0,-7.44504,-7.86,-1.2,-6.990001112554472
CCOc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2)cc(Br)c1OCC,C16688367_decoy,TRY1,Decoy,0,-6.42354,-5.25,-1.01,-4.504284021940866
CC[NH+](CC)CCN1C(=O)C(=O)/C(=C(/O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(O)c(OC)c1,C09412669_decoy,TRY1,Decoy,0,-8.81912,-7.21,-1.41,-8.668149665472253
CC[NH+](CC)CCNc1nc(Nc2cccc(OC)c2)c2cnn(-c3ccccc3)c2n1,C17287697_decoy,TRY1,Decoy,0,-9.14934,-6.43,-1.9,-7.232472145085669
CCC[NH+](CC(=O)Nc1ccccc1C)CC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1,C19531979_decoy,TRY1,Decoy,0,-7.75311,-7.4,-3.28,-6.857083954501488
CCOc1ccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc2cc(Cl)ccc2Cl)cc1OCC,C03541715_decoy,TRY1,Decoy,0,-7.98268,-6.21,-2.92,-6.31665641012024
COc1cc(OC)c(OC)cc1CN(C[C@@H]1CCCO1)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21263482_decoy,TRY1,Decoy,0,-9.90602,-5.67,-2.65,-7.229955735945997
CCCCC(=O)Nc1cc(C(=O)N(CC(C)C)CC(C)C)cnc1N1CC[NH2+]CC1,C21707454_decoy,TRY1,Decoy,0,-8.41585,-5.89,-3.29,-5.908077994883865
CC[NH+](CC)CCCn1c(SCC(=O)NC(=O)Nc2ccccc2F)nc2ccccc2c1=O,C23557220_decoy,TRY1,Decoy,0,-9.89437,-8.68,-3.9,-7.865951257990002
C[NH+](C)[C@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl,C23788952_decoy,TRY1,Decoy,0,-7.29321,-6.75,-3.26,-5.448619334495792
C=CCNC(=O)C[NH+]1CCN(CC(=O)Nc2sc3c(c2C(=O)OCC)CC[C@H](C)C3)CC1,C27559066_decoy,TRY1,Decoy,0,-9.70513,-6.95,-2.44,-7.695331084047221
Cc1ccc(C[NH+](CCc2c[nH]c3ccccc23)Cc2nc(C(=O)NC[C@H]3CCCO3)co2)cc1,C35704927_decoy,TRY1,Decoy,0,-8.86299,-8.11,-2.68,-7.3421333455719155
O=c1[nH]c(C[NH+](Cc2ccco2)C[C@H](O)COCc2ccccc2)nc2sc3c(c12)CCC3,C35744356_decoy,TRY1,Decoy,0,-9.30731,-7.69,-3.17,-7.471642118640491
COCCC[NH+](Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1)CC(C)(C)O,C35746534_decoy,TRY1,Decoy,0,-7.86692,-6.22,-3.27,-6.289862342759023
C=CCOC(=O)c1sc2nc(C[NH+](C[C@H](O)CC)C3CCCCC3)[nH]c(=O)c2c1C,C35746724_decoy,TRY1,Decoy,0,-8.64067,-5.62,-4.19,-6.344464014843215
CCC[C@H](O)C[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C1CC1,C35746831_decoy,TRY1,Decoy,0,-8.13705,-5.73,-3.71,-5.306031744912278
C=CC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)C(C)C,C35746869_decoy,TRY1,Decoy,0,-8.80197,-5.46,-2.61,-6.020374597260819
C#CCOC[C@H](O)C[NH+](Cc1nc2scc(-c3ccc(OC)cc3)c2c(=O)[nH]1)C1CCCCC1,C35747449_decoy,TRY1,Decoy,0,-9.50162,-6.35,-1.87,-6.360878680101889
Cc1cccc(C[NH+](CCc2c[nH]c3ccccc23)Cc2nc(C(=O)NCc3ccco3)co2)c1,C36064012_decoy,TRY1,Decoy,0,-8.16299,-8.56,-2.92,-7.464421291039834
COc1ccc(OC)c(C[NH+](CCc2c[nH]c3ccccc23)Cc2nc(C(=O)NC(C)C)co2)c1,C36064239_decoy,TRY1,Decoy,0,-8.69471,-7.81,-3.77,-9.011509770990903
COCCC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCCC3)C[C@H](O)COc1ccccc1,C36157070_decoy,TRY1,Decoy,0,-9.46288,-7.12,-1.7,-7.060322548141038
CC(C)CC[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CCC3)C[C@H](O)COCc1ccco1,C36159957_decoy,TRY1,Decoy,0,-9.22144,-4.66,-3.25,-6.149730146662387
CCC[C@H](O)C[NH2+][C@@H](c1nc(-c2cc(OC)c(OC)c(OC)c2)no1)C(C)C,C36160516_decoy,TRY1,Decoy,0,-8.37762,-6.79,-1.52,-6.688715423538969
Cc1sc2nc(C[NH+](Cc3ccco3)C[C@H](O)COCc3ccccc3)[nH]c(=O)c2c1C,C36204458_decoy,TRY1,Decoy,0,-7.59158,-7.65,-3.43,-6.422167692500371
Cc1ccc(-c2csc3nc(C[NH+](Cc4ccco4)C[C@H](O)COC(C)C)[nH]c(=O)c23)cc1C,C36205240_decoy,TRY1,Decoy,0,-8.65704,-5.66,-2.46,-5.470357249125308
COCCC[NH+](Cc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C[C@@H](O)COC(C)(C)C,C36205527_decoy,TRY1,Decoy,0,-8.0659,-5.94,-2.74,-6.601842150765484
C=CC[NH+](Cc1nc2scc(-c3ccc(OC)c(OC)c3)c2c(=O)[nH]1)C[C@@H](O)CC,C36206087_decoy,TRY1,Decoy,0,-8.4721,-6.54,-1.7,-7.764972274959815
COCC[NH+](Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1)C[C@@H](O)COC(C)C,C36206498_decoy,TRY1,Decoy,0,-9.01899,-6.8,-2.94,-6.971369213781003
C=CC[NH+](Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1)C[C@H](O)COCC,C36206611_decoy,TRY1,Decoy,0,-8.00431,-5.76,-3.43,-5.795726703343648
CCc1c(C(=O)OC)sc2nc(C[NH+](C[C@@H](O)COc3ccccc3C)C(C)C)[nH]c(=O)c12,C36207315_decoy,TRY1,Decoy,0,-8.12634,-6.25,-1.52,-5.46862820959573
C=CCC[C@H](O)C[NH+](CC)Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1,C36207425_decoy,TRY1,Decoy,0,-8.90058,-5.67,-3.7,-7.423694981203998
Cc1c(C(=O)OC(C)C)sc2nc(C[NH+](C[C@@H](O)COc3ccccc3)C3CC3)[nH]c(=O)c12,C36207437_decoy,TRY1,Decoy,0,-8.08414,-7.12,-1.96,-7.205700817640814
COCCC[NH+](Cc1nc2sc(C(C)C)cc2c(=O)[nH]1)C[C@@H](O)COCC(C)C,C36313197_decoy,TRY1,Decoy,0,-8.02782,-6.38,-2.91,-7.456424341227952
CCn1cc(/C=C(\NC(=O)c2ccccc2OC)C(=O)NCCCn2cc[nH+]c2)c2ccccc21,C15936419_decoy,TRY1,Decoy,0,-7.81024,-7.18,-2.01,-7.767353654293572
CCOc1ccc(OCCNC(=O)C[NH+](C)CC(=O)Nc2c(C)cc(C)cc2C)cc1,C39519543_decoy,TRY1,Decoy,0,-7.66308,-5.76,-3.77,-5.375895494496748
CC(C)CC[C@@H](C)[NH+](C[C@H](O)COCc1ccco1)C[C@@H](O)COCc1ccco1,C25051829_decoy,TRY1,Decoy,0,-6.94136,-6.1,-2.26,-9.017762612451229
COc1ccc(OC[C@@H](O)C[NH+](Cc2nc3scc(-c4ccccc4C)c3c(=O)[nH]2)C(C)C)cc1,C40404934_decoy,TRY1,Decoy,0,-8.84551,-7.77,-2.82,-7.308721467577547
CCCCCC[NH+](CCO)Cc1cc(=O)oc2cc(NC(=O)OCC)ccc12,C52995099_decoy,TRY1,Decoy,0,-6.95006,-5.3,-4.27,-5.135722503606726
CCCCC[NH+](CC(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1)C(C)C,C59350258_decoy,TRY1,Decoy,0,-8.96192,-6.01,-3.72,-5.831763262236019
O=[N+]([O-])c1ccc(Cl)cc1NCC[NH2+]CCOc1nonc1-c1ccccc1,C59384055_decoy,TRY1,Decoy,0,-6.86342,-6.87,-2.02,-6.913310151419868
CCCCNC(=O)[C@@H]1CC[C@@H](C)[NH+](CC(=O)Nc2cc(OC)c(OC)c(OC)c2)C1,C60041347_decoy,TRY1,Decoy,0,-8.43067,-6.29,-1.81,-5.820089135090277
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)Nc1nc(C[NH+]2CCC(C)CC2)cs1,C22291032_decoy,TRY1,Decoy,0,-10.3077,-7.55,-2.23,-7.509491528550392
CC1=C(/C=C/C(=O)OCC(=O)NCCC2=c3ccccc3=[NH+]C2)[C@H](C)N(Cc2ccc(C)cc2)N1,C63135292_decoy,TRY1,Decoy,0,-9.24577,-9.25,-3.25,-7.858427257261519
C[NH+](C)[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1,C65496778_decoy,TRY1,Decoy,0,-7.04994,-7.42,-2.43,-5.784352052835185
O=S1(=O)CC[C@@H](S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3ccc(F)cc3)o2)C1,C08972470_decoy,TRY1,Decoy,0,-9.31845,-7.6,-3.04,-7.219976671484195
O=S1(=O)CC=C(S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3ccc(F)cc3)o2)C1,C08972473_decoy,TRY1,Decoy,0,-9.01229,-7.92,-2.83,-7.717860212512622
CN(CCc1ccncc1)C(=O)C(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1,C09005996_decoy,TRY1,Decoy,0,-8.30405,-8.16,-2.37,-7.109718200915972
O=S1(=O)CC=C(S(=O)(=O)NCCc2nnc(S(=O)(=O)Cc3ccccc3)o2)C1,C09024492_decoy,TRY1,Decoy,0,-8.17871,-5.1,-2.82,-5.23381667170178
CC(C)NC(=O)C(=O)NC[C@@H](c1cccs1)S(=O)(=O)c1ccc2c(c1)OCCO2,C09105772_decoy,TRY1,Decoy,0,-8.83779,-7.28,-1.44,-6.0723191780653725
CCSc1nnc(NC(=O)CSc2nc(C3CC3)nc3c2c(=O)n(C)c(=O)n3C)s1,C09277916_decoy,TRY1,Decoy,0,-10.9569,-7.44,-2.66,-8.739753833118618
C[C@H](Sc1nnc(C2CC2)o1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1,C09316583_decoy,TRY1,Decoy,0,-8.58609,-6.56,-3.47,-5.982749160316562
CCCn1c2c(c(=O)n(C)c1=O)[C@H](c1cc(OC)c(OC)c(OC)c1)C1=C(COC1=O)N2,C09704851_decoy,TRY1,Decoy,0,-6.37745,-5.7,-2.34,-4.7869771423919705
O=C1CCCN1CCCNc1ccc2nnc(CCC(=O)N3CCC4(CC3)OCCO4)n2n1,C09746104_decoy,TRY1,Decoy,0,-8.1851,-6.62,-1.43,-6.220789261483071
CCS(=O)(=O)N1CCN(S(=O)(=O)CCNC(=O)c2cc(=O)c3ccccc3o2)CC1,C10706066_decoy,TRY1,Decoy,0,-7.74615,-7.36,-2.03,-5.602532316208488
CC(C)[C@@H](NC(=O)[C@H]1CCOC1)c1nnc2n1CCN(C(=O)/C=C/c1ccccn1)CC2,C11786822_decoy,TRY1,Decoy,0,-7.76583,-5.18,-2.19,-5.141544467418254
COc1ccc([C@@H](NC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)c2nccn2C)cc1,C12520672_decoy,TRY1,Decoy,0,-9.14219,-6.16,-0.25,-5.993099435145046
CCC(=O)OC[C@@H]1O[C@H](n2cc(F)c(=O)[nH]c2=O)[C@@H](Br)[C@@H]1OC(=O)CC,C13303368_decoy,TRY1,Decoy,0,-5.92549,-4.68,-3.5,-4.44154169630962
CC(=O)OC[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C13361607_decoy,TRY1,Decoy,0,-6.01037,-4.17,-3.61,-4.702462432455832
Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@@H]3OC(C)(C)O[C@H]32)cc1,C13550944_decoy,TRY1,Decoy,0,-7.24101,-9.11,-1.68,-7.341638273057812
C[C@H](Sc1nnc(N2CCOCC2)n1Cc1ccco1)C(=O)N[C@H]1CCS(=O)(=O)C1,C14113162_decoy,TRY1,Decoy,0,-8.86818,-5.81,-2.86,-5.645458827676285
CCn1c(CN2CCCCCC2=O)nnc1S[C@@H](C)C(=O)N[C@H]1CCS(=O)(=O)C1,C14242901_decoy,TRY1,Decoy,0,-8.62602,-7.16,-2.17,-6.219913815701753
CCOc1cc(/C=C2\SC(=S)NC2=O)ccc1OC(=O)C[C@H]1SC(=O)NC1=O,C14904633_decoy,TRY1,Decoy,0,-10.8835,-6.04,-2.72,-9.58156591735643
C[C@@]1(c2ccc(OC(F)F)cc2)NC(=O)N(CC(=O)N2CCN(S(C)(=O)=O)CC2)C1=O,C18257327_decoy,TRY1,Decoy,0,-7.25966,-5.28,-1.8,-6.982694888078672
O=C1CCS(=O)(=O)N1c1ccc(S(=O)(=O)NC[C@H](c2ccco2)N2CCOCC2)cc1,C19818962_decoy,TRY1,Decoy,0,-9.5342,-7.09,-2.6,-6.176946943383812
C[C@H](Sc1nnc([C@H]2COc3ccccc3O2)n1C)C(=O)N[C@@H]1CCS(=O)(=O)C1,C21669695_decoy,TRY1,Decoy,0,-7.74984,-7.74,-2.05,-5.344882560022966
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)Nc2ccc(S(=O)(=O)CC)cc2)c1,C21693602_decoy,TRY1,Decoy,0,-7.84755,-5.95,-2.87,-5.202937477479777
CN(Cc1c(F)cccc1Cl)C(=O)CSc1nnc(Cn2ccc(=O)[nH]c2=O)o1,C21704405_decoy,TRY1,Decoy,0,-7.75771,-7.38,-1.89,-5.928051719488836
CC(=O)N[C@H](C(=O)N1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cn2)CC1)C(C)C,C22282815_decoy,TRY1,Decoy,0,-7.57956,-7.0,-4.17,-4.987418421795998
Cc1nc(NC(=O)CCCn2cnc3c2c(=O)n(C)c(=O)n3C)sc1-c1nccn1C,C25143614_decoy,TRY1,Decoy,0,-7.33155,-6.24,-2.03,-5.5109624732329205
COCCn1nc(C(=O)NCCN2C(=O)S/C(=C\c3ccccc3F)C2=O)ccc1=O,C27705858_decoy,TRY1,Decoy,0,-7.76259,-6.42,-5.1,-5.485137840055602
O=C(NCCN1CCOCC1)c1ccc(Cn2nnc3cc4c(cc3c2=O)OCCO4)o1,C28560357_decoy,TRY1,Decoy,0,-8.58284,-7.85,-1.82,-5.926936530248105
Cc1nc2c(C(=O)NC[C@H]3CCCO3)nc(-c3ccco3)cc2n1[C@@H]1CCS(=O)(=O)C1,C32642610_decoy,TRY1,Decoy,0,-9.14099,-5.4,-2.03,-5.703520377414348
CC(=O)O[C@@H](I)[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)C[C@H]1OC(C)=O,C35024547_decoy,TRY1,Decoy,0,-5.9022,-4.26,-2.02,-4.088593768294017
C[C@H](C(=O)NCCN1C(=O)CSC1=O)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1,C12792198_decoy,TRY1,Decoy,0,-8.72768,-5.69,-3.81,-5.422105688264973
CN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C,C09125203_decoy,TRY1,Decoy,0,-7.05732,-7.85,-2.67,-6.11405383782279
COc1cc(OC)c(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)cc1NC(C)=O,C13028134_decoy,TRY1,Decoy,0,-7.10531,-6.05,-3.3,-4.86909875300844
COc1ccc(-c2nnc3ccc(OCCNC(=O)Cn4nc(C)ccc4=O)nn23)cc1OC,C38500307_decoy,TRY1,Decoy,0,-8.47827,-5.66,-3.34,-5.731832509304601
CN1CCN(C(=O)C(=O)NC[C@H](c2ccco2)S(=O)(=O)c2ccc3c(c2)OCO3)CC1,C38791415_decoy,TRY1,Decoy,0,-7.9234,-7.98,-2.71,-8.306759699469415
Cc1nc(SCC2=N[C@@H]3C=CS[C@@H]3C(=O)N2)c2c(=O)n(C)c(=O)n(CC(C)C)c2n1,C39422634_decoy,TRY1,Decoy,0,-9.49476,-6.94,-2.65,-5.741658824099898
CC(C)S(=O)(=O)C1=C2Nc3ccccc3C[NH+]2[C@@H](C(=O)N(C)S(=O)(=O)C(C)C)C1,C39543595_decoy,TRY1,Decoy,0,-7.3462,-7.59,-1.06,-8.259071410841957
C[C@@H](Sc1nnc([C@@H]2COc3ccccc3O2)n1C)C(=O)N[C@H]1CCS(=O)(=O)C1,C39995753_decoy,TRY1,Decoy,0,-8.13734,-7.59,-2.08,-6.338747468291225
COCCN(CC(=O)Nc1nc(CC(=O)N2CCN(C(C)=O)CC2)cs1)C(=O)c1ccco1,C40372668_decoy,TRY1,Decoy,0,-8.86476,-7.13,-4.26,-6.652587502443659
[H]/N=C1C(=C/c2ccc(OS(C)(=O)=O)c(OCC)c2)/C(=O)N=C2SC(c3ccco3)=NN2/1,C41076783_decoy,TRY1,Decoy,0,-7.78381,-6.77,-3.29,-4.836431148082527
O=c1ccn([C@H]2CC[C@@H](CO[P@](=O)(Oc3ccccc3)Oc3ccncc3)O2)c(=O)[nH]1,C43020402_decoy,TRY1,Decoy,0,-6.18062,-6.18,-2.29,-5.030351093440085
O=c1ccn([C@H]2CC[C@@H](CO[P@](=O)(Oc3ccccc3)Oc3cccnc3)O2)c(=O)[nH]1,C43075451_decoy,TRY1,Decoy,0,-6.26978,-7.22,-2.63,-6.072422432991417
O=C(c1cnc2c(c1)c(=O)[nH]c(=O)n2C1CC1)N1CCN(CCCOCC(F)(F)F)CC1,C48300119_decoy,TRY1,Decoy,0,-7.46702,-6.14,-2.75,-5.242267377790712
Cc1cc(NC(=O)CN2CCN(C(=O)[C@@H]3CC(=O)N(CCN4CCOCC4)C3)CC2)no1,C48332263_decoy,TRY1,Decoy,0,-8.43834,-7.2,-1.92,-7.1031017557148175
COc1nn(C)cc1C(=O)N1CCC[C@@H](C(=O)NCCn2nc(-c3ccco3)ccc2=O)C1,C49030588_decoy,TRY1,Decoy,0,-6.87892,-6.83,-2.56,-5.668745260030293
COc1nn(C)cc1C(=O)N1CCC(C(=O)NCCn2nc(-c3ccco3)ccc2=O)CC1,C56906842_decoy,TRY1,Decoy,0,-6.94597,-7.13,-2.58,-5.59563854669016
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(-c3ccco3)cc(C(=O)NCc3ccccn3)c12,C57293708_decoy,TRY1,Decoy,0,-8.28948,-6.9,-1.11,-5.801730312865198
[H]/N=C1C(=C\c2ccc(OS(C)(=O)=O)c(OC)c2)/C(=O)N=C2SC(S(C)(=O)=O)=NN2/1,C20207748_decoy,TRY1,Decoy,0,-8.72278,-6.27,-2.06,-5.822878733657725
CC(=O)Nc1nnc(S(=O)(=O)N2CCN(CC(=O)c3cc(C)n(C(C)C)c3C)CC2)s1,C62692418_decoy,TRY1,Decoy,0,-8.67064,-5.29,-3.11,-5.770500201180867
CCOC(=O)c1c(S(=O)(=O)N2CCC(C(=O)NC[C@H]3CCCO3)CC2)c(C)n(C)c1C,C64979349_decoy,TRY1,Decoy,0,-8.32941,-6.39,-4.47,-5.867976544291761
Cc1noc(C)c1S(=O)(=O)N1CCC([C@@H](C)C(=O)NCCCN2CCOCC2)CC1,C65061442_decoy,TRY1,Decoy,0,-8.58468,-5.43,-4.19,-5.091810936245549
O=C(CF)N[C@H](NC(=S)Nc1cccc(O)c1)C(Cl)(Cl)Cl,C03137343_decoy,TRY1,Decoy,0,-8.16417,-5.09,-0.76,-5.335156604180781
Cc1cccc(NCC[NH2+][C@@H](CC(=O)Nc2c(Cl)cccc2Cl)C(=O)[O-])c1,C05258298_decoy,TRY1,Decoy,0,-7.002,-7.0,-2.81,-5.945097413192967
Cc1ccc(OCC(=O)NC(=S)NNC(=O)c2ccccc2O)cc1,C06845542_decoy,TRY1,Decoy,0,-8.06057,-7.05,-1.48,-6.990588333394491
CCCCCNC(=S)NNC(=O)C[C@H]1Sc2ccccc2NC1=O,C08089165_decoy,TRY1,Decoy,0,-8.73624,-5.22,-2.98,-5.668485127306654
NC(=O)N[C@@H](CC(=O)Nc1cccc(/C=C/c2ccccn2)c1)c1ccc(Cl)cc1,C08346237_decoy,TRY1,Decoy,0,-8.38637,-5.23,-1.54,-5.613052880087828
O=C(CNC(=O)C1CCCCC1)NNC(=S)NC(=O)C1CCCCC1,C08554320_decoy,TRY1,Decoy,0,-8.44532,-7.41,-1.68,-6.4140515235141216
CCc1c(C)sc(NC(=S)NC(=O)Cc2ccccc2)c1C(N)=O,C10149799_decoy,TRY1,Decoy,0,-9.57103,-5.28,-2.23,-6.779766045759627
O=C(C[C@@H]([NH2+]CCC1=CCCCC1)C(=O)[O-])Nc1cc(Cl)ccc1O,C10186453_decoy,TRY1,Decoy,0,-7.7737,-6.09,-1.69,-6.298839688706049
O=C(Cc1cccc2ccccc12)NC(=S)Nc1ccccc1C(=O)NCCO,C14651400_decoy,TRY1,Decoy,0,-7.45606,-6.92,-1.65,-6.9642040599221735
CC(=O)N[C@H](CC(=O)NNC(=S)Nc1cc(C)ccc1C)c1ccc(C)cc1,C22886062_decoy,TRY1,Decoy,0,-8.70279,-7.47,-2.81,-6.76092077517714
CC(=O)N[C@@H](CC(=O)NNC(=S)NC1CCCC1)c1ccc(Cl)cc1,C22976440_decoy,TRY1,Decoy,0,-7.60351,-6.28,-1.01,-6.491173999489144
CCCNC(=S)NNC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)C(C)C,C26677605_decoy,TRY1,Decoy,0,-8.08696,-5.65,-1.86,-6.14390298882787
N#CCSc1ccccc1NC(=O)CNc1ccc(Cl)c(C(N)=O)c1,C26785571_decoy,TRY1,Decoy,0,-8.70434,-4.96,-1.13,-4.91252351978128
O=C(CNC(=O)C12CC3CC(CC(C3)C1)C2)NNC(=S)NC1CCCC1,C27249476_decoy,TRY1,Decoy,0,-9.02171,-5.43,-2.78,-5.196133001744727
CCCCNC(=O)[C@H](c1cccc(O)c1)N(C)C(=O)c1cccc(O)c1O,C36531241_decoy,TRY1,Decoy,0,-6.82098,-5.47,-3.27,-5.314366924003733
C=C(C)C(=O)N(CCC)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36576410_decoy,TRY1,Decoy,0,-5.93312,-5.07,-2.32,-4.846123197826556
CN(C)c1ccccc1NC(=S)NNC(=S)Nc1ccccc1N(C)C,C38656208_decoy,TRY1,Decoy,0,-7.68117,-4.83,-2.24,-5.140057648307881
Cc1ccccc1[C@@H](CC(=O)NC[C@H](C)N(C)c1ccccc1)NC(N)=O,C40108911_decoy,TRY1,Decoy,0,-7.74542,-7.49,-2.24,-6.41762529179117
C=CCNC(=S)NNC(=O)CSCC(=O)Nc1ccc(F)cc1,C41961173_decoy,TRY1,Decoy,0,-9.02257,-6.58,-4.1,-7.018700012777588
C=CCNC(=S)NNC(=O)[C@@H](NC(=O)c1ccc(Cl)cc1)C(C)C,C41961633_decoy,TRY1,Decoy,0,-7.73091,-5.78,-2.08,-6.611474701173029
CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)NNC(=S)NC1CCCCC1,C41963578_decoy,TRY1,Decoy,0,-7.99388,-7.12,-2.34,-6.444738259898907
C[C@@H](NC(=O)C[C@@H](NC(N)=O)c1cccs1)c1ccc(OC(F)F)cc1,C45155112_decoy,TRY1,Decoy,0,-6.1079,-7.05,-2.19,-5.142463360883519
O=C(CNC(=O)C1CCCC1)NNC(=S)Nc1ccc(F)cc1F,C46584609_decoy,TRY1,Decoy,0,-8.76281,-7.64,-1.8,-8.028108063048757
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=S)N[C@H]2CCC[C@@H](C)[C@@H]2C)c1,C47872106_decoy,TRY1,Decoy,0,-8.08515,-7.33,-2.36,-7.176853075508521
Cc1ccc(C(=O)NCC(=O)NNC(=S)N[C@H]2CCC[C@@H](C)[C@@H]2C)s1,C47872182_decoy,TRY1,Decoy,0,-8.29497,-7.45,-1.15,-6.10739304608733
Cc1cc([C@H](C)NC(=O)Nc2ccccc2OCCC(N)=O)c(C)s1,C47878115_decoy,TRY1,Decoy,0,-7.24817,-6.21,-1.85,-5.351366889831676
CSCC[C@H](NC(N)=O)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl,C49952081_decoy,TRY1,Decoy,0,-8.34738,-5.94,-3.51,-5.739809762734455
C#CCNC(=O)CNC(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1,C51617575_decoy,TRY1,Decoy,0,-7.3336,-6.0,-3.58,-5.377356947405864
NC(=O)COc1ccc(/C=C/C(=O)NCCc2c[nH]c3ccccc23)cc1,C08275352_decoy,TRY1,Decoy,0,-7.85791,-7.26,-2.85,-9.05862545386892
CCC[C@H](NC(=O)CNc1ccccc1SCC(N)=O)c1ccccc1,C53100579_decoy,TRY1,Decoy,0,-8.04637,-5.82,-1.47,-6.646224640217822
CC(=O)Nc1ccc(SCCC(=O)Nc2sccc2C(N)=O)cc1,C54439776_decoy,TRY1,Decoy,0,-8.46072,-6.28,-0.19,-6.012929189089027
CC[C@H](C)[C@@H](NC(N)=O)C(=O)NCCc1ccc(Br)s1,C10500795_decoy,TRY1,Decoy,0,-9.01379,-5.48,-3.98,-7.207667152461905
CC(=O)Nc1ccc(S[C@@H](C)C(=O)Nc2ccccc2CC(N)=O)cc1,C55303384_decoy,TRY1,Decoy,0,-7.19232,-6.57,-1.81,-7.1395606236020726
CC(C)NC(=O)Nc1ccc(CN[C@H](C(=O)NC(C)(C)C)C(C)C)cc1,C56153400_decoy,TRY1,Decoy,0,-6.78905,-5.85,-1.75,-5.752625669619663
C[C@H](Nc1ccc(Cl)c(F)c1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1,C56173850_decoy,TRY1,Decoy,0,-8.8036,-6.83,-2.54,-5.73459633878836
Cc1cc(OCC(N)=O)ccc1N[C@H](C)C(=O)Nc1cccnc1Cl,C56206819_decoy,TRY1,Decoy,0,-8.1909,-6.28,-1.54,-8.1050150692243
COC(=N[C@H](NC(=S)NN)C(Cl)(Cl)Cl)c1ccc(C)cc1,C02686567_decoy,TRY1,Decoy,0,-7.67138,-6.31,,99.0
COc1ccc(C2(CNC(=O)[C@H](CCSC)NC(N)=O)CCCCC2)cc1,C63083172_decoy,TRY1,Decoy,0,-7.87315,-6.97,-2.39,-6.052466105182596
CC(C)Oc1ccc(C#N)cc1N[C@H](C)C(=O)Nc1sccc1C(N)=O,C63640868_decoy,TRY1,Decoy,0,-8.30005,-4.88,-2.6,-4.968695182139555
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=S)NCC(F)(F)F)cc1,C64082679_decoy,TRY1,Decoy,0,-7.97341,-6.93,-1.95,-5.977925899065399
C#CCNC(=O)CCNC(=O)NC[C@H](c1cccs1)c1c[nH]c2ccccc12,C50136666_decoy,TRY1,Decoy,0,-9.15538,-5.08,-2.25,-5.802405340403777
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNC(=O)NCC1CC1,C65623595_decoy,TRY1,Decoy,0,-7.88875,-7.19,-2.08,-7.0743215428345225
CC(=O)Nc1ccc(CC(=O)NNC(=S)Nc2ccccc2C(C)C)cc1,C66123019_decoy,TRY1,Decoy,0,-7.56006,-7.35,-2.55,-5.931842399515195
CC[NH+](c1ccc(NC(=O)C[NH+]2CCNC(=O)[C@@H]2C(C)C)cc1)C(C)C,C66498835_decoy,TRY1,Decoy,0,-7.0598,-5.4,-1.25,-4.923706098415241
C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](NC(N)=O)c1cccs1,C66855970_decoy,TRY1,Decoy,0,-8.2657,-7.19,-2.96,-7.230610690677204
C#Cc1cccc(NC(=S)NNC(=O)CNC(=O)CCc2ccc(C)cc2)c1,C67196124_decoy,TRY1,Decoy,0,-9.1705,-6.83,-2.65,-6.404415964419999
Cc1ccc(NC(=O)NCCCSc2ccc(F)cc2)cc1C(N)=O,C67313247_decoy,TRY1,Decoy,0,-9.69411,-7.54,-4.96,-7.492922999032634
C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)CCNC(=O)c1ccc(F)cc1,C67464396_decoy,TRY1,Decoy,0,-8.64869,-7.28,-2.55,-6.286709218500492
C[C@@H]1CCCC[C@H]1NC(=S)NNC(=O)CCNC(=O)c1ccc(F)cc1,C67464397_decoy,TRY1,Decoy,0,-8.19528,-7.62,-3.16,-6.280986332554118
Cc1cccc(C)c1OC[C@H](O)CNC(=O)N[C@H](C)Cc1ccc(O)cc1,C67605891_decoy,TRY1,Decoy,0,-8.25743,-6.92,-2.48,-6.3607005109050325
CCOc1cc(/C=N\n2c(N)c(C(=O)NCCCOC(C)C)c3nc4ccccc4nc32)ccc1O,C01876250_decoy,TRY1,Decoy,0,-8.18715,-7.64,-3.34,-9.137628661973944
COCCNC(=O)C[C@@H]1c2nc(NCc3ccccc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222512_decoy,TRY1,Decoy,0,-9.58866,-6.44,-2.26,-6.658843952925224
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC(=S)NNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1,C09229854_decoy,TRY1,Decoy,0,-8.95385,-7.92,-1.89,-6.6147211110987625
CC(C)CN(C(=O)CSc1nnc(-c2ccccc2F)[nH]1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C09837070_decoy,TRY1,Decoy,0,-8.16765,-6.86,-2.27,-7.657427143718943
COc1ccccc1/C=C/C(=O)NC(=S)NNC(=O)CCC(=O)Nc1cccc(Cl)c1C,C10000585_decoy,TRY1,Decoy,0,-8.71531,-8.18,-2.05,-7.322126707225088
COCCNC(=O)NC(=O)COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1,C12357424_decoy,TRY1,Decoy,0,-9.25012,-7.29,-0.96,-7.795949162973937
CCOC(=O)/C=C/C(=O)NC(=S)NNC(=O)CCC(=O)Nc1ccc(Cl)cc1Cl,C12501359_decoy,TRY1,Decoy,0,-8.15519,-7.82,-4.07,-7.01187843646226
CCc1ccc(NC(=S)Nc2cnn(Cn3cc(NC(=S)Nc4ccc(CC)cc4)cn3)c2)cc1,C02799616_decoy,TRY1,Decoy,0,-8.6986,-7.78,-4.28,-6.575214512507566
COc1ccccc1Nc1nc(N)nc(CSCC(=O)N[C@H](C)c2ccccc2Cl)n1,C15495851_decoy,TRY1,Decoy,0,-9.30714,-8.44,-3.87,-7.520730501250594
C=C/C(=C\C=C/CCl)NC(=O)NCc1cccc(CNC(=O)Nc2cccc(Cl)c2)c1,C16138234_decoy,TRY1,Decoy,0,-10.1734,-7.28,-2.96,-7.271734883141656
CCOc1ccccc1Nc1nnc(SCc2nc(N)nc(Nc3ccccc3OC)n2)s1,C16618279_decoy,TRY1,Decoy,0,-8.28103,-6.97,-3.87,-6.897644232308076
CCCCN(C(=O)CSc1nc2ccc(Cl)cc2[nH]1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C18956699_decoy,TRY1,Decoy,0,-10.1178,-7.25,-3.27,-7.838147344533043
CCOc1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cc(Cl)ccc3C)n2N)cc1,C20528017_decoy,TRY1,Decoy,0,-10.8013,-5.41,-2.65,-7.054344625915217
CC[C@@H](C)c1ccc(NC(=O)CSc2nnc(N/N=C/c3c(C)nn(C(C)C)c3C)n2N)cc1,C20805374_decoy,TRY1,Decoy,0,-9.74504,-8.77,-4.05,-8.228294137810446
O=C(CCSc1n[nH]c(N/N=C/c2cccc(O)c2)n1)Nc1cccc(N2CCCC2=O)c1,C20906681_decoy,TRY1,Decoy,0,-8.49342,-7.0,-3.79,-6.455833030538097
CCOc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2c(O)ccc3ccccc23)n1,C20907036_decoy,TRY1,Decoy,0,-8.75323,-8.28,-3.03,-6.885471448070967
CC(C)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3c(O)ccc4ccccc34)n2)s1,C20907316_decoy,TRY1,Decoy,0,-10.1247,-8.55,-3.21,-10.517838840976031
COc1cc(NC(=O)CCSc2n[nH]c(N/N=C/c3c(O)ccc4ccccc34)n2)cc(OC)c1,C20907795_decoy,TRY1,Decoy,0,-8.93419,-8.86,-4.36,-7.876204660540622
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)Nc2cccc3ccccc23)n1N,C20911871_decoy,TRY1,Decoy,0,-10.807,-9.39,-3.08,-8.045547497029736
Cc1nnc(NC(=O)CSc2nnc(NN=C(Cc3ccccc3)Cc3ccccc3)n2N)s1,C20919402_decoy,TRY1,Decoy,0,-9.58953,-9.03,-1.85,-8.589257056296642
NC(=O)N[C@H](CC(=O)OCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(Cl)cc1,C20970427_decoy,TRY1,Decoy,0,-8.78242,-8.7,-1.84,-7.865579860707982
CCOc1cc(/C=N/Nc2nc(SCCC(=O)NC(c3ccccc3)c3ccccc3)n[nH]2)ccc1O,C21084078_decoy,TRY1,Decoy,0,-8.18897,-6.18,-3.98,-5.945344169639243
COc1cc(NC(=O)C2CCCC2)c(C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1OC,C21327695_decoy,TRY1,Decoy,0,-9.3186,-7.63,-1.8,-8.026623413865778
CCOC(=O)c1sc(N)c(C#N)c1CSc1nnc(-c2ccc(OC(F)F)cc2)n1N,C22871530_decoy,TRY1,Decoy,0,-7.94035,-7.39,-1.05,-5.831540898308441
Cc1ccc(S(=O)(=O)NCC(=O)OCc2nc(N)nc(Nc3ccc(F)cc3)n2)cc1C,C32384289_decoy,TRY1,Decoy,0,-8.64528,-6.81,-1.95,-7.011272644923588
CC(C)CC(=O)N(Cc1ccco1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36494683_decoy,TRY1,Decoy,0,-7.4986,-6.98,-2.29,-8.792220231702437
CCCC[C@H](CC)C(=O)N(Cc1ccco1)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36496369_decoy,TRY1,Decoy,0,-6.99789,-4.2,-1.87,-5.398706088130111
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccccc1Cl,C36505981_decoy,TRY1,Decoy,0,-7.04575,-5.57,-1.44,-5.797157422916701
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)Cc1ccccc1)c1ccccc1Cl,C36550131_decoy,TRY1,Decoy,0,-8.20125,-5.01,-1.05,-5.939690302987911
CCCCCC(=O)N(CCC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36575025_decoy,TRY1,Decoy,0,-9.0768,-7.29,-3.25,-7.084530062289077
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C,C36593525_decoy,TRY1,Decoy,0,-5.96796,-5.97,-4.75,-4.7883745467493934
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C,C36593526_decoy,TRY1,Decoy,0,-5.92083,-4.75,-1.83,-4.9513390475073775
CCCCN(C(=O)CCCc1nc2ccccc2c(=O)[nH]1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C15934800_decoy,TRY1,Decoy,0,-8.73121,-7.62,-2.76,-8.229570418477827
O=C(CCCCCCCC(=O)N/N=C1\C(=O)Nc2ccccc21)N/N=C1\C(=O)Nc2ccccc21,C01880474_decoy,TRY1,Decoy,0,-8.84389,-6.06,-4.36,-7.284976076555585
CCOc1ccc(N2C(SCC(=O)Nc3ccc(CC)cc3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362541_decoy,TRY1,Decoy,0,-9.58013,-7.83,-0.95,-7.657397259745372
NC(=O)c1c(Nc2nc(NCCCN3CCOCC3)nc3c2cnn3-c2ccccc2)sc2c1CCC2,C41026294_decoy,TRY1,Decoy,0,-9.23194,-7.35,-1.93,-7.685953004403099
CCCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)NC(N)=O)CCC3)cc1,C44452672_decoy,TRY1,Decoy,0,-9.81244,-7.7,-2.44,-7.670009057879223
CS(=O)(=O)Nc1ccc(/C=C/C(=O)NNC(=S)Nc2cc(C(F)(F)F)ccc2Cl)cc1,C46773456_decoy,TRY1,Decoy,0,-8.83888,-5.96,-2.43,-5.995502567564046
CCS(=O)(=O)[N-]c1cccc(N2CCC([NH2+]CCc3ccc(S(N)(=O)=O)cc3)CC2)c1,C55344645_decoy,TRY1,Decoy,0,-8.025,-6.53,-2.93,-5.701891630837737
CCCCn1c(N)c(N(C(=O)CN[C@H](C)c2ccccc2Cl)C2CCCC2)c(=O)[nH]c1=O,C15481855_decoy,TRY1,Decoy,0,-8.4882,-7.1,-1.32,-6.784426580839756
NC(=O)c1ccsc1NC(=O)COC(=O)c1ccccc1Nc1ccc(OC(F)F)cc1,C19484131_decoy,TRY1,Decoy,0,-9.35828,-7.06,-1.71,-8.151096512231776
Cc1cccc(NC(=O)NC(=O)CSc2nnc(CCC(N)=O)n2C[C@@H]2CCCO2)c1C,C23369365_decoy,TRY1,Decoy,0,-10.2998,-8.34,-5.19,-0.5621864518199993
CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3O)n2)sc2c1CCCC2,C58996996_decoy,TRY1,Decoy,0,-12.3458,-9.34,-4.81,-8.418144576156708
CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cc(OC)ccc4O)n3)cc2s1,C58998066_decoy,TRY1,Decoy,0,-10.71,-8.08,-2.75,-9.592517830384512
COc1ccc(Cl)cc1NC(=O)CSc1n[nH]c(N/N=C/c2cccc(OC)c2O)n1,C59016836_decoy,TRY1,Decoy,0,-9.35902,-7.45,-2.84,-6.793693936288978
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(OC)cc3)n[nH]2)c(O)c1,C59039033_decoy,TRY1,Decoy,0,-9.73016,-7.71,-3.85,-8.093799340348575
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(F)c3C)n[nH]2)c(O)c1,C59039138_decoy,TRY1,Decoy,0,-9.38243,-7.68,-2.51,-6.968228855794423
S=C(Nc1cccnc1)NC1CCC(CC2CCC(NC(=S)Nc3cccnc3)CC2)CC1,C34722319_decoy,TRY1,Decoy,0,-9.44973,-6.2,-3.52,-6.143797541183226
CCOc1ccc2nc(NC(=O)CSc3n[nH]c(N/N=C(\C)c4ccccc4O)n3)sc2c1,C59830722_decoy,TRY1,Decoy,0,-10.1373,-10.05,-3.55,-8.178663200758935
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)c(Br)c1,C59887734_decoy,TRY1,Decoy,0,-10.4731,-7.87,-3.69,-7.317843682683506
Cc1ccc(C(=O)N/C(=C/c2ccc(-c3ccc(Br)cc3)o2)C(=O)NCCC[NH+](C)C)cc1,C01823666_decoy,TRY1,Decoy,0,-8.92239,-7.02,-3.42,-6.018015904118025
Cc1sc(NC(=O)c2ccco2)c([C@H](Nc2cccc[nH+]2)c2ccc(C(F)(F)F)cc2)c1C,C08763396_decoy,TRY1,Decoy,0,-7.56828,-6.09,-0.81,-5.368317408075376
CC(C)CNS(=O)(=O)c1cc(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)c(Cl)cc1Cl,C09120188_decoy,TRY1,Decoy,0,-7.61351,-6.39,-4.61,-6.1129448586093975
COc1ccc([C@@H](CNC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)[NH+]2CCCCC2)cc1,C11658522_decoy,TRY1,Decoy,0,-10.3301,-7.95,-0.8,-8.955095250055745
COc1ccccc1CCNC(=O)Cc1ccc(N2CCC([NH2+][C@H](C)Cc3cncs3)CC2)cc1,C11970276_decoy,TRY1,Decoy,0,-10.9337,-6.73,-2.59,-7.139505274418884
CCc1ccc2[nH]c(=O)c(CN(CCC[NH+](CC)CC)C(=O)Nc3cccc(Cl)c3)cc2c1,C12706634_decoy,TRY1,Decoy,0,-9.85898,-6.91,-1.59,-6.63436609186726
CC[NH+]1CCC[C@@H]1CN(Cc1cc2cc(OC)ccc2[nH]c1=O)C(=O)Nc1cccc(Cl)c1,C12707776_decoy,TRY1,Decoy,0,-9.31345,-6.69,-2.39,-7.352251687951606
CN1CCc2cc([C@@H](CNC(=O)C(=O)Nc3ccc(C(F)(F)F)cc3)[NH+]3CCCCC3)ccc21,C13008019_decoy,TRY1,Decoy,0,-9.91764,-8.83,-1.96,-8.765251391205979
CCOC(=O)c1c(NC(=O)C[NH+]2CCC[C@@H](C)C2)sc(C(=O)Nc2ccc(C)cc2C)c1C,C13037943_decoy,TRY1,Decoy,0,-10.3334,-7.92,-2.33,-7.745506998556995
CCOC(=O)c1c(NC(=O)C[NH+]2CCCCCC2)sc(C(=O)Nc2ccc(C)cc2C)c1C,C13071355_decoy,TRY1,Decoy,0,-10.2739,-7.51,-2.83,-6.354282764345658
COc1cccc([C@@H](C[NH2+][C@@H](C)C(=O)N2CCc3ccccc32)c2c[nH]c3ccccc23)c1OC,C13120355_decoy,TRY1,Decoy,0,-7.11027,-7.12,-3.49,-5.923831578297149
O=C(NCc1cccc(C(F)(F)F)c1)[C@@H]1CC12CC[NH+](Cc1c[nH]nc1-c1ccccc1)CC2,C11789690_decoy,TRY1,Decoy,0,-7.55729,-5.55,-2.68,-5.76204779646046
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2,C14473569_decoy,TRY1,Decoy,0,-7.6517,-5.28,-3.61,-4.66996492205659
OC[C@@H]1CCCN(c2nc3cc4c(cc3cc2C[NH2+]Cc2ccccc2C(F)(F)F)OCO4)C1,C19789300_decoy,TRY1,Decoy,0,-10.2086,-8.36,-1.94,-8.64060334301198
C[C@H](C(=O)N[C@H](C)c1ccc(F)cc1)[NH+]1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1,C20795471_decoy,TRY1,Decoy,0,-7.53037,-7.57,-2.49,-5.776092081475292
C[C@H](NC(=O)[C@@H](C)[NH+]1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1)c1ccc(F)cc1,C20795476_decoy,TRY1,Decoy,0,-7.37378,-8.14,-2.3,-6.644174255788836
COc1cc(OC)c(NC(=O)C[NH+](C)CC(=O)Nc2ccccc2Br)cc1Cl,C23038679_decoy,TRY1,Decoy,0,-8.36681,-7.27,-2.87,-6.708564819122204
Cc1ccc(-c2[nH]c3ccccc3c2[C@H]2c3ccccc3C(=O)N2[C@@H](C)C(=O)NCC[NH+]2CCCC2)cc1,C27912066_decoy,TRY1,Decoy,0,-9.11293,-6.62,-4.73,-5.699266626933543
O=C(NC[C@@H]1CCCO1)c1ccccc1NC(=O)[C@H]1CCC[NH+](Cc2c(F)cccc2Cl)C1,C30942319_decoy,TRY1,Decoy,0,-8.99728,-8.23,-1.67,-7.164924832961516
COc1ccc2[nH]cc(CCNC(=O)c3ccccc3SC[C@H]3CCC[NH+]4CCCC[C@@H]34)c2c1,C33435703_decoy,TRY1,Decoy,0,-9.82849,-7.94,-1.87,-7.232501124249631
CCc1c(C)sc2nc(SCC(N)=O)nc(N3CC[NH+](Cc4cc(C)ccc4C)CC3)c12,C34762186_decoy,TRY1,Decoy,0,-9.38542,-6.11,-1.67,-6.140433904369124
CC(C)COC[C@@H](O)C[NH+](Cc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C1CCCCC1,C35745675_decoy,TRY1,Decoy,0,-9.33698,-7.87,-2.71,-8.59209158195496
Cc1ccccc1-c1csc2nc(C[NH+](C[C@@H](O)COC(C)C)C3CCCCC3)[nH]c(=O)c12,C35745828_decoy,TRY1,Decoy,0,-8.8968,-7.95,-1.77,-9.23094110247896
COc1cc([C@H]2[C@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(C)cc2)cc(OC)c1OC,C35806322_decoy,TRY1,Decoy,0,-9.61,-6.39,-3.52,-6.4696517087945065
O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NCC1([NH+]2CCCCC2)CCCCC1,C23978369_decoy,TRY1,Decoy,0,-9.895,-5.76,-0.54,-6.073950491537233
O=c1[nH]c(C[NH+](C[C@H](O)COCc2ccccc2)C2CCCCC2)nc2sc3c(c12)CCC3,C36159066_decoy,TRY1,Decoy,0,-9.18528,-6.0,-1.8,-6.380554443069022
CC(C)(C)OC[C@H](O)C[NH+](Cc1nc2scc(-c3ccccc3F)c2c(=O)[nH]1)C1CCCCC1,C36206264_decoy,TRY1,Decoy,0,-8.48702,-7.1,-1.74,-6.899163487368425
C#CCOC[C@@H](O)C[NH+](CCC(C)C)Cc1nc2scc(-c3ccc(C)cc3C)c2c(=O)[nH]1,C36207976_decoy,TRY1,Decoy,0,-9.83435,-7.0,-2.42,-7.424491484867237
CCC[NH+](CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C)[C@@H](C)c1ccccc1Br,C36393900_decoy,TRY1,Decoy,0,-8.37104,-6.68,-2.1,-6.163733333179859
CC(C)[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1ccccc1C[NH+]1CCCCC1,C36624979_decoy,TRY1,Decoy,0,-9.66312,-8.02,-2.31,-7.917763504346992
Cc1c(-c2ccc(O)cc2)nn(-c2ccc(O)cc2)c1-c1ccc(OCC[NH+]2CCCCC2)cc1,C03996033_decoy,TRY1,Decoy,0,-8.10489,-9.02,-1.64,-7.181923761264072
Cc1cccc(N[C@@H](c2ccc(C(F)(F)F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)[nH+]1,C38547622_decoy,TRY1,Decoy,0,-7.53116,-6.59,-2.95,-5.53939126162957
Cc1ccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCN(c3ccc(F)cc3)CC2)cc1F,C38597918_decoy,TRY1,Decoy,0,-7.77379,-8.07,-2.5,-5.958316223837478
CC[NH+](CC)[C@H](CNC(=O)[C@H](C)SCc1nc2sc(C)c(C)c2c(=O)[nH]1)c1ccccc1,C36692808_decoy,TRY1,Decoy,0,-10.343,-6.11,-3.39,-6.363211828911834
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39596445_decoy,TRY1,Decoy,0,-11.4624,-6.53,-1.41,-7.578596500194068
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NCCSCc3ccccc3)C3(CC[NH2+]CC3)C2)c1F,C39658513_decoy,TRY1,Decoy,0,-9.17668,-7.64,-0.88,-7.502553253587135
C[C@@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665390_decoy,TRY1,Decoy,0,-9.51582,-8.23,-2.28,-7.624873408692
Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3ccccc3C(F)(F)F)CC23CC[NH2+]CC3)cc1,C39665960_decoy,TRY1,Decoy,0,-9.10617,-8.29,-2.66,-8.929357570886227
O=C(NCCOc1cccc(F)c1)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39685463_decoy,TRY1,Decoy,0,-9.28236,-9.77,-2.23,-8.238100380727479
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NCCSC(C)(C)C)C2(CC[NH2+]CC2)C1,C39696554_decoy,TRY1,Decoy,0,-9.79045,-5.88,-2.97,-6.449795763085268
O=C(NC[C@@H]1CCCO1)c1ccccc1NC(=O)C1CC[NH+](Cc2c(F)cccc2Cl)CC1,C39757450_decoy,TRY1,Decoy,0,-8.26742,-6.87,-2.99,-6.340258914936111
Cc1ccc(-c2csc3nc(C[NH+](CC(C)C)C[C@@H](O)COCC(C)C)[nH]c(=O)c23)c(C)c1,C35746373_decoy,TRY1,Decoy,0,-9.47519,-7.3,-3.33,-7.942099922051976
COc1ccccc1[C@@H](Nc1cc(C)cc[nH+]1)c1c(NC(=O)c2ccco2)sc2c1CCCC2,C38551057_decoy,TRY1,Decoy,0,-7.65283,-7.18,-2.36,-7.499951237393845
COc1cc2cc(CNc3ccc(N4CCCCC4)cc3[NH+]3CCCCC3)c(=O)[nH]c2cc1OC,C57709858_decoy,TRY1,Decoy,0,-8.98006,-7.69,-3.07,-5.959143538929508
COc1ccc(-c2nn(-c3ccccc3)c3[nH]c(=O)c(C[NH2+]Cc4ccc(Cl)cc4)cc23)cc1,C57720887_decoy,TRY1,Decoy,0,-7.31912,-8.84,-3.5,-8.15506162238614
O=C(NC(=S)Nc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(-c2cc(Cl)ccc2Cl)o1,C22746215_decoy,TRY1,Decoy,0,-11.1466,-6.12,-3.51,-7.4636477655058515
Cc1cc(C[NH+](C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc(C)c1OCC(F)(F)F,C59577971_decoy,TRY1,Decoy,0,-7.75092,-8.39,-1.57,-6.694202212058436
COc1ccc(/C=N/NC(=O)CC2=c3ccccc3=[NH+]C2)cc1CS[C@@H]1Nc2ccccc2O1,C63406127_decoy,TRY1,Decoy,0,-8.3895,-7.95,-0.83,-6.520668303871895
CCOc1ccc2c(c1)S[C@@H](NC(=O)[C@@H]1CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C1)N2,C63557343_decoy,TRY1,Decoy,0,-9.27483,-8.13,-3.0,-6.2361836576669205
O=C(NCCC1=c2ccccc2=[NH+]C1)/C(=C\c1cccnc1)NC(=O)c1cccc(Br)c1,C65361771_decoy,TRY1,Decoy,0,-8.33714,-5.95,-4.35,-5.8490094868579865
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C/C(Cl)=C/c1ccc([N+](=O)[O-])cc1)n2C[C@H](O)CO,C02317272_decoy,TRY1,Decoy,0,-8.78632,-6.06,-3.39,-6.765800834606362
CC(C)(CO)NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3[C@H](O)C[C@@]21C,C08876371_decoy,TRY1,Decoy,0,-8.88402,-7.15,-3.22,-6.19076412012836
COc1cc(C(=O)Nc2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(=O)n2)cc(OC)c1OC,C08918280_decoy,TRY1,Decoy,0,-7.58221,-7.45,-2.87,-5.629746573508747
CS(=O)(=O)NCCCCCC(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C09244427_decoy,TRY1,Decoy,0,-11.0264,-5.83,-2.24,-7.241790902932626
Cc1ccccc1OC[C@H](O)Cn1c(SC[C@H](O)CO)nc2c1c(=O)[nH]c(=O)n2C,C09363720_decoy,TRY1,Decoy,0,-8.52459,-6.4,-2.06,-8.437239400015276
NC(=O)c1ccsc1NC(=O)COC(=O)CCNC1=NS(=O)(=O)c2ccccc21,C09389913_decoy,TRY1,Decoy,0,-8.82988,-7.38,-0.72,-6.59823101222112
CC(C)CN(C(=O)CCC(=O)OCC(=O)c1ccc[nH]1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C09544798_decoy,TRY1,Decoy,0,-7.44868,-5.55,-3.04,-5.255360449167475
COCCn1c(N)c(C(=O)CSc2nnc(Nc3cccc(F)c3)s2)c(=O)[nH]c1=O,C11016626_decoy,TRY1,Decoy,0,-9.96909,-6.13,-3.15,-6.023450462490521
CCCCn1c(N)c(N(C(=O)CSc2nnc(C3CC3)[nH]2)C2CCCC2)c(=O)[nH]c1=O,C11571573_decoy,TRY1,Decoy,0,-9.82204,-5.42,-3.32,-7.575365411222938
Cc1cccn2c(=O)c(/C=N/Nc3ncnc([N+](=O)[O-])c3N)c(NCc3ccco3)nc12,C12779140_decoy,TRY1,Decoy,0,-7.9771,-7.71,-1.48,-7.028720179430594
CCC1(CC)NC(=O)N(CC(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)C1=O,C13063455_decoy,TRY1,Decoy,0,-9.31057,-7.32,-4.3,-8.197611111141123
Cn1c(N)c(C(=O)COC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(=O)n(C)c1=O,C13129513_decoy,TRY1,Decoy,0,-6.79693,-8.26,-2.27,-6.23065208337828
Cn1c(=O)[nH]c(=O)c2c1nc(N/N=C\c1ccccc1O)n2C[C@H](O)COc1ccccc1,C05295379_decoy,TRY1,Decoy,0,-8.78132,-7.27,-3.41,-9.014422067349644
Cc1cc[nH+]c(NCCCC(=O)NCC(=O)N[C@@H](CC(=O)[O-])c2cccc(OC(F)(F)F)c2)c1,C13472616_decoy,TRY1,Decoy,0,-7.3179,-6.86,-2.76,-6.270056507790796
C[C@H](NC(=O)CSc1nnc(NCc2ccco2)s1)c1ccc(S(N)(=O)=O)cc1,C14162829_decoy,TRY1,Decoy,0,-8.64544,-6.37,-2.79,-6.446128377965458
COc1cc(C(=O)Nc2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c(=O)n2)cc(OC)c1OC,C15954677_decoy,TRY1,Decoy,0,-8.32079,-6.65,-3.06,-5.6006173146091935
COc1cc(CNS(=O)(=O)c2ccc(NC=C3C(=O)NC(=O)NC3=O)cc2)nc(OC)n1,C16215082_decoy,TRY1,Decoy,0,-7.40407,-7.57,-1.88,-6.545679727520899
C[C@H](OC(=O)CNS(=O)(=O)/C=C/c1ccccc1)C(=O)Nc1sccc1C(N)=O,C16771159_decoy,TRY1,Decoy,0,-7.43398,-7.15,-2.8,-8.410224135854218
C[C@H](OC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)C(=O)Nc1sccc1C(N)=O,C16793536_decoy,TRY1,Decoy,0,-9.65774,-8.33,-2.99,-6.983109604779117
CC1(C)NC(=O)N(C[C@@H](O)CN2CCN(C[C@H](O)CN3C(=O)NC(C)(C)C3=O)CC2)C1=O,C19882305_decoy,TRY1,Decoy,0,-7.67059,-6.31,-3.4,-5.905470983689456
NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)cc1,C20583703_decoy,TRY1,Decoy,0,-8.1911,-7.5,-2.5,-5.982760047579966
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]1,C20905223_decoy,TRY1,Decoy,0,-8.61077,-5.71,-1.32,-5.879058055525107
C/C(=N\Nc1nc(SCC(=O)NNC(=O)c2ccc(Cl)cc2)n[nH]1)c1ccncc1,C20923638_decoy,TRY1,Decoy,0,-8.91789,-6.9,-4.63,-6.451177497102284
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)C[C@@H](NC(N)=O)c2ccc(Cl)cc2)c1C,C21178076_decoy,TRY1,Decoy,0,-9.2955,-7.31,-2.37,-6.993175572395108
COC(=O)C(C(=O)CSc1nnc(SCC(N)=O)s1)=C1Nc2ccccc2N1,C22533609_decoy,TRY1,Decoy,0,-9.16331,-7.09,-2.24,-6.779771839818203
O=C(C[C@@H]([NH2+]Cc1ccco1)C(=O)[O-])Nc1ccc(S(=O)(=O)/N=c2\[nH]ccs2)cc1,C16778898_decoy,TRY1,Decoy,0,-6.67385,-6.58,-2.54,-4.972544893743586
Cc1ccc(SC[C@@H](CSCCO)OCn2cnc3c2NC(N)=NC32OCCO2)cc1,C17254918_decoy,TRY1,Decoy,0,-10.2559,-6.78,-2.87,-6.871043324279112
CCn1c(COc2ccc(C(C)(C)C)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594298_decoy,TRY1,Decoy,0,-6.65322,-5.64,-3.1,-4.608986438160911
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1n1nc(COc2ccccc2C)n(C2CCCC2)c1=S,C32594359_decoy,TRY1,Decoy,0,-7.13681,-6.25,-3.56,-4.998367515336442
CC1(C)NC(=O)N(C[C@H](O)CN2CCN(C[C@H](O)CN3C(=O)NC(C)(C)C3=O)CC2)C1=O,C22924043_decoy,TRY1,Decoy,0,-8.40625,-5.79,-2.37,-7.425329815769616
Cc1[nH]c(=O)[nH]c(=O)c1CSCC(=O)OCC(=O)N[C@@H]1NC2=C(CC(C)(C)CC2=O)S1,C39699112_decoy,TRY1,Decoy,0,-9.8644,-6.23,-3.76,-6.011190258765022
COc1ccccc1OCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)nc2ccccc21,C39915980_decoy,TRY1,Decoy,0,-6.18423,-7.84,-1.78,-6.750359354507064
COc1ccccc1OCCn1c(S[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)nc2ccccc21,C39915981_decoy,TRY1,Decoy,0,-7.33875,-7.85,-1.56,-8.103299403958221
COc1ccccc1OCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39915982_decoy,TRY1,Decoy,0,-6.08963,-7.94,-3.05,-5.905056035118403
COc1ccccc1OCCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)nc2ccccc21,C39916024_decoy,TRY1,Decoy,0,-8.14003,-6.61,-2.62,-6.926341820903915
O=C(COC(=O)CSCc1c[nH]c(=O)[nH]c1=O)N[C@@H]1N[C@H](c2ccccc2)CS1,C39960451_decoy,TRY1,Decoy,0,-9.45936,-7.08,-2.43,-7.771688600600351
O=C(COC(=O)CSCc1c[nH]c(=O)[nH]c1=O)N[C@@H]1N[C@@H](c2ccccc2)CS1,C39960452_decoy,TRY1,Decoy,0,-7.52944,-7.32,-1.62,-6.420332953692394
C[NH2+]CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CC(=O)[O-])(C(=O)[O-])[NH2+][C@H]2c1cccc(OC(F)(F)F)c1,C43218450_decoy,TRY1,Decoy,0,-6.72047,-6.93,-2.93,-5.781791465938448
CC(C)OC[C@H](O)Cn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(=O)[nH]c(=O)n2C,C08995110_decoy,TRY1,Decoy,0,-9.16363,-7.06,-3.81,-8.04405805585938
COCCn1c(N)c(C(=O)CSc2nnc(NC3CCCCC3)s2)c(=O)[nH]c1=O,C10580156_decoy,TRY1,Decoy,0,-7.87544,-6.26,-1.78,-5.7971766855423645
Cc1cc(NC(=O)CSCC(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)no1,C27984125_decoy,TRY1,Decoy,0,-8.53852,-7.15,-4.45,-6.22751717388208
Cc1sc2nc([C@@H](C)Sc3nnc(CCC(N)=O)n3C[C@@H]3CCCO3)nc(N)c2c1C,C58597742_decoy,TRY1,Decoy,0,-11.2879,-7.4,-2.67,-8.804412687053773
COc1cc(/C=N/NC(=O)CCCSc2nnc(-c3ccncc3)n2N)c([N+](=O)[O-])cc1O,C58992146_decoy,TRY1,Decoy,0,-9.10033,-7.31,-2.49,-7.081504802184978
COc1cc(/C=N/Nc2nc(SCC(=O)Nc3nc(C)cs3)n[nH]2)c([N+](=O)[O-])cc1O,C59040051_decoy,TRY1,Decoy,0,-9.79628,-8.56,-2.98,-8.452441188932369
COc1ccc(/C=N/Nc2n[nH]c(SCC(=O)NNC(=O)C(C)(C)C)n2)cc1OC,C20832246_decoy,TRY1,Decoy,0,-9.6612,-5.78,-3.02,-6.465976590540853
C=CCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3OCC)n2N)cn1,C59830095_decoy,TRY1,Decoy,0,-8.92489,-7.73,-1.93,-6.968872201269266
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)cc1C,C59887712_decoy,TRY1,Decoy,0,-9.74615,-8.56,-3.44,-7.627338440951566
Cc1cc(F)ccc1NC(=O)CSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59887975_decoy,TRY1,Decoy,0,-9.89129,-7.84,-3.53,-7.395532496645167
Cc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(CCO)c3C)n2)s1,C59888350_decoy,TRY1,Decoy,0,-10.0326,-8.34,-2.0,-7.273569252199245
CCNC(=O)NC(=O)[C@H](C)Sc1nnc(S[C@H](C)C(=O)NC(=O)NCC)s1,C10798437_decoy,TRY1,Decoy,0,-10.3666,-7.45,-3.7,-8.87431129871098
C[NH2+][C@@H](CC(C)C)C(=O)N[C@H]1C[C@@](O)(C(=O)N[C@@H](C(=O)OC)C(C)C)C[C@@H](O)[C@@H]1O,C03838502_decoy,TRY1,Decoy,0,-9.07153,-5.83,-3.22,-6.124349906735447
CC[C@@]1(O)C[C@H](O[C@@H]2C[C@H]([NH+](C)C)[C@H](O)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1C(=O)OC,C04293360_decoy,TRY1,Decoy,0,-6.89556,-5.26,-3.24,-5.23425348704775
C[C@H](O)[C@@H]([NH3+])C(=O)NCCc1nc(-c2nc(C(=O)NCCCBr)cs2)cs1,C01572158_decoy,TRY1,Decoy,0,-11.1081,-5.1,-3.14,-6.952348097854141
C[NH+](Cc1c(C(=O)N/N=C/c2ccccc2O)nnn1-c1nonc1N)C1CCCCC1,C01854023_decoy,TRY1,Decoy,0,-8.45728,-8.84,-1.78,-11.351029852939853
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(O)[nH]c(=O)n(Cc3ccc(OC)cc3)c2=O)[NH2+]1,C08764234_decoy,TRY1,Decoy,0,-8.44417,-7.67,-1.27,-6.033497574271834
Cc1cc(Cl)c2c(c1)[C@]1([NH2+][C@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791309_decoy,TRY1,Decoy,0,-8.02783,-5.67,-0.98,-6.96802717014146
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)ccc1O,C01745260_decoy,TRY1,Decoy,0,-9.00271,-6.34,-1.83,-7.213426960865896
Nc1nonc1-n1nnc(C(=O)N/N=C/c2cc(Cl)ccc2O)c1C[NH+]1CCOCC1,C01794155_decoy,TRY1,Decoy,0,-8.67557,-5.89,-2.59,-5.6163793262934325
CC1(C)Cc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCOCC4)cc3)c2C(N)=O)C(C)(C)[NH2+]1,C04177863_decoy,TRY1,Decoy,0,-8.14174,-6.29,-3.33,-5.319483840148838
COc1cccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)c1O,C01879865_decoy,TRY1,Decoy,0,-8.4971,-5.69,-2.9,-6.307923674155411
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3Cl)C(=O)[C@H]21,C02127070_decoy,TRY1,Decoy,0,-8.54781,-6.93,-1.18,-6.29677123429207
CC(C)c1ccc(N2C(=O)N=C(O)[C@H](/C=[NH+]/[C@H]3[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]3O)C2=O)cc1,C13297965_decoy,TRY1,Decoy,0,-8.4334,-8.51,-2.9,-6.233799531046758
C[C@H](NC(=O)[C@@H]1C=CC2(CC[NH2+]CC2)n2c(=O)n(Cc3ccc4c(c3)OCO4)c(=O)n21)C(N)=O,C13559911_decoy,TRY1,Decoy,0,-7.96645,-6.87,-3.12,-5.713865406534952
NC(=O)C1CC[NH+](CCOc2ccc(-c3n[nH]cc3-c3ccc(Cl)cc3)c(O)c2)CC1,C09410511_decoy,TRY1,Decoy,0,-8.39812,-7.25,-2.18,-5.642148670326022
CCOc1ccccc1-n1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c1=O,C09013976_decoy,TRY1,Decoy,0,-7.86225,-7.05,-1.72,-5.981807532362976
Cn1c(=O)c2c(nc(N3CCOCC3)n2CCC[NH2+]C[C@H](O)c2cc(O)cc(O)c2)n(C)c1=O,C17107040_decoy,TRY1,Decoy,0,-8.87609,-7.61,-1.6,-8.029094962502157
COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C09329483_decoy,TRY1,Decoy,0,-6.80734,-5.58,-3.35,-5.313897794983733
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC(=O)Nc1ccc(OC(F)(F)F)cc1,C20465316_decoy,TRY1,Decoy,0,-7.58685,-6.82,-2.0,-5.675155700100946
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCCN3CCOCC3)C[NH+]12)NC1CC1,C15708344_decoy,TRY1,Decoy,0,-9.36009,-5.42,-1.34,-6.968780418158619
Nc1[nH]c(=O)[nH]c(=O)c1[C@@H](c1cccc(C(F)(F)F)c1)N1CCN(c2cccc[nH+]2)CC1,C23865295_decoy,TRY1,Decoy,0,-6.91305,-6.17,-3.42,-5.0113118422874265
Nc1nonc1-n1nnc(C[NH+]2CCCC2)c1C(=O)N/N=C/c1cc(Cl)ccc1O,C02242821_decoy,TRY1,Decoy,0,-9.15553,-6.48,-2.18,-6.278053445310318
COc1ccc(/C=N/NC(=O)c2c(C[NH+]3CCCCC3)nnn2-c2nonc2N)cc1O,C02242880_decoy,TRY1,Decoy,0,-9.19915,-5.95,-1.38,-7.56202774805103
COc1cccc(/C=N/NC(=O)c2c(C[NH+]3CCCCC3)nnn2-c2nonc2N)c1O,C02520774_decoy,TRY1,Decoy,0,-8.23883,-6.81,-1.48,-6.543196146683168
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2cc(Cl)ccc2O)nnn1-c1nonc1N,C01959519_decoy,TRY1,Decoy,0,-9.12742,-7.79,-3.1,-7.617952851581939
COCC[NH+](Cc1nc(N)nc(Nc2ccccc2C)n1)Cc1nc2ccccc2c(=O)[nH]1,C32664978_decoy,TRY1,Decoy,0,-8.25066,-5.74,-4.29,-5.244539723837142
CC[C@@H](C)[C@H](NC(=O)CCCCC[NH3+])C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C33498039_decoy,TRY1,Decoy,0,-10.609,-6.41,-4.6,-7.9410414290545
COc1ccccc1Nc1nc(NC[C@H](c2ccco2)[NH+]2CCCC2)nc(N)c1[N+](=O)[O-],C35681903_decoy,TRY1,Decoy,0,-7.29269,-7.41,-2.1,-7.69046399749415
CC[C@@H](C)[C@@H](NC(=O)C1=C(O)Nc2ccccc2N1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C36569255_decoy,TRY1,Decoy,0,-8.26341,-8.19,-1.12,-8.86830218154459
C[NH+](Cc1c(C(=O)N/N=C/c2cccc(O)c2)nnn1-c1nonc1N)C1CCCCC1,C02596317_decoy,TRY1,Decoy,0,-9.68206,-9.01,-1.37,-8.468561280202684
Nc1nonc1-n1nnc(C(=O)NNC2=c3cc(Cl)ccc3=[NH+]C2=O)c1CN1CCCc2ccccc21,C02387962_decoy,TRY1,Decoy,0,-9.90134,-7.91,-3.55,-9.566303585623638
COCc1cc(C)nc2c1[C@H]([NH3+])[C@@H](C(=O)Nc1nc3ccc(NC(C)=O)cc3s1)S2,C39272629_decoy,TRY1,Decoy,0,-8.56076,-6.02,-1.69,-5.29139115722638
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39661918_decoy,TRY1,Decoy,0,-10.3826,-6.85,-2.26,-7.626561030398218
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)NN1C,C39674121_decoy,TRY1,Decoy,0,-7.47589,-6.75,-2.16,-5.417028769670815
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C=C(C(=O)CO)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@H](O)[C@@H](C)O1,C40741425_decoy,TRY1,Decoy,0,-6.44917,-7.94,-1.22,-5.011966144450128
Nc1nccc(Oc2ccc(NC(=O)NC(=O)Cc3ccc(F)cc3)cc2F)c1C#CC[NH3+],C40979989_decoy,TRY1,Decoy,0,-10.3716,-6.6,-2.42,-6.696811396671363
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)nc(OC[C@@H]([NH3+])Cc3ccccc3)cc21,C49088230_decoy,TRY1,Decoy,0,-9.90623,-8.72,-2.94,-8.92208482702363
C[NH+]1CCN(c2ccc(Nc3ncc(Cl)c(Nc4cccnc4C(N)=O)n3)cc2)CC1,C52565717_decoy,TRY1,Decoy,0,-8.39875,-8.06,-1.72,-9.54338609150704
COc1ccccc1[C@H]1[NH+]=C(NCCc2c[nH]c3ccccc23)N[C@@H]2N[C@@H](C)CC(=O)N21,C39357294_decoy,TRY1,Decoy,0,-8.38319,-7.13,-3.41,-5.360822039874518
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3cc(O)ccc3cc2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1,C59170717_decoy,TRY1,Decoy,0,-8.2107,-7.42,-1.51,-5.794189121895361
Cc1cc(C)cc(NC(=S)N/C(=N/c2nc(C)cc(C)n2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)c1,C14161161_decoy,TRY1,Decoy,0,-8.4313,-6.43,-2.98,-6.361957913477699
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1N[NH+]=C(N2CCOCC2)N1c1cccc(F)c1,C39938531_decoy,TRY1,Decoy,0,-11.3322,-6.97,-2.38,-7.1571993861750185
CC1=C(C[NH2+]CCCc2n[nH]c(N)c2C#N)[C@H](Oc2ccc(F)cc2)N(c2ccccc2)N1,C39939950_decoy,TRY1,Decoy,0,-8.45845,-7.87,-0.92,-8.070410316604377
Cc1ccc2c(c1)=C(CCNC(=O)CC[C@@H]1NN[C@H](C(=O)Nc3ccccc3)S1)C[NH+]=2,C63686262_decoy,TRY1,Decoy,0,-8.82602,-8.27,-2.95,-7.140072758531256
CC(C)[NH+](C[C@@H](O)COc1cccc2[nH]ccc12)C[C@@H](O)COc1cccc2[nH]ccc12,C65743331_decoy,TRY1,Decoy,0,-7.50865,-7.87,-1.94,-10.276361898292585
CC[C@@]1(O)C[C@@H](O[C@@H]2C[C@H]([NH+](C)C)[C@H](O)[C@@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1C(=O)OC,C03978067_decoy,TRY1,Decoy,0,-8.26256,-7.36,-2.39,-6.323149549948963
CC[C@@]1(O)C[C@H](O[C@H]2C[C@H]([NH+](C)C)[C@H](O)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)[C@H]1C(=O)OC,C04165387_decoy,TRY1,Decoy,0,-6.79546,-6.98,-2.64,-6.471233126308612
CC[NH+]1CCc2c(sc(NC(=S)NC(=O)c3c(Cl)cnn3C)c2C(N)=O)C1,C02750573_decoy,TRY1,Decoy,0,-8.54636,-6.32,-3.68,-5.230559442238923
CCN(CC)c1ccc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCCC2)c(O)c1,C08809777_decoy,TRY1,Decoy,0,-9.28681,-5.16,-3.21,-6.536789709408003
CCCN1C(=O)NC(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@@H]2C[NH+](CC)CCN32)C1=O,C09253723_decoy,TRY1,Decoy,0,-9.403,-6.91,-2.02,-5.654797709771214
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)cc(OC)c1O,C01899259_decoy,TRY1,Decoy,0,-8.43204,-7.69,-3.26,-6.7633568690698045
NC(=O)CC[C@@H]1[NH2+][C@@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]12,C12884778_decoy,TRY1,Decoy,0,-8.05722,-5.48,-2.52,-5.072951762411761
Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccc(O)cc2O)c1C[NH+]1CCCCC1,C15162535_decoy,TRY1,Decoy,0,-8.84357,-7.31,-2.39,-6.180346195583603
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2CC(N)=O)C(=O)Nc2ccccc21,C09312779_decoy,TRY1,Decoy,0,-7.18562,-5.99,-2.85,-4.85210660643008
C[NH+]1CCN(Cc2c(C(=O)N/N=C/c3ccc(O)cc3O)nnn2-c2nonc2N)CC1,C19367271_decoy,TRY1,Decoy,0,-9.86023,-8.97,-2.96,-8.43847140159789
COc1cc(/C=N/NC(=O)c2c(C[NH+]3CCCC3)nnn2-c2nonc2N)cc(OC)c1O,C19927026_decoy,TRY1,Decoy,0,-8.62904,-6.63,-1.94,-6.3850358878576605
COc1cccc(/C=N/NC(=O)c2c(C[NH+]3CCCC3)nnn2-c2nonc2N)c1O,C19927199_decoy,TRY1,Decoy,0,-8.42871,-6.59,-3.21,-6.188385509898671
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2cccc(O)c2)nnn1-c1nonc1N,C03633013_decoy,TRY1,Decoy,0,-9.14408,-7.33,-2.1,-9.856775481989658
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C2CCCCC2)cc(OC)c1O,C01875385_decoy,TRY1,Decoy,0,-9.97558,-8.86,-2.0,-13.2661285568691
CC1(C)Cc2c(sc3nc(SCC(N)=O)nc(N4CC[NH+](CC(N)=O)CC4)c23)CO1,C34750161_decoy,TRY1,Decoy,0,-9.57456,-6.15,-0.87,-5.662658985008672
COc1ccccc1[C@@H](CNc1nc(N)c([N+](=O)[O-])c(NC[C@@H]2CCCO2)n1)[NH+](C)C,C35681909_decoy,TRY1,Decoy,0,-7.32679,-6.61,-0.74,-7.261735225442075
COc1cc2nc(N3CC[NH+](C)CC3)nc(N/N=C3/CCCc4[nH]c(=O)c(C(N)=O)cc43)c2cc1OC,C35958754_decoy,TRY1,Decoy,0,-9.48344,-8.33,-1.52,-7.438777721884667
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C36369754_decoy,TRY1,Decoy,0,-8.753,-7.4,-1.15,-7.555901101886039
C[NH+](Cc1c(C(=O)N/N=C/c2ccc(O)cc2)nnn1-c1nonc1N)C1CCCCC1,C02604895_decoy,TRY1,Decoy,0,-8.86433,-6.53,-1.45,-6.9048690011179135
NC(=O)c1ccccc1NC[C@H]1[C@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)N=NN1c1nonc1N,C38688943_decoy,TRY1,Decoy,0,-8.81195,-9.65,-1.25,-8.163216219235181
COc1ccc2c(CCNC(=O)CS[C@@H]3N[NH2+]NN3c3cccc(C)c3)c[nH]c2c1,C39024436_decoy,TRY1,Decoy,0,-9.34755,-8.62,-1.5,-8.003814584599121
O=C(CN1N[C@H](c2ccc3c(c2)OCO3)N[NH2+]1)N/N=C/[C@H]1C=NN=C1c1ccc(F)cc1,C39210932_decoy,TRY1,Decoy,0,-8.86837,-8.75,-2.02,-8.461910925345402
CCN1NC(C)=C(Br)[C@@H]1C(=O)N1C[C@H](C(=O)NCc2cc3ccccc3[nH]2)C2(CC[NH2+]CC2)C1,C39671541_decoy,TRY1,Decoy,0,-9.13606,-6.28,-1.75,-5.736217961482439
Cc1ccc(C(=O)NNc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2[N+](=O)[O-])cc1,C40645213_decoy,TRY1,Decoy,0,-8.24934,-6.49,-1.73,-6.45886557455082
Cc1ccccc1C(=O)NNc1ncnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1[N+](=O)[O-],C40645215_decoy,TRY1,Decoy,0,-7.88472,-6.07,-3.02,-5.322362807097205
CC1(C)CC(Nc2ncnc(NNC(=O)Cc3ccc([N+](=O)[O-])cc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645235_decoy,TRY1,Decoy,0,-6.83315,-6.73,-3.37,-5.296674254380174
CC(=O)Nc1ccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2[N+](=O)[O-])cc1,C40645257_decoy,TRY1,Decoy,0,-8.11682,-5.8,-3.86,-5.7954994469621886
CCOc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccccc1F,C40744412_decoy,TRY1,Decoy,0,-7.45944,-7.76,-2.1,-7.619830722923043
CC1(C)CC(Nc2ncnc(NNC(=O)COc3ccc(Cl)cc3Cl)c2N)CC(C)(C)[NH2+]1,C40760842_decoy,TRY1,Decoy,0,-7.50507,-7.57,-2.78,-5.79078308418274
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OCC[C@@H]([NH3+])Cc3ccccc3)c21,C40972249_decoy,TRY1,Decoy,0,-9.53534,-7.84,-3.95,-7.496426997011951
OCC[NH2+]CCNc1nc(Nc2cccc3cccnc23)c2cnn(-c3ccccc3)c2n1,C41333444_decoy,TRY1,Decoy,0,-8.95346,-6.8,-1.24,-7.051228845658248
Nc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@@](O)(=S)O[C@H]3[C@H]2OC(=O)NCCCCCC[NH3+])c(=O)[nH]1,C42854039_decoy,TRY1,Decoy,0,-8.29853,-6.71,-3.83,-6.537527769894992
COc1ccc(Br)cc1[C@H]1[NH2+][C@@](CCCC[NH3+])(C(=O)[O-])[C@@H]2C(=O)N(C)C(=O)[C@@H]12,C43209329_decoy,TRY1,Decoy,0,-8.58789,-7.4,-1.67,-11.014205984250548
C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)N[C@@H](CCCC(N)=[NH2+])C(=O)OC)CC[C@@]4(C)[C@H]3CC[C@]21C,C43736967_decoy,TRY1,Decoy,0,-10.4471,-8.51,-2.18,-12.247195042171246
CCNc1nc(-c2ccoc2)c(-c2cnc3[nH]nc(C)c3n2)cc1OC[C@@H]([NH3+])Cc1ccccc1,C45349847_decoy,TRY1,Decoy,0,-8.85337,-7.44,-3.2,-7.407569297106792
COc1ccc(/N=C2\N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C20504126_decoy,TRY1,Decoy,0,-9.1466,-5.82,-1.6,-6.360083429536839
CN(C)c1ccc(/N=C2\N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NCC[NH+]4CCOCC4)[C@H]3S2)cc1,C20504129_decoy,TRY1,Decoy,0,-9.67429,-6.39,-2.49,-6.653477279493029
Cc1cc(C)cc(NCc2ccc3[nH+]c(NC[C@@H](O)CO)n(Cc4[nH+]c(C)ccc4[O-])c3c2)c1,C29134122_decoy,TRY1,Decoy,0,-8.81678,-7.01,-2.39,-6.114717024065204
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCC(C)CC2)cc(OC)c1O,C51331028_decoy,TRY1,Decoy,0,-9.1429,-6.47,-2.91,-6.237900705188264
COc1cc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)cc(OC)c1,C14156526_decoy,TRY1,Decoy,0,-9.61778,-7.5,-2.03,-9.580095625098448
Nc1nc2c(nc(NNC3=c4ccccc4=[NH+]C3=O)n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C13425105_decoy,TRY1,Decoy,0,-6.90083,-9.25,-2.44,-7.216488127051422
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C1CC1,C39935432_decoy,TRY1,Decoy,0,-8.11393,-8.15,-1.61,-7.747795852374246
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1nc(N)nc(Nc2ccccc2)n1,C64352902_decoy,TRY1,Decoy,0,-9.48527,-8.6,-1.49,-7.866932224834052
Cc1ccc(Nc2nc(N)nc(CN3C(=O)N[C@H](CC4=c5ccccc5=[NH+]C4)C3=O)n2)cc1,C64697975_decoy,TRY1,Decoy,0,-8.27859,-9.36,-1.15,-10.88385506631604
COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1c(O)[nH]c(=O)[nH]c1=O,C02131723_decoy,TRY1,Decoy,0,-6.95197,-6.45,-0.71,-4.868200500040438
C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(O)=C(C(N)=O)C(=O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@@H]21,C04019706_decoy,TRY1,Decoy,0,-7.96294,-5.66,-2.13,-4.531237146031681
O[C@@H](C[NH2+]C1CCCCC1)CSC[C@@H](O)C[NH2+]C1CCCCC1,C04989801_decoy,TRY1,Decoy,0,-10.2361,-6.32,-1.66,-7.719217286649909
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(O)[nH]c(=O)[nH]c2=O)[NH2+]1,C08764281_decoy,TRY1,Decoy,0,-6.88245,-6.1,-2.75,-3.8230259430843008
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@H]12,C11592620_decoy,TRY1,Decoy,0,-7.63765,-7.73,-2.58,-5.104053180300524
O[C@H](C[NH2+]C1CCCCC1)CSC[C@@H](O)C[NH2+]C1CCCCC1,C12343521_decoy,TRY1,Decoy,0,-10.1341,-6.45,-1.79,-8.043787322744512
CC[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(O)[nH]c(=S)[nH]c2=O)[NH2+]1,C12897100_decoy,TRY1,Decoy,0,-8.25089,-5.21,0.12,-4.595951121113621
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@]2(O)C(O)=C3C(=O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@@H]3C[C@H]12,C09211000_decoy,TRY1,Decoy,0,-9.10187,-7.2,-2.6,-5.032921843919322
[NH3+][C@@H](Cc1ccc(O)cc1)c1nc2ccccc2n1C[C@H](O)CO,C19734746_decoy,TRY1,Decoy,0,-7.34664,-7.3,-3.66,-8.238987575704762
COc1cccc([C@H]2c3c([nH][nH+]c3C)Nc3[nH]c(=O)[nH]c(=O)c32)c1O,C31809860_decoy,TRY1,Decoy,0,-6.47679,-5.93,-0.31,-3.8045976311137646
Cc1cc(N)[n+](/C(NC2CC(C)(C)[NH2+]C(C)(C)C2)=[NH+]\C2CC2)s1,C35739834_decoy,TRY1,Decoy,0,-7.35956,-4.45,-1.67,-4.645333097075111
NC(=O)CCCNc1c(N)c[nH+]c2ccc(Br)cc12,C37658465_decoy,TRY1,Decoy,0,-7.36455,-7.19,-0.62,-7.049946705838678
C[C@@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2ccc([C@@H](C)O)cc2)o1,C38246114_decoy,TRY1,Decoy,0,-8.66946,-6.09,-1.75,-5.815997526396386
C=C(C)CS[C@@H]1NN[C@@H]([C@@H]([NH3+])Cc2c[nH]c3ccccc23)O1,C38965153_decoy,TRY1,Decoy,0,-7.7725,-5.59,-1.84,-5.504695245436971
Nc1ccc2c(c1)=N[C@H](c1ccccc1[C@H]1N=c3cc(N)ccc3=[NH+]1)[NH+]=2,C39698143_decoy,TRY1,Decoy,0,-7.37128,-9.1,-1.1,-10.064329811416629
Nc1ccc2c(c1)=N[C@@H](c1cccc([C@@H]3N=c4cc(N)ccc4=[NH+]3)c1)[NH+]=2,C39709527_decoy,TRY1,Decoy,0,-8.77908,-9.9,-0.95,-7.827308284744839
CC(C)[C@@H]([NH3+])C(=O)N1CCOCCN(C(=O)[C@H]([NH3+])C(C)C)CCOCC1,C39988451_decoy,TRY1,Decoy,0,-8.13116,-4.26,-3.28,-5.135959147790526
C[NH+]1CCN(Nc2ncnc(NN3CC[NH+](C)CC3)c2N)CC1,C40756826_decoy,TRY1,Decoy,0,-7.75454,-5.61,-0.97,-4.906588180503015
Cc1cccc(Nc2ncnc(NC3CC(C)(C)[NH2+]C(C)(C)C3)c2N)c1,C40760746_decoy,TRY1,Decoy,0,-7.74547,-7.69,-1.35,-6.423590306706525
CC1(C)CC(NC(=O)[C@H]([NH3+])CCS(C)(=O)=O)CC(C)(C)[NH2+]1,C40810406_decoy,TRY1,Decoy,0,-7.51777,-4.37,-2.93,-4.513058586343626
CC[C@H]([NH3+])[C@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)cc1,C42951459_decoy,TRY1,Decoy,0,-8.0128,-7.18,-3.12,-9.0008736099176
CC[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)cc1,C42951471_decoy,TRY1,Decoy,0,-8.64114,-6.92,-2.65,-7.164361954182922
C[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+]1CCC(C(N)=O)CC1,C42952428_decoy,TRY1,Decoy,0,-6.91762,-3.76,-1.11,-4.043784350955339
CC[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](CCO)CCO,C42954104_decoy,TRY1,Decoy,0,-7.36271,-3.68,-3.81,-4.842497388464724
Nc1cc(=O)[nH]c(S[C@@H](C[NH3+])c2ccc(Br)cc2)n1,C42959827_decoy,TRY1,Decoy,0,-8.76045,-6.96,-1.02,-8.408527094197773
CC[C@H]([NH3+])[C@H](c1cccc(Br)c1)[NH+](CCO)CCO,C43021079_decoy,TRY1,Decoy,0,-7.10228,-4.35,-4.05,-5.162969212504159
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1cccc(Br)c1,C43025255_decoy,TRY1,Decoy,0,-8.83593,-6.49,-2.26,-8.061309948645903
CC[C@H]([NH3+])[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1Cl,C43090172_decoy,TRY1,Decoy,0,-8.78189,-6.81,-2.35,-7.68219926672405
CC[C@@H]([NH3+])[C@@H](c1ccccc1Br)[NH+](CCO)CCO,C43092468_decoy,TRY1,Decoy,0,-8.21325,-3.71,-3.21,-5.1437109021347815
C[C@@H]([NH3+])[C@@H](Sc1nc(N)cc(N)n1)c1ccccc1Br,C43096458_decoy,TRY1,Decoy,0,-9.39828,-7.28,-1.39,-10.22084292448526
C[C@@H]([NH3+])[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1Br,C43096474_decoy,TRY1,Decoy,0,-7.48809,-6.71,-2.94,-7.953156958423386
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](CC(N)=O)C(C)C,C43287312_decoy,TRY1,Decoy,0,-8.46976,-3.56,-1.4,-4.679422331843044
[NH3+][C@@H](CO)CCc1ccccc1-c1ccccc1CC[C@@H]([NH3+])CO,C44464399_decoy,TRY1,Decoy,0,-8.13585,-6.44,-2.35,-8.796028439708788
[NH3+][C@H](CO)CC(C[C@H]([NH3+])CO)c1ccc(OC(F)(F)F)cc1,C44465886_decoy,TRY1,Decoy,0,-9.32443,-6.3,-0.64,-9.064561808629223
NC1=N[C@@]2([NH+]=C(Nc3ccc(F)cc3)N1)C(=O)Nc1ccccc12,C19327176_decoy,TRY1,Decoy,0,-5.71643,-6.65,-1.69,-3.5492555633501177
C[C@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](CCO)CCO,C43261275_decoy,TRY1,Decoy,0,-7.18972,-4.57,-3.01,-4.757621129770742
C[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](CCO)CCO,C43286313_decoy,TRY1,Decoy,0,-8.24241,-4.08,-2.74,-5.22587121151604
Cc1ccc(OC[C@@H](O)C[NH2+]CCC[NH3+])c(Br)c1,C51356126_decoy,TRY1,Decoy,0,-8.30526,-4.42,-1.08,-5.3025189903861625
Cc1ccc(NC2=[NH+][C@]3(N=C(N)N2)C(=O)Nc2ccccc23)cc1,C19318958_decoy,TRY1,Decoy,0,-7.25147,-6.0,-1.96,-4.522646256900621
COc1cc(C[NH2+]C2CCC([NH3+])CC2)cc(Br)c1O,C51693005_decoy,TRY1,Decoy,0,-9.40889,-6.61,-1.75,-9.290542880452731
[NH3+]C1CCC([NH2+][C@@H]2C(=O)Nc3c(Br)cccc32)CC1,C51694567_decoy,TRY1,Decoy,0,-7.90676,-5.86,-1.25,-4.902072078513898
[NH3+]C[C@@H]1CC2=c3cc(C(=O)Nc4cccnc4)ccc3=[NH+][C@@H]2C(=O)N1,C52637454_decoy,TRY1,Decoy,0,-8.49048,-7.53,-0.93,-11.225672155554392
Nc1nc2c(c(N)[nH+]1)CN(Cc1ccc(Cl)cc1Cl)CN2,C13207634_decoy,TRY1,Decoy,0,-9.32503,-8.9,-1.09,-11.368798895644243
CC[C@H]([NH3+])Cc1c(N)nc(N)c(C[C@@H]([NH3+])CC)c1-c1ccccc1,C44410064_decoy,TRY1,Decoy,0,-6.68774,-4.46,-1.87,-3.254570177142048
CC[NH2+][C@H](C)c1ccc(Sc2nc(N)cc(N)n2)c(Cl)c1,C61700312_decoy,TRY1,Decoy,0,-7.99707,-6.03,-1.41,-6.496747699521332
NC(=O)N/[NH+]=c1\oc2ccccc2cc1C1[NH+]=c2ccccc2=[NH+]1,C63129279_decoy,TRY1,Decoy,0,-6.91476,-9.06,-0.34,-7.035608472616505
CC1=C(c2ccc(Cl)cc2)[C@@H]([NH3+])N(C2[NH+]=c3ccccc3=[NH+]2)N1,C63425298_decoy,TRY1,Decoy,0,-7.61808,-5.95,-0.99,-3.906153760037697
NN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@H]1c1ccccc1F,C63619694_decoy,TRY1,Decoy,0,-6.81743,-8.4,-1.32,-6.211438700009234
C[C@@H]1NN[C@H](NCCC2=c3cc(Cl)ccc3=[NH+]C2)N(N)C1=O,C63952565_decoy,TRY1,Decoy,0,-8.46006,-7.7,-1.45,-7.018414431160244
CN(C[C@@H]1[NH+]=c2ccc(F)cc2=[NH+]1)c1cc(NC2CC2)[nH+]c(N)n1,C65407996_decoy,TRY1,Decoy,0,-8.31772,-5.7,-1.6,-4.739302664748945
O=S(=O)(c1ccc2c(c1)Cc1cc(S(=O)(=O)N(CCO)CCO)ccc1-2)N(CCO)CCO,C02066996_decoy,TRY1,Decoy,0,-7.64077,-5.91,-3.97,-5.672104646637873
CC(=O)N[C@H](C=O)[C@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1O)[C@H](O)[C@H](O)COS(=O)(=O)[O-],C04535972_decoy,TRY1,Decoy,0,-7.4099,-5.78,-3.63,-6.1698434235901045
CC(=O)N[C@H](C=O)[C@@H](O[C@H]1OC(C(=O)[O-])=C[C@@H](O)[C@H]1OS(=O)(=O)[O-])[C@H](O)[C@H](O)CO,C04536198_decoy,TRY1,Decoy,0,-6.91184,-5.53,-3.16,-5.792197907050257
COc1cc2c(c(OC)c1OC)-c1ccc(NCCCC[C@H]([NH3+])C(=O)[O-])c(=O)cc1[C@@H](N(C)N=O)CC2,C08740218_decoy,TRY1,Decoy,0,-8.61883,-7.24,-2.45,-6.785535778903016
CCOC(=O)CC1=C(C(=O)OCC)[C@@H](c2ccc(OCC(N)=O)c(OC)c2)C(C#N)=C(N)O1,C02267177_decoy,TRY1,Decoy,0,-6.8758,-6.31,-3.88,-6.661568856561613
Cc1ccc(OC[C@@H](O)Cn2c(N(CCO)CCO)nc3c2c(=O)[nH]c(=O)n3C)cc1,C09308849_decoy,TRY1,Decoy,0,-8.10945,-7.08,-2.05,-7.990301844110607
Cn1c(=O)[nH]c(=O)c2c1nc(NCCCO)n2C[C@H](O)COc1ccc([N+](=O)[O-])cc1,C08926254_decoy,TRY1,Decoy,0,-8.48898,-6.95,-1.3,-8.746865690849296
O=C(NCCCCCCNC(=O)NC[C@@H]1CCS(=O)(=O)C1)NC[C@@H]1CCS(=O)(=O)C1,C12174916_decoy,TRY1,Decoy,0,-10.531,-6.1,-2.2,-7.69456742780799
OCCN(CCO)C1=N[C@@H]2C(N3CCCCC3)=NC(N(CCO)CCO)=N[C@@H]2C(N2CCCCC2)=N1,C13510822_decoy,TRY1,Decoy,0,-10.2952,-4.81,-3.46,-6.701906023219606
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)CNC(=O)c2ccco2)cc1,C18072041_decoy,TRY1,Decoy,0,-8.26228,-6.11,-2.22,-7.316496926884687
CCOC(=O)C(CC[C@@]([NH3+])(P(=O)([O-])[O-])[P@@](=O)([O-])O)(NC(C)=O)C(=O)OCC,C20112509_decoy,TRY1,Decoy,0,-5.7241,-4.84,-3.2,-4.866781267197071
CCSc1nnc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)s1,C20920848_decoy,TRY1,Decoy,0,-9.89991,-6.56,-4.07,-6.851973895854081
COCCC[NH2+][C@H](CC(=O)Nc1ccc(S(=O)(=O)/N=c2\[nH]ccs2)cc1)C(=O)[O-],C16740603_decoy,TRY1,Decoy,0,-6.51936,-6.25,-2.13,-4.843857062777194
CCOC(=O)C1=C(CSc2nnc(C3CC3)n2CCC(N)=O)NC(=O)N[C@@H]1c1ccc(C)o1,C25671759_decoy,TRY1,Decoy,0,-8.82475,-6.56,-2.4,-6.294156256519905
CCOC(=O)C1=C(CSc2nnc(CCC(N)=O)n2C[C@H]2CCCO2)NC(=O)NC1,C28945948_decoy,TRY1,Decoy,0,-8.18626,-6.74,-1.68,-8.376596518844611
C/C(=C/C[C@@H](CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](C)C(=O)[O-])C[C@@H]1C[C@@H](C)C(=O)O1,C31163360_decoy,TRY1,Decoy,0,-6.28993,-7.1,-4.0,-5.130662810546462
CON1C(=O)C2=C(O[C@@H](CCC[C@@H](C)O)[C@@](C)(O)[C@H]2O)[C@@H]1CSC[C@H](O)C(=O)[O-],C31163413_decoy,TRY1,Decoy,0,-7.79015,-5.1,-1.49,-5.488636885213862
CCCCCn1c(COc2ccccc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594367_decoy,TRY1,Decoy,0,-6.96091,-7.42,-2.94,-6.018281542893751
CCCCCn1c(COc2ccc(Cl)cc2)nn([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)c1=S,C32594371_decoy,TRY1,Decoy,0,-8.38293,-7.85,-3.0,-8.084957078137663
Cc1cccc(C(C)C)c1NC(=O)/C(CC(=O)/C=C/c1cccc([N+](=O)[O-])c1)=N/NC(=O)C(N)=O,C25585260_decoy,TRY1,Decoy,0,-7.54186,-7.33,-2.63,-6.2402107937763285
CON1C(=O)C2=C(O[C@@H](CCC[C@H](C)O)[C@@](C)(O)[C@H]2O)[C@H]1CSC[C@H](O)C(=O)[O-],C35270733_decoy,TRY1,Decoy,0,-8.45002,-5.25,-3.52,-5.659425097882957
COCC(=O)N(Cc1ccco1)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1c(O)cc(O)cc1O,C36505396_decoy,TRY1,Decoy,0,-8.63998,-7.06,-0.72,-7.099275963481426
CCOC(=O)NC(=O)C(=CNNc1ncc(C(F)(F)F)cc1Cl)C(=O)NC(=O)OCC,C08856992_decoy,TRY1,Decoy,0,-8.13057,-7.03,-2.7,-8.198618794072933
NC(=O)OC[C@@H]1[C@H](NC(=O)/C(=N/OCC(=O)[O-])c2csc(N)n2)C(=O)N1S(=O)(=O)[O-],C13831159_decoy,TRY1,Decoy,0,-6.73992,-6.37,-1.79,-11.04471656316425
CSCCCCC(=O)N(OS(=O)(=O)[O-])S[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C38654281_decoy,TRY1,Decoy,0,-7.02249,-4.57,-3.4,-4.6642832942091
CSCCCCC(=O)N(OS(=O)(=O)[O-])S[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C38654285_decoy,TRY1,Decoy,0,-7.24263,-5.03,-2.98,-5.106354582498102
CCCCN1C(=O)N=C([O-])[C@H](N(CCOC)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)[C@@H]1[NH3+],C38800498_decoy,TRY1,Decoy,0,-7.74595,-5.21,-2.25,-5.234082914196457
CCOc1ccc(N2C(SCC(=O)NC[C@@H]3CCCO3)=NN[C@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362570_decoy,TRY1,Decoy,0,-8.07679,-7.6,-1.57,-9.03270960204822
CCOc1ccc(N2C(SCC(=O)NC[C@@H]3CCCO3)=NN[C@@H]2Cc2cc(=O)[nH]c(=O)[nH]2)cc1,C39362572_decoy,TRY1,Decoy,0,-8.43827,-7.24,-2.45,-7.773983572708283
CCOC(=O)CNC(=O)CSC1=NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1,C39362839_decoy,TRY1,Decoy,0,-6.63415,-7.09,-2.63,-6.547458110947169
CCOC(=O)CNC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1,C39362841_decoy,TRY1,Decoy,0,-8.80139,-7.36,-4.04,-8.835377993004922
C=CCNC(=O)NC(=O)COC(=O)c1ccccc1SCC(=O)NC(=O)NCC=C,C39585865_decoy,TRY1,Decoy,0,-9.04307,-6.75,-1.8,-7.0971133005894265
COc1ccc(N(CCC(N)=O)C(=O)CSc2nc(C)c(CCC(=O)O)c(=O)[nH]2)cc1,C13451216_decoy,TRY1,Decoy,0,-8.74076,-6.99,-3.19,-7.214267133803951
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NCCCc2[nH]nc(N)c2C#N)c1OC,C13247131_decoy,TRY1,Decoy,0,-8.81282,-7.41,-2.97,-7.604395798856046
C[N+](C)(C[C@H](O)CO)NC(=O)CCCCCCCCC(=O)N[N+](C)(C)C[C@@H](O)CO,C16102280_decoy,TRY1,Decoy,0,-7.64108,-5.52,-3.35,-7.264615563151251
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)Nc3cccc(NC(C)=O)c3)n[nH]2)c1C,C59830945_decoy,TRY1,Decoy,0,-9.15649,-6.15,-3.17,-5.70495163752854
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)c1C,C59831571_decoy,TRY1,Decoy,0,-8.67416,-7.44,-2.95,-9.613142331478969
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3cccc(NC(C)=O)c3)n[nH]2)cn1,C59831680_decoy,TRY1,Decoy,0,-9.01704,-7.38,-2.38,-9.65870351801366
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(NC(C)=O)cc3)n[nH]2)cn1,C59832460_decoy,TRY1,Decoy,0,-9.98555,-7.4,-3.53,-7.401306234335762
COc1cc(/C=N/Nc2nc(S[C@H](C)C(=O)NNC(C)=O)n[nH]2)cc(OC)c1OC,C59883777_decoy,TRY1,Decoy,0,-8.06406,-7.09,-1.88,-6.504060965345052
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)NNC(=O)C3CCC3)n[nH]2)c1C,C59883810_decoy,TRY1,Decoy,0,-9.62668,-6.78,-2.43,-6.849401147350242
C=CCn1nc(C)c(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]2)c1C,C59883818_decoy,TRY1,Decoy,0,-8.67402,-5.56,-3.07,-5.904193282389702
COCCn1cc(/C=N/Nc2nc(S[C@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)cn1,C59883900_decoy,TRY1,Decoy,0,-9.16441,-6.07,-1.61,-6.354723973580184
COCCn1cc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(F)(F)F)n[nH]2)cn1,C59887431_decoy,TRY1,Decoy,0,-7.41069,-6.47,-1.94,-6.215512156266347
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NCc2ccccc2Cl)n[nH]1,C59887679_decoy,TRY1,Decoy,0,-9.96678,-8.26,-2.34,-7.363843538165535
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)N[C@H](C)c2ccccc2)n[nH]1,C59887854_decoy,TRY1,Decoy,0,-10.125,-8.8,-3.04,-7.5044887112453615
COc1ccccc1CNC(=O)CCSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59888196_decoy,TRY1,Decoy,0,-9.89004,-9.28,-2.2,-11.39483738741412
CCOc1ccccc1NC(=O)CSc1nnc(N/N=C/c2cnn(CCOC)c2)n1N,C59914061_decoy,TRY1,Decoy,0,-8.66692,-7.15,-2.76,-7.733290793325205
COCCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3nc(C)cs3)n2N)cn1,C59914134_decoy,TRY1,Decoy,0,-9.36614,-7.37,-3.8,-7.09206636122575
COCCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3sc4c(c3C#N)CCCC4)n2N)cn1,C59914153_decoy,TRY1,Decoy,0,-10.9378,-6.8,-1.84,-7.726138719652192
COC(=O)[C@]1(O)C[C@H](O)[C@@H](NC(C)=O)[C@@H]([C@H](O)[C@H](O)CO)O1,C04293696_decoy,TRY1,Decoy,0,-6.22002,-4.12,-1.11,-4.205538771349537
COC(=O)[C@]1(O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O1,C04293698_decoy,TRY1,Decoy,0,-5.4529,-5.65,-1.85,-4.879469269094847
CC(=O)N1[C@H](CO)CS[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO,C04419831_decoy,TRY1,Decoy,0,-8.60138,-5.19,-2.56,-5.839689704066021
COC(=O)[C@@]1(O)C[C@@H](O)[C@H](NC(C)=O)[C@@H]([C@H](O)[C@H](O)CO)O1,C02558706_decoy,TRY1,Decoy,0,-5.96677,-4.7,-3.52,-4.099645423106991
COC(=O)[C@@]1(O)C[C@H](O)[C@H](NC(C)=O)[C@@H]([C@H](O)[C@H](O)CO)O1,C02586056_decoy,TRY1,Decoy,0,-5.50521,-5.09,-1.91,-5.0236270796774924
CC1(C)O[C@@H]2[C@H](CO[C@H]2c2[nH]nc(C(N)=O)c2C(=O)NN)O1,C04982956_decoy,TRY1,Decoy,0,-7.06807,-7.76,0.14,-8.567965130061634
CN(C)P1(N)=NP(N)(N(C)C)=NP(N)(N(C)C)=N1,C05063127_decoy,TRY1,Decoy,0,-4.63527,-4.06,-3.47,-3.489448011391415
OC[C@@H](O)[C@@H](O)[C@H](O)/C=N\Nc1nnc2c(n1)[nH]c1ccccc12,C05517999_decoy,TRY1,Decoy,0,-7.48484,-7.1,0.08,-5.692333921146435
CNC(=O)NCCNC(=O)[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@@H]1O,C05648145_decoy,TRY1,Decoy,0,-6.01603,-6.48,-1.5,-4.839008746881949
CSc1nc(NN)c2cnn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C05766209_decoy,TRY1,Decoy,0,-6.50927,-5.66,-0.38,-4.530707042148834
NC(=O)CNc1cnn([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1,C06041601_decoy,TRY1,Decoy,0,-5.79514,-4.25,-2.7,-3.4541264428942378
Nc1ccccc1S[C@]1(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04762240_decoy,TRY1,Decoy,0,-7.28324,-7.02,-2.36,-7.475253695568628
Nc1ccccc1S[C@]1(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C04762245_decoy,TRY1,Decoy,0,-6.52448,-4.77,-1.75,-4.195338046596609
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@@H]1O,C06930964_decoy,TRY1,Decoy,0,-3.50445,-5.79,-2.67,-3.676727075271284
CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]1O,C06932870_decoy,TRY1,Decoy,0,-4.27886,-6.51,-3.67,-4.5452335582232175
Cn1c(NC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc(=O)n(C)c1=O,C06995976_decoy,TRY1,Decoy,0,-7.33695,-7.05,-3.41,-7.36352706576422
Cn1c(=O)c([N+](=O)[O-])c2n(c1=O)[C@@H](O)[C@H]([C@H](O)[C@H](O)[C@H](O)CO)N2,C08384287_decoy,TRY1,Decoy,0,-6.28608,-6.33,-2.85,-5.2708782726377
Cn1c(=O)c([N+](=O)[O-])c2n(c1=O)[C@@H](O)[C@@H]([C@H](O)[C@H](O)[C@H](O)CO)N2,C08384293_decoy,TRY1,Decoy,0,-5.31547,-5.15,-2.8,-4.034731511721181
Cc1ccc(C2=NN[C@@H]([C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)S2)cc1,C13151365_decoy,TRY1,Decoy,0,-8.9756,-5.26,-1.3,-5.719425727111574
OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H]12,C13407185_decoy,TRY1,Decoy,0,-7.48055,-4.76,-2.23,-4.363278798003649
OC[C@H]1O[C@H](OCCc2ccc(O)c(O)c2)[C@@H](O)[C@@H](O)[C@@H]1O,C14512194_decoy,TRY1,Decoy,0,-6.04363,-6.91,-3.39,-6.278393854411607
CN(C)c1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C15225672_decoy,TRY1,Decoy,0,-6.29255,-7.8,-1.79,-8.157947685895165
C[C@H]1CN(/C(=N\O)c2nonc2N)C[C@H](C)N1/C(=N/O)c1nonc1N,C16609419_decoy,TRY1,Decoy,0,-7.08686,-7.48,-2.91,-6.394450999652607
Nc1ncnc2c1c(-c1ncn[nH]1)cn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C16973805_decoy,TRY1,Decoy,0,-6.57201,-7.2,-0.3,-6.844020273844197
NC(=O)CC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O,C17021483_decoy,TRY1,Decoy,0,-6.84125,-7.92,-1.58,-11.211426094227484
NC(=O)N/N=C\Cn1c(=O)ccn(C/C=N/NC(N)=O)c1=O,C17376782_decoy,TRY1,Decoy,0,-6.31455,-6.89,-1.56,-8.865644249636413
[H]/N=C(\N)NC(=O)c1nc(Cl)c(N(C)C(C)(C)C)nc1N,C03871093_decoy,TRY1,Decoy,0,-7.70448,-6.55,-0.9,-9.368893621518929
CCc1nnc(NC(=O)CSc2nnc(NN)n2N)s1,C21036052_decoy,TRY1,Decoy,0,-8.40521,-7.65,-0.27,-9.824686362849178
CC(=O)N1[C@H]2N([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)C=N[C@@]2(C(C)=O)C(=O)N[C@@]1(N)C(C)=O,C21299949_decoy,TRY1,Decoy,0,-6.29466,-5.08,-2.78,-4.468322758054334
CC(=O)N1[C@H]2N([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)C=N[C@]2(C(C)=O)C(=O)N[C@@]1(N)C(C)=O,C21299957_decoy,TRY1,Decoy,0,-4.89528,-6.55,-1.69,-4.840324174492364
NC(=O)c1cn([C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2[nH]cnc(=O)c12,C17428738_decoy,TRY1,Decoy,0,-6.40608,-5.44,-0.85,-3.973183520413638
CSc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(C=O)c(=O)[nH]1,C17175491_decoy,TRY1,Decoy,0,-4.61291,-6.13,-3.43,-4.670876968367141
O=C1N[C@@H]2NC(=O)N(CCCN3C(=O)N[C@@H]4NC(=O)N[C@@H]43)[C@H]2N1,C33664060_decoy,TRY1,Decoy,0,-5.45445,-5.42,-1.43,-4.1541658445741945
[N-]=[N+]=Nc1ccc(C(=O)NC[C@H]2O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]2O)c(O)c1,C33683072_decoy,TRY1,Decoy,0,-6.43191,-6.24,-2.26,-7.037945703482964
NC(=S)c1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c2[nH]cnc(=O)c12,C08628068_decoy,TRY1,Decoy,0,-6.54347,-5.04,-0.71,-4.503342910765856
Nc1ccc(CS[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C33770190_decoy,TRY1,Decoy,0,-6.18385,-7.02,-2.21,-6.092636127434274
Nc1ccc(CS[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1,C38599793_decoy,TRY1,Decoy,0,-6.67069,-7.58,-1.78,-6.624527351412418
Nc1ccc2c(c1)=N[C@H]([C@@H](O)[C@@H](O)[C@@H]1N=c3ccc(N)cc3=N1)N=2,C39699179_decoy,TRY1,Decoy,0,-8.16366,-8.3,-0.92,-8.675340116582538
OC[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@H]3CO[C@H]3O[C@H]2CO)[C@H](O)[C@H](O)[C@@H]1O,C44171313_decoy,TRY1,Decoy,0,-4.94991,-5.09,-3.12,-4.050273498634216
CN(C)/C=C(C(=C/[NH+](C)C)/[C@@H](N)CC(=O)[O-])\[C@@H]([NH3+])CC(=O)[O-],C44217642_decoy,TRY1,Decoy,0,-5.13131,-3.63,-1.66,-3.652848618135795
[NH3+][C@H](CC(C[C@H]([NH3+])C(=O)[O-])c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-],C44286052_decoy,TRY1,Decoy,0,-6.07107,-4.02,-2.71,-4.161023884418928
O=C(NCCBr)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,C45067722_decoy,TRY1,Decoy,0,-7.63467,-6.28,-1.95,-7.334758998202856
OC[C@H]1O[C@@H](O[C@@H]2[C@H](O)C=CO[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,C48533063_decoy,TRY1,Decoy,0,-6.49495,-5.46,-2.94,-4.752431707635689
NNc1ncc(Br)cc1C(=O)NCCC(N)=O,C51128714_decoy,TRY1,Decoy,0,-6.84384,-6.42,-0.71,-6.627135858663223
CC1=C(C(N)=O)[C@@H](c2ccc(N(C)C)cc2)C(C(N)=O)=C(N)O1,C58949512_decoy,TRY1,Decoy,0,-5.57174,-5.54,-1.29,-4.467775299032841
CC1=C(C(N)=O)[C@H](c2ccc([N+](=O)[O-])o2)C(C(N)=O)=C(N)O1,C58949543_decoy,TRY1,Decoy,0,-5.20898,-5.25,-1.09,-4.477106781828106
CC1=C(C(N)=O)[C@H](c2ccc([N+](=O)[O-])s2)C(C(N)=O)=C(N)O1,C58949562_decoy,TRY1,Decoy,0,-6.80483,-4.13,-1.93,-4.244574339008634
CN1C(=O)NC(=O)/C(=C/N[C@@H]2[C@H](O)[C@H](O)[C@H](CO)O[C@@H]2O)C1=O,C35423037_decoy,TRY1,Decoy,0,-5.24483,-5.89,-3.48,-3.9913195075564607
Cn1ncc2c(N)nc(CSc3nc(N)cc(N)n3)nc21,C63083988_decoy,TRY1,Decoy,0,-7.54598,-7.29,-0.55,-6.245849536090163
Cc1cc(C[C@H](C)NC(=O)CS[C@@H]2NN[C@H](N)S2)[nH]n1,C63884180_decoy,TRY1,Decoy,0,-7.6149,-6.31,-1.45,-6.694575330824549
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C04349794_decoy,TRY1,Decoy,0,-7.27376,-8.25,-4.05,-7.512261722929203
COc1ccc(-c2coc3cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3c2=O)cc1,C04349817_decoy,TRY1,Decoy,0,-8.38632,-7.85,-1.46,-6.885695583364908
CCC1(Sc2ncnc3c2ncn3[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)C(=O)NC(=O)NC1=O,C04994313_decoy,TRY1,Decoy,0,-6.59095,-5.97,-1.66,-5.30190542228699
CCC1(Sc2ncnc3c2ncn3[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)C(=O)NC(=O)NC1=O,C04994314_decoy,TRY1,Decoy,0,-6.27734,-6.26,-0.91,-4.662932681197714
COc1cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(c1)O[C@@H](c1ccc(O)cc1)CC2=O,C05742784_decoy,TRY1,Decoy,0,-8.6495,-7.52,-1.59,-7.64536434403121
CCOC(=O)CNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06546810_decoy,TRY1,Decoy,0,-6.8818,-6.25,-1.41,-6.126320850045324
Nc1ncnc2c1nc(N/N=C/c1c(Cl)cccc1Cl)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C08636780_decoy,TRY1,Decoy,0,-7.79505,-7.91,-2.99,-6.89664601023294
COc1cc(O)c2c(=O)c(-c3ccc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3)coc2c1,C08662732_decoy,TRY1,Decoy,0,-7.73215,-7.8,-1.92,-5.242582690000472
O=C(Cc1ccc2c(c1)OCCO2)c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1O,C04258482_decoy,TRY1,Decoy,0,-7.40315,-7.26,-2.45,-5.528827849106061
Nc1ncnc(NNC(=O)CNC(=O)c2cc(Br)ccc2Cl)c1[N+](=O)[O-],C09391670_decoy,TRY1,Decoy,0,-7.50177,-7.63,-1.19,-7.341362020117211
Nc1ncnc2c1nc(N/N=C/c1c(Cl)cccc1Cl)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C09975287_decoy,TRY1,Decoy,0,-8.92138,-7.6,-1.48,-9.072870539793731
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004134_decoy,TRY1,Decoy,0,-8.51819,-8.38,-0.48,-8.386878600939506
Nc1ncnc2c1nc(N/N=C/c1ccc(Cl)cc1Cl)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004150_decoy,TRY1,Decoy,0,-8.6245,-8.56,-0.63,-7.675387481673914
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)o1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O,C10004194_decoy,TRY1,Decoy,0,-7.78165,-8.17,-3.39,-7.1183760965027325
COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3o2)ccc1O,C12419110_decoy,TRY1,Decoy,0,-8.83388,-7.64,-2.01,-5.792257518491198
Nc1nc2c(nc(SCc3ccc(Cl)cc3)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C12862693_decoy,TRY1,Decoy,0,-8.30388,-8.16,-2.24,-6.510887018465402
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1Br,C03652836_decoy,TRY1,Decoy,0,-7.32437,-6.89,-1.59,-5.586328889886763
COc1ccc(-c2coc3cc(O[C@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc(O)c3c2=O)cc1,C13813075_decoy,TRY1,Decoy,0,-8.90573,-7.59,-3.28,-6.721000878293603
O=c1[nH]cnc2c1nc(N/N=C/c1c(O)ccc3ccccc13)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C16525799_decoy,TRY1,Decoy,0,-6.73733,-6.96,-1.28,-5.5640638834217855
CCC1(Sc2ncnc3c2ncn3[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)C(=O)NC(=O)NC1=O,C17020741_decoy,TRY1,Decoy,0,-5.9907,-4.99,-1.09,-3.973529519638614
CCOc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc(Br)c1OCC(N)=O,C19646828_decoy,TRY1,Decoy,0,-7.35209,-4.8,-0.83,-5.1936128256813445
Cc1nn(C)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1,C20837048_decoy,TRY1,Decoy,0,-10.0658,-7.73,-4.21,-8.545970919035238
OCc1cnn(-c2nc(Nc3ccccn3)c3ncn([C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)c3n2)c1,C28817684_decoy,TRY1,Decoy,0,-7.69352,-6.23,-2.22,-5.26505065644016
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(=O)c(-c3ccc(O)cc3)coc2c1,C31502299_decoy,TRY1,Decoy,0,-6.22836,-7.69,-0.73,-6.273145244510941
O=C(O[C@@H]1C=C(CO)[C@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C35455263_decoy,TRY1,Decoy,0,-8.16639,-7.08,-2.3,-6.074486959593678
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)cc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C08740494_decoy,TRY1,Decoy,0,-8.3725,-7.74,-1.33,-6.94825281353731
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)C1CCCCC1,C36490665_decoy,TRY1,Decoy,0,-7.51156,-6.15,-0.17,-6.067357081907737
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1ccccc1O,C36497841_decoy,TRY1,Decoy,0,-8.20459,-6.48,-0.38,-7.138930038318011
O=C1C=C(c2ccc(O)cc2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](Cc2ccc(O)cc2)O1,C37538744_decoy,TRY1,Decoy,0,-6.73939,-8.09,-1.94,-5.599854018674506
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C04399785_decoy,TRY1,Decoy,0,-8.9099,-6.31,-2.0,-8.691579458706837
Cc1ccc(C)c(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)o2)c1,C12714910_decoy,TRY1,Decoy,0,-8.49476,-6.45,-2.76,-6.416754234106003
COc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c2c1O[C@@H](c1ccccc1)CC2=O,C36374617_decoy,TRY1,Decoy,0,-8.97398,-6.1,-1.74,-5.1644259051474455
COc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccccc1)CC2=O,C36374615_decoy,TRY1,Decoy,0,-6.88565,-7.39,-2.45,-5.035204831146489
C/C(=C\Cc1c(O)cc2oc(C)cc(=O)c2c1O)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31161031_decoy,TRY1,Decoy,0,-7.0347,-7.45,-1.94,-5.4999738520065184
COc1ccc(-c2coc3cc(O[C@@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc(O)c3c2=O)cc1,C03947504_decoy,TRY1,Decoy,0,-8.3288,-6.78,-1.87,-6.707720997689539
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C12495612_decoy,TRY1,Decoy,0,-8.15996,-6.87,-2.04,-6.535473509658529
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)Nc2nc(N3CCC(C(N)=O)CC3)[nH]c(=O)c21,C38828097_decoy,TRY1,Decoy,0,-8.28765,-8.61,-1.58,-6.57936549254211
[H]/N=C1/NC(SC)=NC(=O)[C@@H]1[C@H](c1ccc(O)c(OC)c1)[C@H]1C(=O)N=C(SC)N=C1N,C39290112_decoy,TRY1,Decoy,0,-7.20473,-5.01,-3.16,-4.787272935796396
COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2c(c1O)C(=O)[C@@H](c1ccc(O)cc1)CO2,C39351834_decoy,TRY1,Decoy,0,-9.33612,-6.08,-1.79,-5.487620016168307
COc1cc(O[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)c2c(c1)O[C@@H](c1ccc(O)cc1)[C@@H](O)C2=O,C39928748_decoy,TRY1,Decoy,0,-8.68662,-7.2,-2.39,-7.182463945091143
C[C@@H]1CN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCCC4)n2)C[C@H](C)O1,C41026414_decoy,TRY1,Decoy,0,-8.43637,-7.79,-2.9,-7.238702709406876
NC(=O)c1c(Nc2nc(N3CCN(C(=O)c4ccco4)CC3)nc(N)c2[N+](=O)[O-])sc2c1CCCC2,C41026432_decoy,TRY1,Decoy,0,-8.00718,-7.41,-2.33,-6.452845302366454
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C02570156_decoy,TRY1,Decoy,0,-7.58713,-7.4,-2.16,-6.953959163208251
COc1ccc(-c2coc3cc(O[C@H]4O[C@H](CO)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)cc1,C43465494_decoy,TRY1,Decoy,0,-9.43446,-7.32,-1.63,-7.134031455776859
Cc1cc2c(cc1Br)nc1c(=O)[nH]c(=O)nc-1n2C[C@H](O)[C@H](O)[C@H](O)CO,C43763771_decoy,TRY1,Decoy,0,-8.66784,-6.21,-1.36,-6.351826730866359
CCCc1n[nH]c2c1[C@H](c1ccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(CCC)c43)cc1)C(C#N)=C(N)O2,C08856828_decoy,TRY1,Decoy,0,-6.46355,-6.27,-2.25,-6.262175893539802
Nc1nonc1N1N=N[C@H](C(=O)N/N=C2/C(=O)Nc3ccccc32)[C@@H]1CSc1nc2ccccc2[nH]1,C39709112_decoy,TRY1,Decoy,0,-9.5991,-6.64,-2.15,-7.467044796729509
Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C/NC(CO)(CO)CO)C2=O)cc1C,C19596852_decoy,TRY1,Decoy,0,-8.97425,-6.19,-2.0,-5.739598753951977
[NH3+]CCO/N=C(\CCCCO[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)c1ccc(C(F)(F)F)cc1,C65739939_decoy,TRY1,Decoy,0,-7.06265,-7.54,-2.18,-7.724772350073153
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C04349789_decoy,TRY1,Decoy,0,-7.78331,-6.88,-2.24,-6.199682217711953
COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc(O)c3c2=O)cc1,C04349821_decoy,TRY1,Decoy,0,-8.67346,-7.89,-1.74,-5.976867394050123
Nc1nc(SCC(=O)c2ccc(Cl)cc2)c2ncn([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1,C04705727_decoy,TRY1,Decoy,0,-9.2058,-7.84,-1.55,-6.913260157476758
CCOC(=O)CNC(=O)[C@H](c1ccc(F)cc1)N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N,C06546977_decoy,TRY1,Decoy,0,-9.73457,-7.61,-4.13,-8.59244567741058
CCOC(=O)CNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06547136_decoy,TRY1,Decoy,0,-8.53685,-8.12,-3.2,-9.17311288707371
CNc1nc2c(c(=O)[nH]c(=O)n2C)n1CC(O)Cn1c(NC)nc2c1c(=O)[nH]c(=O)n2C,C10049609_decoy,TRY1,Decoy,0,-7.49548,-8.49,-1.4,-11.320163159346816
COc1ccc2nc(/C=N/Nc3nc4c(N)ncnc4n3[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)ccc2c1,C10004097_decoy,TRY1,Decoy,0,-8.02238,-9.18,-0.91,-9.189845787360229
Nc1ncnc2c1nc(N/N=C/c1c(Cl)cccc1Cl)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975285_decoy,TRY1,Decoy,0,-7.50059,-7.31,-1.66,-7.356923397638255
[NH3+][C@H](C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@@H]12)c1ccc(O)cc1,C11616775_decoy,TRY1,Decoy,0,-8.99378,-7.48,-0.89,-5.875701726981941
COc1cc(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3)coc2c1,C11666641_decoy,TRY1,Decoy,0,-8.9248,-6.09,-2.93,-4.975969027673992
COc1cc(-c2cc(=O)c3c(O)cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)cc3o2)ccc1O,C12419113_decoy,TRY1,Decoy,0,-8.41423,-8.4,-2.93,-7.328264620652615
COCCNC(=O)[C@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C12467249_decoy,TRY1,Decoy,0,-6.02458,-6.63,-2.44,-7.532626149595912
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C12495621_decoy,TRY1,Decoy,0,-7.55213,-7.8,-3.28,-6.673462771337173
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4O)cc3o2)cc1,C13334250_decoy,TRY1,Decoy,0,-7.9961,-7.7,-2.19,-6.222489949988723
COc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14488178_decoy,TRY1,Decoy,0,-5.73529,-8.19,-1.08,-6.276258821743158
Nc1ncnc2c1nc(N/N=C/c1ccc(Cl)cc1Cl)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,C15225223_decoy,TRY1,Decoy,0,-8.18173,-8.22,-0.92,-8.209288295370278
O=C(N/N=C(\c1nc2cc(Cl)ccc2[nH]c1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C15775246_decoy,TRY1,Decoy,0,-9.39175,-7.33,-0.82,-6.267976399641115
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)O[C@H](c1ccc(O)cc1)CC2=O,C16951757_decoy,TRY1,Decoy,0,-8.10776,-8.0,-1.3,-5.7914041090359
COc1cc(/C=N/Nc2nnc(SCC(=O)NNC(=O)C(F)(F)F)n2N)cc(OC)c1OC,C20920364_decoy,TRY1,Decoy,0,-8.90974,-7.99,-3.62,-6.909653928527368
Cn1c(NC2=N[C@H]3C(=O)NC(N)=N[C@@H]3N2[C@@H]2C[C@@H](O)[C@@H](CO)O2)nc2ncc(-c3ccccc3)cc21,C22055799_decoy,TRY1,Decoy,0,-8.64238,-10.75,-2.14,-9.429811050558923
Cn1c(Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2C[C@@H](O)[C@@H](CO)O2)nc2ncc(-c3ccccc3)cc21,C22055826_decoy,TRY1,Decoy,0,-8.7503,-9.68,-3.1,-9.477295321228572
N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3)c2[C@H]1c1cn(CC(N)=O)nc1-c1ccccc1,C22707860_decoy,TRY1,Decoy,0,-5.90557,-5.67,-2.83,-4.085486601290954
CC(=O)O[C@H]1[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)O[C@H](CO)[C@H](O)[C@@H]1O,C31156338_decoy,TRY1,Decoy,0,-8.25718,-7.47,-1.24,-7.550696656589073
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@@H]2CCC[NH2+]2)[C@@H](O)[C@@H]1O,C12502197_decoy,TRY1,Decoy,0,-6.99493,-8.71,-1.97,-5.694188847139429
O=C(O[C@H]1C=C(CO)[C@@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C35455273_decoy,TRY1,Decoy,0,-7.93447,-7.13,-2.66,-6.625472448126748
COc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C35455733_decoy,TRY1,Decoy,0,-6.85783,-8.45,-1.69,-6.629988831490868
CC1=C(C(=O)O[C@@H]2O[C@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)CCC1,C35465911_decoy,TRY1,Decoy,0,-6.36616,-6.02,-2.01,-4.8685984904316095
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548365_decoy,TRY1,Decoy,0,-6.52324,-4.91,-2.33,-4.710714246410489
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)[C@@H]1CCC(=O)N1,C36601093_decoy,TRY1,Decoy,0,-7.91328,-7.54,-3.79,-7.922922912214138
O=C(Cc1ccc2c(c1)OCCO2)c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1O,C37009792_decoy,TRY1,Decoy,0,-8.05049,-8.47,-1.98,-5.844471549662964
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C04349785_decoy,TRY1,Decoy,0,-7.62825,-6.11,-0.85,-4.786940044788007
COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3c2=O)cc1,C04096693_decoy,TRY1,Decoy,0,-8.4295,-8.24,-2.63,-7.1606877881189765
COc1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccccc1)CC2=O,C36374609_decoy,TRY1,Decoy,0,-7.54533,-6.2,-2.52,-5.1001175106532255
[NH3+][C@@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cn[nH]n3)CS[C@H]12)c1ccc(O)cc1,C03830404_decoy,TRY1,Decoy,0,-10.8257,-8.3,-1.28,-8.642146443306396
Nc1ncnc2c1nc(N/N=C/c1ccc(Br)cc1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O,C01901766_decoy,TRY1,Decoy,0,-7.80461,-7.8,-1.51,-7.957375592173798
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@@H]2CCC[NH2+]2)[C@@H](O)[C@H]1O,C38664873_decoy,TRY1,Decoy,0,-7.53977,-8.33,-0.88,-10.478691717315897
CC(=O)N[C@@]1(C(F)(F)F)C(=O)N[C@H]2C1=C(O)NC(=O)N2CCc1c[nH]c2ccc(F)cc12,C39000542_decoy,TRY1,Decoy,0,-8.09721,-6.46,-2.18,-5.931057162855083
[H]/N=C1\NC(SC)=NC(=O)[C@H]1[C@@H](c1ccc(O)c(OC)c1)[C@H]1C(=O)N=C(SC)N=C1N,C39290113_decoy,TRY1,Decoy,0,-7.74972,-4.77,-4.51,-5.521301129237689
O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558986_decoy,TRY1,Decoy,0,-8.46272,-8.5,-2.58,-6.965460837859889
COc1cc(O[C@@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)c2c(c1)O[C@@H](c1ccc(O)cc1)[C@H](O)C2=O,C39928750_decoy,TRY1,Decoy,0,-9.12442,-7.43,-3.33,-7.531203432207922
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C39937113_decoy,TRY1,Decoy,0,-7.56512,-8.34,-2.25,-7.301913208958918
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O)[C@H]1O,C39937342_decoy,TRY1,Decoy,0,-5.35664,-5.99,-2.99,-4.617691005531443
CC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)Nc3nc(Nc4ccc(F)cc4)[nH]c(=O)c32)cc1,C40399647_decoy,TRY1,Decoy,0,-7.10352,-6.38,-4.07,-5.16588173091329
CC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)Nc3nc(Nc4ccc(C)cc4)[nH]c(=O)c32)cc1,C40400403_decoy,TRY1,Decoy,0,-7.48734,-9.02,-2.53,-6.1854906957375375
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1ccc2c(c1)OCO2,C40684970_decoy,TRY1,Decoy,0,-9.98069,-6.0,-1.54,-6.693456444059325
C[C@@H]1CN(c2nc(N)c([N+](=O)[O-])c(Nc3sc4c(c3C(N)=O)CCCC4)n2)C[C@@H](C)O1,C41026416_decoy,TRY1,Decoy,0,-8.98407,-7.73,-2.36,-7.681141175916751
NC(=O)c1ccc(Nc2nc(N3CCN(c4ccccc4F)CC3)nc(N)c2[N+](=O)[O-])cc1,C41300976_decoy,TRY1,Decoy,0,-8.53925,-8.93,-2.48,-7.400452465416423
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C43465486_decoy,TRY1,Decoy,0,-7.40551,-8.06,-1.64,-5.341732543733474
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O,C44963918_decoy,TRY1,Decoy,0,-7.02411,-6.2,-4.1,-5.259441657045306
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(OC)c1O,C04349704_decoy,TRY1,Decoy,0,-9.97783,-8.48,-4.9,-8.367798906569034
CCO[C@]1(C)O[C@@](C)(CO)[C@@](C)(O[C@@]2(C)O[C@](C)(CO)[C@@](C)(O)[C@@](C)(O)[C@@]2(C)O)[C@@](C)(O)[C@@]1(C)O,C09915709_decoy,TRY1,Decoy,0,-5.43286,-6.14,-4.71,-4.890667576916452
Nc1ncnc2c1nc(N/N=C/c1c(Cl)cccc1Cl)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975284_decoy,TRY1,Decoy,0,-7.45446,-7.59,-1.5,-6.881145825140414
CCCCCN(CC(=O)c1c(N)n(C)c(=O)n(C)c1=O)c1c(N)n(CCCC)c(=O)[nH]c1=O,C11338964_decoy,TRY1,Decoy,0,-8.00152,-5.98,-3.23,-5.763333717722954
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C12495616_decoy,TRY1,Decoy,0,-8.3082,-7.78,-1.21,-5.667585955058543
CCCc1cc(=O)oc2c(C)c(OCC(=O)N(C)C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)ccc12,C12892493_decoy,TRY1,Decoy,0,-7.36924,-5.52,-1.99,-5.123225941549173
COc1cc2ccc(=O)oc2cc1O[C@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,C14488184_decoy,TRY1,Decoy,0,-5.6031,-6.54,-2.48,-4.344467322101568
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C15250068_decoy,TRY1,Decoy,0,-5.59287,-6.73,-2.58,-4.830474750657439
O[C@H]1[C@H](O)[C@H](Nc2ccc(-c3ccc(N[C@@H]4OC[C@@H](O)[C@@H](O)[C@@H]4O)cc3)cc2)OC[C@H]1O,C15746452_decoy,TRY1,Decoy,0,-6.50205,-7.44,-2.23,-4.8296389619277695
O[C@H]1[C@H](O)[C@H](Nc2ccc(-c3ccc(N[C@@H]4OC[C@H](O)[C@@H](O)[C@@H]4O)cc3)cc2)OC[C@H]1O,C15746454_decoy,TRY1,Decoy,0,-6.23174,-6.36,-3.77,-4.712076603448411
O[C@H]1[C@H](O)[C@H](Nc2ccc(-c3ccc(N[C@H]4OC[C@@H](O)[C@@H](O)[C@@H]4O)cc3)cc2)OC[C@H]1O,C15746455_decoy,TRY1,Decoy,0,-6.29025,-9.19,-1.31,-5.906263532237548
O[C@H]1[C@H](O)[C@H](Nc2ccc(-c3ccc(N[C@H]4OC[C@H](O)[C@@H](O)[C@@H]4O)cc3)cc2)OC[C@H]1O,C15746457_decoy,TRY1,Decoy,0,-6.63174,-6.84,-3.86,-4.227285195251587
Nc1nc2c(nc(NN=Cc3cccc([N+](=O)[O-])c3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16399834_decoy,TRY1,Decoy,0,-6.93482,-9.38,-2.83,-8.756604668251724
Nc1nc2c(nc(NN=Cc3cccc([N+](=O)[O-])c3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C16399839_decoy,TRY1,Decoy,0,-6.22675,-9.12,-0.62,-7.823007984316912
O=c1cc(CO)oc2c3c(cc(O)c12)OCC(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=CC3,C16958212_decoy,TRY1,Decoy,0,-8.64966,-6.61,-1.86,-5.562500615308964
O=[N+]([O-])c1ccccc1O[C@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O,C22064855_decoy,TRY1,Decoy,0,-3.94026,-6.85,-4.99,-3.9806695852657503
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22065007_decoy,TRY1,Decoy,0,-5.58024,-5.94,-1.33,-4.647910488956831
COc1cccc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1O,C27475336_decoy,TRY1,Decoy,0,-7.83194,-9.41,-3.31,-8.002195066712073
COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC[C@H](C)[C@@]3(O)COC(=O)C3)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31167134_decoy,TRY1,Decoy,0,-8.72722,-7.86,-2.9,-7.552663986143254
Nc1nc2c(nc(N/N=C\c3cccc([N+](=O)[O-])c3)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35188432_decoy,TRY1,Decoy,0,-5.78194,-8.77,-2.06,-10.049450416818036
Nc1nc2c(nc(N/N=C\c3cccc([N+](=O)[O-])c3)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C35188436_decoy,TRY1,Decoy,0,-6.63813,-8.14,-2.3,-8.019684713705754
O[C@@H]1[C@H](O)[C@H](O)CO[C@@H]1Nc1ccc(-c2ccc(N[C@@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)cc2)cc1,C35338736_decoy,TRY1,Decoy,0,-5.83864,-6.77,-1.15,-4.80754692806717
O=C(O[C@H]1C=C(CO)[C@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C35455266_decoy,TRY1,Decoy,0,-7.29882,-7.24,-1.74,-6.0751621408164285
COc1cc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(=O)c(-c3ccc(O)cc3)coc2c1,C35465657_decoy,TRY1,Decoy,0,-7.24516,-8.53,-1.44,-6.699679712561564
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645674_decoy,TRY1,Decoy,0,-6.61387,-7.57,-1.93,-5.763317194997423
O=[N+]([O-])c1ccccc1O[C@@H]1O[C@@H](CO)[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C37246086_decoy,TRY1,Decoy,0,-4.54249,-5.7,-4.57,-4.0893960754500345
COCCNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1,C04399786_decoy,TRY1,Decoy,0,-6.26845,-7.47,-2.96,-6.929599148472921
COc1c(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc(O)c2c1O[C@@H](c1ccccc1)CC2=O,C36374612_decoy,TRY1,Decoy,0,-7.36861,-7.18,-0.61,-6.206455829086476
COc1c(O)cc2oc(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)cc(=O)c2c1O,C31160931_decoy,TRY1,Decoy,0,-9.13727,-8.43,-2.22,-6.601427989753428
O=C1c2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)cc2O[C@]1(O)Cc1ccc(O)cc1,C31154833_decoy,TRY1,Decoy,0,-7.18976,-8.05,-1.48,-5.782340479141092
O=C1c2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)cc2O[C@@]1(O)Cc1ccc(O)cc1,C31154829_decoy,TRY1,Decoy,0,-8.68648,-9.19,-3.48,-10.331696124317446
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C12495605_decoy,TRY1,Decoy,0,-7.77394,-8.36,-2.86,-7.695141674816091
Nc1nonc1N1[NH2+]N[C@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)[C@@H]1CN1CCOCC1,C38611388_decoy,TRY1,Decoy,0,-9.03606,-5.76,-1.42,-5.920854227674421
Nc1nonc1N1[NH2+]N[C@@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)[C@@H]1CN1CCOCC1,C38611389_decoy,TRY1,Decoy,0,-8.76017,-5.7,-1.31,-6.888913259909111
Nc1nonc1N1[NH2+]N[C@@H](C(=O)N/N=C/C2=c3ccccc3=[NH+]C2)[C@H]1CN1CCOCC1,C38611391_decoy,TRY1,Decoy,0,-10.0154,-6.26,-0.99,-6.095465348950349
COc1cc(O[C@H]2O[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)c2c(c1)O[C@@H](c1ccc(O)cc1)[C@H](O)C2=O,C39928749_decoy,TRY1,Decoy,0,-7.70466,-8.28,-2.59,-5.596067641436452
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C39937347_decoy,TRY1,Decoy,0,-5.37399,-6.83,-2.8,-4.775932042485327
C[C@@H]1CCCC[NH+]1C[C@@H]1[C@H](C(=O)N/N=C\C2=c3ccccc3=[NH+]C2)N=NN1c1nonc1N,C39948789_decoy,TRY1,Decoy,0,-8.2283,-7.93,-2.81,-7.450328080884439
C[C@H]1CCCC[NH+]1C[C@@H]1[C@H](C(=O)N/N=C\C2=c3ccccc3=[NH+]C2)N=NN1c1nonc1N,C39948790_decoy,TRY1,Decoy,0,-8.43811,-6.37,-2.97,-5.595544522948894
COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C43465485_decoy,TRY1,Decoy,0,-7.98109,-7.53,-2.68,-6.881116181755166
COc1ccc(-c2coc3cc(O[C@H]4O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)cc(O)c3c2=O)cc1,C43465495_decoy,TRY1,Decoy,0,-9.10051,-6.57,-3.14,-6.368929519702598
COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccccc3)oc12,C49601377_decoy,TRY1,Decoy,0,-6.71679,-6.82,-3.72,-5.735167618772213
Nc1nc2c(nc(N/N=C/c3c(Cl)cccc3Cl)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C59382128_decoy,TRY1,Decoy,0,-7.39997,-9.02,-1.87,-8.253009352423213
Nc1nc2c(nc(N/N=C/c3c(Cl)cccc3Cl)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C59382130_decoy,TRY1,Decoy,0,-8.42301,-9.44,-1.36,-8.766453487866054
CC(=O)Nc1ccccc1NC(=O)CCSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59888219_decoy,TRY1,Decoy,0,-9.52463,-8.46,-2.16,-7.658077294018714
NC1=[NH+]C(=S)N=C([O-])[C@H]1C(c1cn(-c2ccccc2)nc1-c1ccccc1)[C@@H]1C([O-])=NC(=S)[NH+]=C1N,C63598727_decoy,TRY1,Decoy,0,-7.5454,-6.11,-0.94,-5.318107473435199
COc1cc2cc(C(=O)NCCC(=O)NC3[NH+]=c4ccccc4=[NH+]3)[nH]c2c(OC)c1OC,C63821756_decoy,TRY1,Decoy,0,-7.54633,-5.98,-2.48,-5.411055051239907
COc1cc2cc(C(=O)N[C@@H](C)C(=O)NC3[NH+]=c4ccccc4=[NH+]3)[nH]c2c(OC)c1OC,C63821830_decoy,TRY1,Decoy,0,-7.65663,-6.79,-4.26,-5.378247338777914
CC1=N[C@H]2N[C@H](c3cccnc3)NN2C(Nc2cccc(C(=O)NC3[NH+]=c4ccccc4=[NH+]3)c2)=C1,C64791638_decoy,TRY1,Decoy,0,-9.95895,-9.26,-1.99,-7.187772844477766
C[NH+](C)CCNC(=O)C(=O)Nc1c(C(=O)Nc2ccccc2F)oc2ccccc12,C09705576_decoy,TRY1,Decoy,0,-8.16849,-8.04,-2.1,-8.348393988378891
Cc1n[nH]c(SCC[NH2+]Cc2cc3c(C)nn(-c4ccc(F)cc4)c3[nH]c2=O)n1,C12326872_decoy,TRY1,Decoy,0,-8.63733,-7.61,-1.66,-6.824071109304932
CCOC(=O)C1=C(C[NH+](C)CC(=O)Nc2ccc(F)c(F)c2F)NC(=O)N[C@@H]1C,C13058990_decoy,TRY1,Decoy,0,-7.35601,-7.01,-2.84,-5.761313783721947
CCOC(=O)C1=C(C[NH+](C)CC(=O)Nc2ccc(F)c(F)c2F)NC(=O)N[C@H]1C,C13058992_decoy,TRY1,Decoy,0,-8.37308,-7.23,-3.64,-6.236473659134278
CCOC(=O)C1=C(C[NH2+]CCN2CCOCC2)NC(=O)N[C@H]1c1cc(C)ccc1C,C19359360_decoy,TRY1,Decoy,0,-7.93876,-5.44,-4.12,-5.567701597550265
Cc1n[nH]c(SCCNC(=O)C[C@H]2C(=O)NCC[NH+]2C/C=C/c2ccccc2)n1,C19840133_decoy,TRY1,Decoy,0,-9.39093,-6.69,-3.09,-7.486263362244411
Cc1n[nH]c(SCCNC(=O)C[C@@H]2C(=O)NCC[NH+]2C/C=C/c2ccccc2)n1,C19840135_decoy,TRY1,Decoy,0,-7.63505,-6.61,-3.07,-6.140501414554516
CCc1ccccc1-n1c(SCC(=O)Nc2cccc(C)c2)nc2[nH]nc(C)c2c1=[NH2+],C02927476_decoy,TRY1,Decoy,0,-9.19771,-8.24,-3.16,-8.009107231027121
CC(C)CN(C[C@@H](O)[C@@H]([NH3+])Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1,C22048451_decoy,TRY1,Decoy,0,-6.50884,-7.11,-1.37,-6.237035590630618
CC(C)Cc1ccc(-c2cnc(CCC(=O)NC3CC[NH+](CC(N)=O)CC3)o2)cc1,C25518106_decoy,TRY1,Decoy,0,-9.74125,-6.0,-1.76,-5.810459764966242
C[NH+](C)[C@@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccsc1,C26149639_decoy,TRY1,Decoy,0,-8.70453,-7.4,-1.62,-5.968107131078427
C[NH+](C)[C@H](CNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1)c1ccsc1,C26149648_decoy,TRY1,Decoy,0,-9.19241,-5.57,-2.31,-5.540715659117011
CCc1ccccc1Nc1nc(N)nc(C[NH+](C)Cc2cnn(-c3ccccc3)c2)n1,C27551021_decoy,TRY1,Decoy,0,-7.08734,-6.33,-1.92,-5.278538521577501
COc1ccc([C@@H](CNC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)[NH+]2CCCCC2)cc1,C27669192_decoy,TRY1,Decoy,0,-8.89033,-6.02,-2.21,-5.799767809097967
NC(=O)c1c(NC(=O)CN2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)sc2c1CCC2,C22928809_decoy,TRY1,Decoy,0,-8.8734,-7.92,-1.88,-7.642961607255881
CC[C@@H]1CCCC[NH+]1Cc1ccc(C(=O)NC[C@@H]2Nc3ccccc3S2)c(=O)[nH]1,C39393654_decoy,TRY1,Decoy,0,-9.01626,-8.14,-2.51,-7.58044424908477
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(OC)cc23)C2(CC[NH2+]CC2)C1,C39598953_decoy,TRY1,Decoy,0,-8.76353,-7.77,-1.29,-6.790529167691738
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(OC)cc23)C2(CC[NH2+]CC2)C1,C39598955_decoy,TRY1,Decoy,0,-8.50476,-7.68,-2.99,-7.010158118012346
COc1ccccc1C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655842_decoy,TRY1,Decoy,0,-8.82513,-7.08,-1.87,-7.376327134944052
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NCc2cc3ccccc3[nH]2)C2(CC[NH2+]CC2)C1,C39671502_decoy,TRY1,Decoy,0,-7.58949,-8.12,-1.71,-6.181559070263824
CCSc1ncccc1C(=O)N1C[C@@H](C(=O)NCc2cc3ccccc3[nH]2)C2(CC[NH2+]CC2)C1,C39671503_decoy,TRY1,Decoy,0,-9.06328,-6.73,-3.22,-6.837069380906721
Cc1cccc(C(=O)N2C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c1,C39685700_decoy,TRY1,Decoy,0,-8.78025,-7.95,-0.96,-7.610196186437457
Nc1c(NCCc2ccccc2)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40726049_decoy,TRY1,Decoy,0,-7.0752,-6.32,-1.66,-5.607371714971239
COc1ccc(N2CCN(c3ncnc(NCC[NH+]4CCCCC4)c3N)CC2)cc1,C40727693_decoy,TRY1,Decoy,0,-9.32036,-7.31,-2.58,-6.621804386376264
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714124_decoy,TRY1,Decoy,0,-8.14969,-5.57,-3.0,-5.477619643277047
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714126_decoy,TRY1,Decoy,0,-8.50065,-6.34,-1.32,-6.20676698556975
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44714128_decoy,TRY1,Decoy,0,-7.66436,-6.46,-2.1,-5.71771287034249
C[NH+](C)C[C@H](CNC(=O)Nc1nnc(-c2ccccn2)s1)[C@H](O)c1ccccc1,C47791041_decoy,TRY1,Decoy,0,-7.51578,-6.44,-1.71,-5.549522986851042
C[NH+](C)C[C@@H](CNC(=O)Nc1nnc(-c2ccccn2)s1)[C@@H](O)c1ccccc1,C47791042_decoy,TRY1,Decoy,0,-8.34107,-6.51,-0.83,-5.810976558219361
C[NH+](C)C[C@H](CNC(=O)Nc1nnc(-c2ccccn2)s1)[C@@H](O)c1ccccc1,C47791043_decoy,TRY1,Decoy,0,-8.26645,-6.37,-3.82,-5.606790020675967
C[NH+](C)[C@@H](CNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1)c1cccs1,C48301234_decoy,TRY1,Decoy,0,-9.46544,-6.12,-2.84,-6.282799466905588
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)CCC4CCCC4)CC34CC[NH2+]CC4)[nH]c2c1,C44737127_decoy,TRY1,Decoy,0,-10.2387,-9.17,-1.0,-7.762744577178285
C[NH+]1CCN(Cc2ccccc2CNC(=O)NC[C@H](O)c2ccc(F)cc2F)CC1,C58168304_decoy,TRY1,Decoy,0,-9.67892,-6.85,-1.19,-7.948822886062546
C[NH+]1CCN(Cc2ccccc2CNC(=O)NC[C@@H](O)c2ccc(F)cc2F)CC1,C58168306_decoy,TRY1,Decoy,0,-9.71818,-6.57,-1.53,-6.997636084681717
COc1cc(C(=O)NC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)cc(Cl)c1OCC(N)=O,C59891157_decoy,TRY1,Decoy,0,-9.22992,-6.78,-1.45,-6.071511384368207
COc1cc(C(=O)NC[C@]2([NH+](C)C)CCC[C@@H](C)C2)cc(Cl)c1OCC(N)=O,C59891160_decoy,TRY1,Decoy,0,-8.31494,-5.35,-1.86,-5.298868868449294
COc1cc(C(=O)NC[C@]2([NH+](C)C)CCC[C@H](C)C2)cc(Cl)c1OCC(N)=O,C59891163_decoy,TRY1,Decoy,0,-9.43839,-4.7,-5.07,-5.168020473213455
CC(C)(C)NC(=O)NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39760482_decoy,TRY1,Decoy,0,-7.46453,-6.29,-1.44,-5.290322553790498
CC(C)CNC(=O)NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39760491_decoy,TRY1,Decoy,0,-7.92329,-5.44,-1.45,-5.145695902037767
CC(C)CNC(=O)NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39760492_decoy,TRY1,Decoy,0,-8.89959,-8.25,-1.76,-8.457063763898518
CC(C)NC(=O)NC(=O)[C@H](C)S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39763551_decoy,TRY1,Decoy,0,-9.0901,-6.56,-2.74,-6.35452548169983
CC(C)NC(=O)NC(=O)[C@@H](C)S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1,C39763553_decoy,TRY1,Decoy,0,-8.55374,-7.68,-2.51,-7.895210072888751
CS(=O)(=O)N[C@@H]1Nc2ccc(C(=O)NCCC3=c4ccccc4=[NH+]C3)cc2S1,C63280856_decoy,TRY1,Decoy,0,-8.77456,-7.0,-2.39,-5.784216253971283
CS(=O)(=O)N[C@H]1Nc2ccc(C(=O)NCCC3=c4ccccc4=[NH+]C3)cc2S1,C63280863_decoy,TRY1,Decoy,0,-9.48792,-7.15,-1.76,-6.054128457767286
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2=c3ccccc3=[NH+]C2)cc1,C63729909_decoy,TRY1,Decoy,0,-8.10053,-6.99,-3.69,-5.764924512019257
Cc1ccc2c(c1)=C(CCN1C[C@H](C(=O)N[C@H]3NN[C@H](CC(C)C)S3)CC1=O)C[NH+]=2,C63941183_decoy,TRY1,Decoy,0,-9.04706,-5.89,-1.52,-5.085959972952822
O=C(N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NC[C@H]1NN=C2CCCN21)c1cccs1,C64185691_decoy,TRY1,Decoy,0,-9.32067,-8.04,-1.0,-6.651466616571564
CC1=C(CSc2ncccc2C(=O)NNC(=O)C2=c3ccccc3=[NH+]C2)[C@@H](C)ON1,C64208106_decoy,TRY1,Decoy,0,-8.92411,-6.95,-1.68,-6.565849190881058
COc1ccc(CCC(=O)N[C@H](C)C(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc1,C13570969_decoy,TRY1,Decoy,0,-8.9592,-6.49,-1.45,-5.523304270420132
O=C(CS[C@@H]1NN=C(Nc2ccccc2)S1)NCCC1=c2ccccc2=[NH+]C1,C64713732_decoy,TRY1,Decoy,0,-8.16504,-7.3,-2.32,-6.836926591900346
CCNC(=S)N[C@@H]1C=C(C(=O)NCC(N)=O)C[C@@H](O)[C@@H]1O,C03838760_decoy,TRY1,Decoy,0,-8.67741,-6.54,-2.51,-8.147658881039119
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)C[NH3+])OC(C(=O)[O-])=C[C@H]1O,C03871305_decoy,TRY1,Decoy,0,-7.87551,-7.19,-3.01,-11.063276406646873
CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)C[NH3+])OC(C(=O)[O-])=C[C@@H]1O,C03871307_decoy,TRY1,Decoy,0,-8.33482,-5.17,-2.0,-5.735847105883435
CC(CO)(CO)NC(=O)C(=O)NC(C)(CO)CO,C02167956_decoy,TRY1,Decoy,0,-5.7429,-3.64,-3.17,-4.153284144517078
Cc1nc([C@](CCC(=O)NN)(CCC(C)C)C(=O)NN)cs1,C02096284_decoy,TRY1,Decoy,0,-7.41215,-4.18,-1.8,-4.60949275610364
CCCCC(C[C@@H](O)COCC(C)C)(C(=O)NN)C(=O)NN,C04807827_decoy,TRY1,Decoy,0,-7.28722,-4.62,-1.94,-5.244972371557721
CNC(=S)NN[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C05319990_decoy,TRY1,Decoy,0,-6.12342,-4.57,-2.8,-4.178116942796052
C[C@H](O)[C@H](O)[C@H](O)[C@H](O)[C@@H]1[NH2+][C@H](C(=O)[O-])CS1,C06183019_decoy,TRY1,Decoy,0,-7.38798,-4.68,-2.81,-4.541268421501226
OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C06184881_decoy,TRY1,Decoy,0,-4.97917,-4.74,-2.64,-3.950581832486324
OCC(CO)O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C06360546_decoy,TRY1,Decoy,0,-5.45229,-4.53,-3.12,-4.038589753770244
CN1C(=O)N(C)[C@H](NC(=O)NCCO)[C@H]1NC(=O)NCCO,C06878842_decoy,TRY1,Decoy,0,-6.926,-6.05,-2.37,-6.760869125662567
CCC(=O)NNC(=O)CSc1nnc(NN)n1N,C20922447_decoy,TRY1,Decoy,0,-7.56775,-6.71,-2.95,-7.838256852054664
Cc1csc(NC(=O)CSc2nnc(NN)n2N)n1,C21035817_decoy,TRY1,Decoy,0,-8.22065,-7.22,-0.71,-10.538653348005376
C[C@@H](NC(N)=O)C(=O)NNC(=S)NC1CCCC1,C27249600_decoy,TRY1,Decoy,0,-6.91473,-6.29,-3.87,-7.672820153802246
CC(C)[C@@H]1C(=O)N(C[C@@H](C)C(=O)NN)C(=O)N1CCC(=O)NN,C38656838_decoy,TRY1,Decoy,0,-6.66907,-6.47,-3.09,-6.971662175888659
COc1ccc(C2=C[C@H]([C@H]3NN[C@H](SCC(N)=O)N3N)N=N2)cc1,C39012298_decoy,TRY1,Decoy,0,-7.74039,-6.0,-2.13,-5.0259614259019445
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(N)=O)N3N)N=N2)cc1,C39012299_decoy,TRY1,Decoy,0,-8.22334,-8.23,-4.0,-6.981081566243086
NC(=O)C[C@H](NC(=O)C1([NH3+])CCCCC1)C(=O)[O-],C40472633_decoy,TRY1,Decoy,0,-7.01727,-4.45,-1.42,-4.716407150059093
CC(C)(C)[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)[O-],C40472706_decoy,TRY1,Decoy,0,-6.22548,-4.99,-1.9,-4.791799335285958
CCC[C@@](C)(NC(=O)[C@H]([NH3+])CC(N)=O)C(=O)[O-],C40482933_decoy,TRY1,Decoy,0,-8.22614,-5.79,-1.72,-7.747741555123162
C[C@H](NC(=O)N[C@@H](Cc1c[nH+]c[nH]1)C(=O)[O-])C(N)=O,C40578442_decoy,TRY1,Decoy,0,-6.91946,-5.86,-2.28,-5.803687156554522
C[C@@H]1CCC[C@](NC(=O)[C@H]([NH3+])CC(N)=O)(C(=O)[O-])C1,C41036736_decoy,TRY1,Decoy,0,-8.19701,-6.44,-1.31,-9.093172606714331
CC(C)(C)C(=O)NCC(=O)NC(C(N)=O)C(N)=O,C43694608_decoy,TRY1,Decoy,0,-6.54172,-6.02,-3.65,-7.229295532746314
OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C44020478_decoy,TRY1,Decoy,0,-5.4818,-4.65,-2.43,-4.141048855517102
[NH3+][C@@H](CC(C[C@H]([NH3+])C(=O)[O-])c1ccc(Cl)cc1)C(=O)[O-],C44286083_decoy,TRY1,Decoy,0,-7.41984,-6.82,-1.53,-8.472665731192727
[NH3+][C@@H](Cc1ccc(-c2ccccc2C[C@H]([NH3+])C(=O)[O-])o1)C(=O)[O-],C44291540_decoy,TRY1,Decoy,0,-6.02607,-4.9,-1.53,-4.290885831196111
[NH3+][C@H](Cc1ccccc1-c1ccc(C[C@H]([NH3+])C(=O)[O-])o1)C(=O)[O-],C44291544_decoy,TRY1,Decoy,0,-6.33463,-5.95,-2.15,-5.116013605624725
NNC(=O)CCN1CCN(CCC(=O)NN)C1=S,C44548683_decoy,TRY1,Decoy,0,-6.909,-4.41,-2.33,-4.931723791508432
N/C(=N/O)C1(C(=O)NCCS(N)(=O)=O)CCOCC1,C44785247_decoy,TRY1,Decoy,0,-7.55392,-4.19,-2.11,-4.814493682390589
N/C(=N/O)C1(C(=O)NCCCS(N)(=O)=O)CCOCC1,C45091460_decoy,TRY1,Decoy,0,-7.37354,-5.25,-1.79,-5.289493261778027
CC(C)C(=O)NNC(=O)NC(C(N)=O)C(N)=O,C45441108_decoy,TRY1,Decoy,0,-6.64241,-1.5,-2.22,-3.117279900752819
C[C@@H]1C[C@@H]1C(=O)NCCC(=O)NC(C(N)=O)C(N)=O,C48135719_decoy,TRY1,Decoy,0,-7.19225,-6.18,-2.05,-6.876321717063396
C[C@H]1C[C@H]1C(=O)NCCC(=O)NC(C(N)=O)C(N)=O,C48135722_decoy,TRY1,Decoy,0,-6.92324,-6.38,-4.42,-7.446923673006791
CC(C)NC(=O)C(=O)NNC(=O)[C@@H](C)NC(N)=O,C48482452_decoy,TRY1,Decoy,0,-6.13489,-6.32,-2.09,-6.6031314410224615
CC(C)NC(=O)C(=O)NNC(=O)CNC(N)=O,C48482473_decoy,TRY1,Decoy,0,-6.70552,-6.56,-1.88,-8.64830312076224
C[C@@H](NC(N)=O)C(=O)NNC(=O)C(=O)NC1CC1,C48482489_decoy,TRY1,Decoy,0,-6.23512,-6.9,-1.49,-7.051114294120683
CC(C)CC(=O)NNC(=O)NC(C(N)=O)C(N)=O,C48852964_decoy,TRY1,Decoy,0,-6.72534,-6.2,-1.32,-6.887315873018042
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)NC1CC1,C49128918_decoy,TRY1,Decoy,0,-6.52963,-4.39,-1.35,-4.312476019116642
CCCCNC(=O)NNC(=O)[C@@H](C)NC(N)=O,C49143375_decoy,TRY1,Decoy,0,-6.43307,-6.53,-2.68,-8.209912214614905
CCCCNC(=O)NNC(=O)[C@H](C)NC(N)=O,C49143377_decoy,TRY1,Decoy,0,-6.77628,-6.5,-3.79,-7.789503344704332
CC(C)c1ncc(NN)c(C(=O)N[C@H](C)C(N)=O)n1,C51128948_decoy,TRY1,Decoy,0,-7.09599,-5.87,-1.34,-4.565158299379372
Nc1nc(C(=O)NCCCS(N)(=O)=O)n[nH]1,C55169612_decoy,TRY1,Decoy,0,-7.49832,-7.23,-0.53,-8.198231927352815
CNC(=S)NN[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C05319987_decoy,TRY1,Decoy,0,-5.90603,-5.77,-2.41,-6.798569130977983
CCC(CO)(CO)NC(=O)COCC(=O)NN,C58838414_decoy,TRY1,Decoy,0,-6.14031,-4.12,-0.67,-4.754347975017377
CC(C)c1[nH]nc(C(=O)N(CC(N)=O)CC(N)=O)c1N,C61805643_decoy,TRY1,Decoy,0,-6.37357,-4.19,-2.05,-4.166860396799126
NC(=O)CN(CC(N)=O)C(=O)c1sccc1N,C61805796_decoy,TRY1,Decoy,0,-6.83697,-3.99,-3.19,-4.417355554929089
NC(=O)CN(CC(N)=O)c1cc2c(cc1N)CC(=O)N2,C61807635_decoy,TRY1,Decoy,0,-6.59535,-5.26,-0.89,-4.757572807916207
CC[C@H](C(=O)N(CC(N)=O)CC(N)=O)C(N)=S,C61808972_decoy,TRY1,Decoy,0,-6.86786,-3.69,-2.15,-4.867554613315495
NC(=O)CN(CC(N)=O)C(=O)C1(/C(N)=N/O)CCCCC1,C61809529_decoy,TRY1,Decoy,0,-6.89272,-4.91,-3.38,-4.783563040442821
C[C@H](C(=O)N(CC(N)=O)CC(N)=O)/C(N)=N/O,C61809537_decoy,TRY1,Decoy,0,-6.43833,-6.25,-2.51,-6.618989242682572
CCCOc1ccc(NC(=O)C[C@@H]2C(=O)N(C)C(=S)N2CCC[NH+]2CCC(C(N)=O)CC2)cc1,C04176751_decoy,TRY1,Decoy,0,-8.17878,-6.38,-2.37,-6.614557603182884
CCCOc1ccc(NC(=O)C[C@H]2C(=O)N(C)C(=S)N2CCC[NH+]2CCC(C(N)=O)CC2)cc1,C04176753_decoy,TRY1,Decoy,0,-9.58848,-6.68,-2.12,-7.111203927878726
CCOc1ccccc1NC(=O)[C@H](C)[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C08494433_decoy,TRY1,Decoy,0,-7.19788,-7.52,-3.48,-6.458852684880324
CCOc1ccccc1NC(=O)[C@@H](C)[NH+](CC)CC(=O)Nc1ccc(NC(C)=O)cc1,C08494439_decoy,TRY1,Decoy,0,-7.44415,-7.42,-2.35,-6.862437795477049
C[NH+](CC(=O)Nc1ccc(Cl)cc1)CC(=O)N(CCC(N)=O)c1ccc(F)cc1,C08940122_decoy,TRY1,Decoy,0,-8.07628,-6.67,-2.36,-7.530681841024671
CCCn1c(N)c(N(CCOC)C(=O)C[NH+](C)[C@@H]2CCCc3ccccc32)c(=O)[nH]c1=O,C09602920_decoy,TRY1,Decoy,0,-8.69678,-5.93,-3.56,-7.032619443342735
CCCn1c(N)c(N(CCOC)C(=O)C[NH+](C)[C@H]2CCCc3ccccc32)c(=O)[nH]c1=O,C09602925_decoy,TRY1,Decoy,0,-8.00073,-7.48,-5.7,-0.8631229474510441
COc1ccc([C@H](CNC(=O)c2ccccc2SC[C@@]2(C)NC(=O)NC2=O)[NH+]2CCCC2)cc1,C12752701_decoy,TRY1,Decoy,0,-9.65942,-7.5,-1.52,-7.609471529728599
COc1ccc([C@H](CNC(=O)c2ccccc2SC[C@]2(C)NC(=O)NC2=O)[NH+]2CCCC2)cc1,C12752713_decoy,TRY1,Decoy,0,-10.1102,-7.44,-2.14,-8.165195023392481
COc1ccccc1CCNC(=O)Cc1ccc(N2CCC([NH2+]CCc3nnc(C)[nH]3)CC2)cc1,C11791499_decoy,TRY1,Decoy,0,-8.93114,-7.35,-2.9,-6.993579886561027
CCCCN(C(=O)C[NH+](Cc1ccccc1)C(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14129413_decoy,TRY1,Decoy,0,-7.28233,-6.34,-4.18,-7.321365886990333
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccccc2N2CCCCC2)c(=O)[nH]c1=O,C15103858_decoy,TRY1,Decoy,0,-7.94358,-6.83,-3.75,-5.562489218820127
CCCCn1c(N)c(N(CC)C(=O)C[NH+](Cc2ccc(OC)cc2)C2CC2)c(=O)[nH]c1=O,C15486052_decoy,TRY1,Decoy,0,-8.15589,-6.47,-2.24,-7.406582092112707
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCc3ccco3)C[NH+]12,C15708658_decoy,TRY1,Decoy,0,-7.1272,-5.02,-0.98,-6.109029992054186
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccc(Cl)cc3)C[NH+]12,C15708670_decoy,TRY1,Decoy,0,-8.11774,-5.57,-0.99,-5.35817637529968
Cc1ccc(C[NH+](C)CC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1,C16587561_decoy,TRY1,Decoy,0,-6.49424,-7.06,-2.71,-5.610351189910847
NS(=O)(=O)c1ccc(CCN2C(=O)CC[C@H]2CC[NH2+]Cc2ccccc2F)cc1,C20256630_decoy,TRY1,Decoy,0,-8.134,-6.07,-2.13,-5.96730219081129
CC(=O)Nc1ccccc1-c1nc2ccc(C(=O)NCC[NH+](CC(C)C)CC(C)C)cc2[nH]c1=O,C09833444_decoy,TRY1,Decoy,0,-7.66595,-6.11,-4.31,-5.949828025375978
Cc1nc(CCNCc2cccc(OC[C@@H](O)C[NH+]3CCC(O)CC3)c2)sc1C,C20906457_decoy,TRY1,Decoy,0,-9.7187,-6.81,-2.4,-6.6133869595338926
CCOc1ccc(NC(=O)C[NH+](C)CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1OCC,C21580203_decoy,TRY1,Decoy,0,-7.4153,-8.22,-3.55,-6.622259204887108
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+](C)CC(=O)Nc2ccccc2C(F)(F)F)C1=O,C21580296_decoy,TRY1,Decoy,0,-7.33015,-7.83,-3.09,-6.384668469076899
CC(C)[NH+](CCn1c(SCC(=O)Nc2sccc2C(N)=O)nc2ccccc2c1=O)C(C)C,C21993117_decoy,TRY1,Decoy,0,-8.78278,-6.69,-2.53,-5.958583834160053
CC[NH+](CC(=O)NCc1cccs1)CC(=O)Nc1sc2c(c1C(=O)NCCOC)CCCC2,C24212283_decoy,TRY1,Decoy,0,-10.6441,-5.9,-3.28,-8.051173209650763
COCCn1c(N)c(C(=O)C[NH+](C)Cc2ccccc2OC(F)(F)F)c(=O)[nH]c1=O,C25534383_decoy,TRY1,Decoy,0,-6.77084,-6.91,-2.96,-6.473271724301811
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)CCCOc1ccc(F)cc1,C30268465_decoy,TRY1,Decoy,0,-8.69814,-7.13,-2.21,-6.51275801643976
CCOC(=O)c1sc(NC(=O)C[NH+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1C,C29062401_decoy,TRY1,Decoy,0,-9.04372,-6.47,-1.47,-6.175588832231288
CCOC(=O)c1c(NC(=O)CN2CC[NH+](Cc3ccc(Cl)cc3)CC2)sc(C(N)=O)c1C,C20168030_decoy,TRY1,Decoy,0,-10.447,-7.08,-1.47,-6.983429649135102
CCOC(=O)c1c(NC(=O)[C@@H](C)[NH2+]CC(=O)N[C@@H]2CCS(=O)(=O)C2)sc2c1CC[C@@H](C)C2,C36386091_decoy,TRY1,Decoy,0,-9.21236,-5.76,-1.83,-6.156077343340581
C[NH+](C)CCCNC(=S)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C04160445_decoy,TRY1,Decoy,0,-7.63498,-5.48,-5.06,-6.333089637207488
COC[C@H](C)Nc1c[nH+]c2c(c1)[C@@H](NC(C)=O)[C@@H](C(=O)OC)N2CCc1c[nH]c2ccccc12,C39344651_decoy,TRY1,Decoy,0,-9.37546,-6.71,-2.94,-6.775313977344239
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631613_decoy,TRY1,Decoy,0,-8.68337,-7.33,-2.27,-8.06213223085966
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693372_decoy,TRY1,Decoy,0,-8.19203,-5.84,-2.49,-5.756463793100913
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693374_decoy,TRY1,Decoy,0,-8.78317,-6.07,-2.15,-5.951253499819179
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693375_decoy,TRY1,Decoy,0,-8.80471,-5.43,-2.69,-6.385930354905863
CC(C)[NH+]1CCC(NC(=S)Nc2ccc(S(=O)(=O)NCc3ccccc3)cc2)CC1,C39970931_decoy,TRY1,Decoy,0,-7.76901,-6.42,-5.14,-5.668063485602079
COC(=O)c1c(NC(=O)CN2CC[NH+](Cc3ccc(SC)cc3)CC2)sc(C(N)=O)c1C,C39972166_decoy,TRY1,Decoy,0,-9.62832,-6.84,-0.85,-7.340004180677829
COc1cc(C[NH2+]CCNCCO)cc(Br)c1OCc1ccccc1C,C40719985_decoy,TRY1,Decoy,0,-7.62948,-5.96,-2.21,-5.281691702014951
O=C(NC[C@@H](O)C[NH+]1CCCCC1)C(=O)Nc1ccccc1SCC(F)(F)F,C41642731_decoy,TRY1,Decoy,0,-8.38182,-7.08,-3.65,-8.438711218985373
COc1cccc(CNC(=O)[C@H]2C[NH2+]C[C@@H]2C(=O)N[C@H](C)CCCC(C)C)c1OC,C43222655_decoy,TRY1,Decoy,0,-8.82705,-6.41,-3.49,-5.9506453200529
C[NH+](C)CCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2NC(=O)Cc1cccs1,C43547816_decoy,TRY1,Decoy,0,-10.0432,-5.48,-1.58,-7.592521030110171
COCCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]Cc1cccn1C,C44681601_decoy,TRY1,Decoy,0,-9.02528,-6.23,-1.91,-6.13510409816603
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)CC(=O)Nc1c(C)cccc1C(C)C,C07669856_decoy,TRY1,Decoy,0,-6.77659,-7.14,-3.8,-6.16463529725916
C=CC[NH2+]CC(=O)Nc1nnc(SCC(=O)Nc2ccc(Br)cc2)s1,C59435192_decoy,TRY1,Decoy,0,-9.73033,-6.96,-2.14,-7.135260356068948
CC[NH+](CC)[C@@H](CNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)c1ccccc1,C59876075_decoy,TRY1,Decoy,0,-9.64459,-6.62,-2.49,-6.454712911842627
CC[NH+](CC)[C@H](CNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)c1ccccc1,C59876077_decoy,TRY1,Decoy,0,-8.60902,-6.52,-2.92,-6.082426358716701
CCCCn1c(N)c(N(CC)C(=O)C[NH+](Cc2cccc(F)c2)C[C@@H]2CCCO2)c(=O)[nH]c1=O,C60245094_decoy,TRY1,Decoy,0,-8.42479,-5.97,-3.5,-8.76106527962606
COc1ccc(OC)c2[nH]c(C(=O)NCCC(=O)NCCC3=c4ccccc4=[NH+]C3)cc12,C63270464_decoy,TRY1,Decoy,0,-8.61624,-7.54,-2.12,-6.596774360679902
CCN[C@@H]1NN=C(SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)OC)S1,C63855248_decoy,TRY1,Decoy,0,-7.40367,-6.48,-1.67,-6.04329408664958
NC(=O)[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)COC(=O)CCCC1=c2ccccc2=[NH+]C1,C63896801_decoy,TRY1,Decoy,0,-8.47321,-8.27,-2.8,-7.461634027016228
NC(=O)[C@H]1C2=C(CCC2)S[C@H]1NC(=O)COC(=O)CCCC1=c2ccccc2=[NH+]C1,C63896804_decoy,TRY1,Decoy,0,-8.61478,-7.52,-2.84,-6.431422671603816
NC(=O)CNC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@@H](NC(=O)Nc2ccc(OC(F)(F)F)cc2)C1,C04221830_decoy,TRY1,Decoy,0,-8.20524,-5.93,-1.3,-5.679511946150946
CC(C)(C)C[C@](CCC(=O)NN)(C(=O)NN)c1csc(N)n1,C02207998_decoy,TRY1,Decoy,0,-7.23397,-5.92,-1.3,-8.38750432874546
NNC(=O)c1cnn(-c2ccc(N(CCO)CCO)nn2)c1N,C01580561_decoy,TRY1,Decoy,0,-7.4365,-7.34,-1.5,-12.75260030903308
OC[C@@H]1O[C@](CO)(NNC(=S)Nc2ccccc2)[C@H](O)[C@@H]1O,C05338401_decoy,TRY1,Decoy,0,-6.19533,-5.73,-3.06,-4.867281670566555
CC(C)C[C@](CCC(=O)NN)(C(=O)NN)c1csc(N)n1,C01899798_decoy,TRY1,Decoy,0,-6.17209,-6.44,-1.31,-7.291241109085605
CCCCOC[C@H](O)C[C@@H](CCC(=O)NN)C(=O)NN,C04610499_decoy,TRY1,Decoy,0,-7.81548,-5.9,-1.66,-7.702281126854522
CC(C)C[C@@](CCC(=O)NN)(C(=O)NN)c1csc(N)n1,C01899799_decoy,TRY1,Decoy,0,-8.02264,-6.81,-2.49,-9.273854686937328
OC[C@H]1O[C@](CO)(NNC(=S)Nc2ccccc2)[C@@H](O)[C@@H]1O,C16489970_decoy,TRY1,Decoy,0,-6.63732,-7.02,-3.43,-7.813031562513991
Cc1ccc(NC(=O)N[C@H]2C[C@](O)(C(=O)NCCCC(N)=O)C[C@@H](O)[C@@H]2O)cc1,C25192324_decoy,TRY1,Decoy,0,-8.81978,-8.45,-2.0,-9.83087688385072
CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=S)NC1CCCC1,C27249633_decoy,TRY1,Decoy,0,-7.55684,-5.87,-2.22,-6.136323626225201
NOCC(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12,C27646488_decoy,TRY1,Decoy,0,-9.41911,-6.72,-1.25,-7.273655050122493
NC(=O)N/N=C/c1cn(C[C@H](O)C[NH2+]CC(=O)[O-])c2ccccc12,C28295725_decoy,TRY1,Decoy,0,-5.88796,-5.09,-2.05,-4.822977893809299
COc1cc([C@@H](O)[C@@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,C31155162_decoy,TRY1,Decoy,0,-7.8579,-7.27,-3.25,-6.330124366983334
NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCC(N)=O,C37660688_decoy,TRY1,Decoy,0,-6.66032,-5.34,-1.98,-6.307596845956345
[H]/N=C(/NC[C@H]1CCC[NH+]1CC)N/C(N)=N/c1ccc(C)cc1,C38635591_decoy,TRY1,Decoy,0,-7.35625,-5.45,-1.89,-4.953120977859258
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(NN)c2N)cc1,C40759464_decoy,TRY1,Decoy,0,-7.9752,-7.17,-1.74,-10.921183500791456
NC(=O)C[C@@H]([NH3+])C(=O)NCCCOC[C@@H]1CCCO1,C40826386_decoy,TRY1,Decoy,0,-8.56945,-4.94,-2.55,-6.970475769572256
NC(=O)C[C@H]([NH3+])C(=O)NCCCOC[C@H]1CCCO1,C40826388_decoy,TRY1,Decoy,0,-8.59069,-5.6,-2.12,-7.403472272695391
COc1ccc([C@H](O)CC[NH+](CCO)CCO)cc1N,C41140355_decoy,TRY1,Decoy,0,-7.19672,-5.21,-1.27,-4.963819614974022
COc1ccc([C@@H](O)CC[NH+](CCO)CCO)cc1N,C41140357_decoy,TRY1,Decoy,0,-6.7517,-5.46,-2.47,-6.941126454821789
NC(=O)c1ccc(Nc2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])cc1,C41300804_decoy,TRY1,Decoy,0,-6.64384,-8.1,-1.34,-9.468683666383662
C=CCNC(=S)NNC(=O)C[C@H](NC(N)=O)c1cccs1,C42011715_decoy,TRY1,Decoy,0,-8.02566,-4.93,-3.33,-5.407391234510152
C[C@@H](NC(N)=O)C(=O)NNC(=S)NC[C@H]1CCCO1,C42084697_decoy,TRY1,Decoy,0,-6.4318,-6.06,-1.55,-5.094741912916557
CC[C@@H](C)[C@H](NC(N)=O)C(=O)NNC(=S)NC1CC1,C42236020_decoy,TRY1,Decoy,0,-6.83339,-5.18,-2.92,-5.2266694830806895
CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NNC(=S)NC1CC1,C42236022_decoy,TRY1,Decoy,0,-7.45529,-5.51,-2.2,-6.806428887213718
NOCC(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21,C43328793_decoy,TRY1,Decoy,0,-8.87808,-6.19,-1.9,-6.293479262689014
CCCCC/C=C\C[C@@H](O)/C=C/C=C\C=C\[C@@H](O)CCCC(=O)NCCC[NH3+],C43898788_decoy,TRY1,Decoy,0,-10.1493,-5.6,-2.49,-6.308691095437237
[NH3+][C@H](CC(=O)[O-])C(c1ccc([N+](=O)[O-])cc1)[C@@H]([NH3+])CC(=O)[O-],C44218746_decoy,TRY1,Decoy,0,-6.48629,-5.4,-1.75,-5.070916770281178
CCC[C@H](C(=O)NCCCS(N)(=O)=O)/C(N)=N/O,C45091474_decoy,TRY1,Decoy,0,-7.84179,-5.76,-3.28,-6.718394397016474
CSCC[C@H](NC(N)=O)C(=O)NNC(=S)NC1CCCC1,C47872020_decoy,TRY1,Decoy,0,-8.98496,-5.24,-3.02,-6.1828230185517326
CC(C)CCNC(=S)NNC(=O)[C@H](NC(N)=O)C(C)C,C47872253_decoy,TRY1,Decoy,0,-8.04206,-5.88,-3.07,-8.45007765228772
C[C@@H](CNC(=O)NC(C(N)=O)C(N)=O)Cn1cccn1,C48857452_decoy,TRY1,Decoy,0,-7.43401,-6.46,-3.28,-7.013386369665079
C[C@H](CNC(=O)NC(C(N)=O)C(N)=O)Cn1cccn1,C48857456_decoy,TRY1,Decoy,0,-7.6877,-6.34,-3.19,-6.969316398782731
NC(=O)Cn1cc(NC(=O)CCCCNC(N)=O)cn1,C49097296_decoy,TRY1,Decoy,0,-8.39076,-5.46,-2.22,-6.595621601386484
CSCC[C@H](NC(N)=O)C(=O)NNC(=O)NC1CC1,C49128936_decoy,TRY1,Decoy,0,-6.59042,-3.99,-2.39,-4.751530997316727
CCCc1[nH]nc(C(=O)NCCCS(N)(=O)=O)c1N,C50323203_decoy,TRY1,Decoy,0,-7.48148,-4.99,-1.84,-5.030196871001529
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H](O)[C@H](O)[C@@H](O)CO,C31160536_decoy,TRY1,Decoy,0,-8.85345,-7.6,-1.59,-10.402372347867848
C=CCNC(=S)NNC(=O)[C@H](CC(C)C)NC(N)=O,C58169959_decoy,TRY1,Decoy,0,-6.96686,-4.21,-1.35,-4.530696618120492
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=S)Nc1ccccc1,C59371120_decoy,TRY1,Decoy,0,-8.75727,-5.39,-3.93,-6.45000729130102
CCOCCCNC(=S)NNC(=O)[C@@H](NC(N)=O)C(C)C,C60400376_decoy,TRY1,Decoy,0,-7.23491,-5.35,-1.7,-5.517974085331948
Cc1ccsc1[C@@H]([C@H](C)[NH3+])N(CC(N)=O)CC(N)=O,C61805074_decoy,TRY1,Decoy,0,-7.41858,-4.21,-4.22,-5.114809008168479
CCc1ccc(N)cc1S(=O)(=O)N(CC(N)=O)CC(N)=O,C61807232_decoy,TRY1,Decoy,0,-6.6147,-5.12,-3.35,-7.523948339732278
NC(=O)CN(CC(N)=O)CC(=O)c1ccc(O)cc1O,C61808154_decoy,TRY1,Decoy,0,-6.72315,-7.08,-0.97,-10.887201713779191
CCC[C@@H](C(=O)N(CC(N)=O)CC(N)=O)/C(N)=N/O,C61809547_decoy,TRY1,Decoy,0,-6.37766,-4.43,-2.25,-4.919198668715444
CC(C)[C@@H](C(=O)N(CC(N)=O)CC(N)=O)/C(N)=N/O,C61809554_decoy,TRY1,Decoy,0,-6.72636,-4.3,-1.49,-4.592747476849325
NC(=O)C(NC(=O)NCCCOc1ccc(F)cc1)C(N)=O,C63800404_decoy,TRY1,Decoy,0,-7.63385,-6.34,-2.42,-6.668483096534953
Cc1ccccc1[C@@H](CC(=O)NNC(=O)NCC(C)C)NC(N)=O,C65179565_decoy,TRY1,Decoy,0,-7.85823,-4.94,-1.3,-5.709450475614656
CC(C)C[C@H](NC(N)=O)C(=O)NNC(=S)NC[C@H]1CCCO1,C66276934_decoy,TRY1,Decoy,0,-8.13053,-5.56,-2.52,-8.759856001270027
CC(C)C[C@@H](NC(N)=O)C(=O)NNC(=S)NC[C@H]1CCCO1,C66276935_decoy,TRY1,Decoy,0,-7.53408,-5.88,-1.1,-6.027801878618618
CCOCCCNC(=O)NNC(=O)[C@H](NC(N)=O)C(C)C,C67648137_decoy,TRY1,Decoy,0,-6.77534,-5.93,-2.8,-6.404375432103305
CC1(C)O[C@@H]2[C@@H](O1)[C@@H](O)[C@@H](O[C@H]1[C@@H](O)[C@@H](O)[C@@H](OCc3ccccc3)O[C@H]1CO)O[C@@H]2CO,C04534142_decoy,TRY1,Decoy,0,-5.6878,-6.06,-3.24,-4.691317943324209
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C04557190_decoy,TRY1,Decoy,0,-4.57409,-5.48,-1.92,-3.85442975251525
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C04565980_decoy,TRY1,Decoy,0,-7.2446,-7.47,-3.9,-6.628920317200127
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C05260518_decoy,TRY1,Decoy,0,-4.95779,-6.57,-1.82,-4.817449942276089
CCCCO[C@@H]1[C@H]2OC(C)(C)O[C@@H]2O[C@@H]1[C@H](O)CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1NC(C)=O,C10001626_decoy,TRY1,Decoy,0,-4.98112,-6.01,-2.54,-4.6703111831498525
Nc1ncnc2c1nc(N/N=C/C=C/c1ccc([N+](=O)[O-])o1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C09975209_decoy,TRY1,Decoy,0,-7.94839,-8.33,-3.4,-8.783346585491785
CS(=O)(=O)Oc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C09975277_decoy,TRY1,Decoy,0,-7.85345,-7.92,-0.37,-6.581554272950442
CCCc1cc(=O)oc2c(C)c(OCC(=O)N(C)C[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)ccc12,C12892498_decoy,TRY1,Decoy,0,-7.86495,-8.11,-2.7,-6.108513028978459
O=[N+]([O-])c1cccc(N[C@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,C13476088_decoy,TRY1,Decoy,0,-6.12706,-5.38,-2.14,-4.319492960327848
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H]2O)cc1,C13519137_decoy,TRY1,Decoy,0,-5.21499,-7.34,-3.68,-4.560216813616835
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205618_decoy,TRY1,Decoy,0,-4.90523,-5.96,-4.15,-4.18832139591303
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15205651_decoy,TRY1,Decoy,0,-4.78496,-6.39,-3.33,-4.262283368697148
O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C15205675_decoy,TRY1,Decoy,0,-4.61921,-6.71,-2.8,-4.292906758014068
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)cc1,C15206261_decoy,TRY1,Decoy,0,-5.98589,-7.57,-4.5,-4.942721914659753
O=C1c2cccc3c(NC(CO)(CO)CO)ccc(c23)C(=O)N1/N=C/c1ccc(O)c(O)c1,C16431496_decoy,TRY1,Decoy,0,-9.85353,-8.06,-2.23,-8.570904059713053
CCOc1ccc(C=NNc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1O,C19203741_decoy,TRY1,Decoy,0,-7.61599,-8.11,-1.56,-6.667784413532351
O=[N+]([O-])c1ccccc1O[C@H]1O[C@H](CO)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O,C22064859_decoy,TRY1,Decoy,0,-4.89503,-7.67,-2.9,-4.84444906926401
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22064961_decoy,TRY1,Decoy,0,-5.33523,-7.39,-2.89,-5.269010109602437
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)cc1,C22065001_decoy,TRY1,Decoy,0,-6.33516,-8.25,-2.15,-5.360488017919853
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)cc1,C22065012_decoy,TRY1,Decoy,0,-5.77809,-7.8,-1.94,-6.931980174514919
O=C(OCC1=C[C@H](O)[C@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12)c1ccccc1,C31156316_decoy,TRY1,Decoy,0,-7.83252,-8.23,-2.34,-7.391873353200415
COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](OC[C@@H](C)[C@]3(O)COC(=O)C3)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O,C31167138_decoy,TRY1,Decoy,0,-8.82819,-7.34,-2.92,-7.592748158997752
O=[N+]([O-])c1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)cc1,C33770973_decoy,TRY1,Decoy,0,-6.11773,-6.12,-3.55,-4.640754837818387
C[C@H](O)[C@H](O)[C@H](O)[C@@H](OCCO)Oc1ccc(C(=O)/C=C/c2ccc3c(c2)OCCO3)c(O)c1,C34898295_decoy,TRY1,Decoy,0,-10.7367,-5.65,-1.96,-8.157588247124517
Nc1ncnc2c1ncn2[C@@H]1O[C@@H](COS(=O)(=O)/N=C(\[O-])[C@H]([NH3+])CS)[C@@H](O)[C@H]1O,C34920696_decoy,TRY1,Decoy,0,-8.48555,-8.25,-1.67,-9.166631053850132
CCOc1ccc(/C=N\Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1O,C35188411_decoy,TRY1,Decoy,0,-6.98138,-8.34,-3.17,-8.072007647244636
O=C(O[C@@H]1C=C(CO)[C@@H]2[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)OC=C[C@@H]21)c1ccc(O)cc1,C35455270_decoy,TRY1,Decoy,0,-6.69947,-7.54,-3.23,-6.631670665599094
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C35645678_decoy,TRY1,Decoy,0,-5.64647,-7.54,-1.57,-6.390957770523406
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)cc1,C35645732_decoy,TRY1,Decoy,0,-5.1674,-6.4,-3.06,-4.569346831938512
CC(C)(C)NC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)[C@@H]1CCC(=O)N1,C36504530_decoy,TRY1,Decoy,0,-7.71286,-5.84,-3.85,-6.161290080932458
O=C1CCC=C[C@@]1(O)C(=O)OCc1cccc(O)c1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O,C35457135_decoy,TRY1,Decoy,0,-6.82105,-5.53,-3.26,-4.737675129199412
C[C@H](O)[C@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C38665116_decoy,TRY1,Decoy,0,-8.24828,-9.34,-1.34,-8.598984009721296
C[C@@H](O)[C@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C38665118_decoy,TRY1,Decoy,0,-6.99715,-8.82,-1.75,-7.875197616706599
C[C@H](O)[C@@H]([NH3+])/C([O-])=N/S(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O,C38665120_decoy,TRY1,Decoy,0,-9.05452,-9.37,-1.34,-9.532945450242996
CCOC(=O)[C@@H]1N[NH2+]N(c2nonc2N)[C@@H]1CSC1=N[C@H]2[NH+]=c3ccccc3=C2N=N1,C39205159_decoy,TRY1,Decoy,0,-9.2686,-7.79,-3.57,-6.4311305501919085
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1,C39937348_decoy,TRY1,Decoy,0,-6.52301,-6.25,-2.61,-5.201869551619208
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C39937356_decoy,TRY1,Decoy,0,-6.19388,-7.01,-2.64,-4.9691519688181565
O=c1nc(SSc2ccn([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c(=O)n2)ccn1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O,C39945445_decoy,TRY1,Decoy,0,-8.09278,-6.18,-3.47,-6.535251940675956
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]2O)c(Cl)c1,C43193664_decoy,TRY1,Decoy,0,-7.25828,-7.52,-1.79,-5.736140511667375
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(Cl)c1,C43193668_decoy,TRY1,Decoy,0,-5.02497,-6.15,-4.61,-4.191859881298851
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1c(O)cccc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C43759584_decoy,TRY1,Decoy,0,-7.2023,-8.23,-1.56,-7.128556132245111
O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]2O)cc1,C44021695_decoy,TRY1,Decoy,0,-6.74277,-5.29,-2.47,-4.559012758949786
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1,C44021730_decoy,TRY1,Decoy,0,-5.54139,-7.63,-3.68,-4.753953609268225
CNC(=O)CCSCCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,C44171696_decoy,TRY1,Decoy,0,-6.98697,-5.58,-3.97,-5.327662514988557
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1,C44963934_decoy,TRY1,Decoy,0,-6.09062,-5.75,-2.26,-4.592950321137837
O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,C44963976_decoy,TRY1,Decoy,0,-4.82834,-7.02,-2.4,-5.266464830698714
[NH3+][C@@H](CSc1ccc(O)cn1)C(=O)N[C@H](C(=O)[O-])[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O,C48998648_decoy,TRY1,Decoy,0,-6.7174,-7.23,-5.12,-6.060062595660519
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CCCC[C@@H]2O)O[C@H](CO)[C@H]1O,C49601709_decoy,TRY1,Decoy,0,-9.15418,-6.5,-2.66,-6.779583364964199
CC(C)[NH2+]C[C@H](O)COc1ccc(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c2ccccc12,C65743003_decoy,TRY1,Decoy,0,-5.74257,-7.98,-2.96,-6.264404589149597
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@H]3SCC[NH3+],C05492861_decoy,TRY1,Decoy,0,-9.2911,-6.97,-1.29,-5.898320582389969
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3SCC[NH3+],C05492863_decoy,TRY1,Decoy,0,-8.2867,-7.99,-1.83,-5.860490893286726
CC[NH+](CC)CCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC(C)(C)C)c1ccc(Cl)cc1,C06511813_decoy,TRY1,Decoy,0,-9.63548,-6.94,-1.45,-8.990881628204821
Cc1ccc(N2C(=S)N[C@H]3[C@@H](O)[C@H](O)C[C@@H](C(=O)NCC[NH+]4CCOCC4)[C@H]32)cc1Cl,C08636339_decoy,TRY1,Decoy,0,-10.118,-5.79,-3.55,-6.069019082442644
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]21,C08791071_decoy,TRY1,Decoy,0,-8.69414,-7.22,-1.92,-6.039518831661641
C[C@@H](CCc1ccccc1)n1c(O)nc(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09109277_decoy,TRY1,Decoy,0,-8.33626,-8.61,-2.08,-7.001403569844635
CC[C@H](CO)/[NH+]=C/[C@]12CC[C@H](O)C[C@]1(O)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C09167573_decoy,TRY1,Decoy,0,-7.98712,-7.3,-2.2,-6.184227078697371
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C[NH3+],C12877906_decoy,TRY1,Decoy,0,-9.87044,-7.3,-2.85,-6.386206901533528
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)c1,C12901444_decoy,TRY1,Decoy,0,-6.8078,-6.42,-1.11,-5.439694870201516
C[C@H](c1ccccc1)N1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@]3(C(=O)Nc4ccccc43)[C@@H]2C1=O,C12901822_decoy,TRY1,Decoy,0,-7.74236,-7.65,-1.33,-7.003776239718347
Cc1cccc(C)c1NC(=O)C[NH+](C)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C16625391_decoy,TRY1,Decoy,0,-7.3888,-7.7,-1.86,-5.7641627526033306
C[C@H](CCc1ccccc1)n1c(O)nc(O)c([C@H]2[NH2+]CCc3c2[nH]c2ccccc32)c1=O,C09109276_decoy,TRY1,Decoy,0,-7.78489,-7.88,-2.12,-6.927757719784401
COc1cccc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)c1O,C20834506_decoy,TRY1,Decoy,0,-9.09816,-6.34,-2.89,-6.484963250922914
C/C(=N\Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1)c1ccc(F)cc1,C20835460_decoy,TRY1,Decoy,0,-8.86216,-6.06,-1.73,-5.520935156539058
NC(=O)COc1ccc2ccccc2c1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1Cl,C20872811_decoy,TRY1,Decoy,0,-8.09626,-6.21,-2.58,-7.287242334409623
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cccc4ccccc34)n2)CC(C)(C)[NH2+]1,C20905551_decoy,TRY1,Decoy,0,-8.96358,-9.3,-3.63,-10.12238196011269
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccc(F)c(Cl)c2)NCCc2c[nH]c[nH+]2)n1,C14156543_decoy,TRY1,Decoy,0,-10.4099,-7.21,-1.07,-8.624342830616623
C=CCNc1[nH+]n(CC(=O)Nc2c(C)cccc2CC)c(N)c1-c1nc(-c2ccc(Cl)cc2)no1,C23125518_decoy,TRY1,Decoy,0,-9.57854,-7.82,-2.52,-9.647665804356562
N/C(COc1ccc(Cl)cc1Cl)=[NH+]\NC(=O)/C=C/NOCc1ccc(Cl)cc1Cl,C20366338_decoy,TRY1,Decoy,0,-9.52317,-7.27,-2.34,-7.528177443557798
COc1ccc(OC)c(NC(=O)[C@H]2C[C@@H]([C@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(Cl)cc23)c1,C35808851_decoy,TRY1,Decoy,0,-7.12237,-6.95,-2.51,-5.483317235016558
COc1ccc(OC)c(NC(=O)[C@H]2C[C@@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(F)cc23)c1,C36569550_decoy,TRY1,Decoy,0,-7.42387,-6.29,-2.51,-5.496961399342105
Cc1cc(C)nc(N/C(=N\C(=S)NCCCN2CCOCC2)NC2CC(C)(C)[NH2+]C(C)(C)C2)n1,C14158068_decoy,TRY1,Decoy,0,-9.88117,-5.78,-2.68,-7.20683587331993
O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1C[C@@H]2[NH2+][C@H](c3ccc(Cl)cc3)C[C@H](C(F)(F)F)N2N1,C39237429_decoy,TRY1,Decoy,0,-8.44027,-7.76,-1.41,-6.239936075891425
O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1C[C@@H]2[NH2+][C@H](c3ccc(Cl)cc3)C[C@@H](C(F)(F)F)N2N1,C39237431_decoy,TRY1,Decoy,0,-10.2232,-9.52,-1.35,-7.980554045634722
O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1C[C@@H]2[NH2+][C@H](c3ccc4c(c3)OCO4)C[C@@H](C(F)(F)F)N2N1,C39440411_decoy,TRY1,Decoy,0,-8.4521,-9.68,-1.3,-6.770478160531616
O=S(=O)(Oc1ccccc1)c1ccc([C@@H](CNO)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534239_decoy,TRY1,Decoy,0,-9.48363,-8.67,-2.37,-8.219527865804855
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](C)ON1,C39597936_decoy,TRY1,Decoy,0,-8.11476,-9.04,-1.74,-7.12744299997943
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39656192_decoy,TRY1,Decoy,0,-9.60743,-8.27,-2.59,-7.535837073430093
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39656197_decoy,TRY1,Decoy,0,-8.88701,-8.05,-2.74,-7.202913918240453
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c1F,C39661794_decoy,TRY1,Decoy,0,-10.586,-6.83,-1.88,-6.593082177469739
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2,C39661801_decoy,TRY1,Decoy,0,-8.67041,-9.07,-1.51,-7.7493947162424766
CC1=C(C(=O)N2C[C@H](C(=O)NCc3nc4ccccc4c(=O)[nH]3)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39676336_decoy,TRY1,Decoy,0,-8.87554,-7.65,-2.43,-6.638470247514222
CC1=C(C(=O)N2C[C@@H](C(=O)NCc3nc4ccccc4c(=O)[nH]3)C3(CC[NH2+]CC3)C2)[C@H](c2ccccc2)NO1,C39676338_decoy,TRY1,Decoy,0,-8.88272,-7.05,-1.92,-6.267127434344367
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1C[C@H]2[NH2+][C@H](c3ccco3)C[C@H](C(F)(F)F)N2N1,C39709607_decoy,TRY1,Decoy,0,-8.32587,-8.32,-2.3,-6.203916844754801
CCCCCCc1cc2cc(/C(N)=[NH+]/NC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)oc2cc1O,C01882384_decoy,TRY1,Decoy,0,-8.52634,-5.98,-3.46,-7.343531301931027
COc1ccc(N2CCN(c3ncnc(NC4CC(C)(C)[NH2+]C(C)(C)C4)c3N)CC2)cc1,C40727725_decoy,TRY1,Decoy,0,-9.34218,-6.43,-2.97,-5.142895211199448
CCCOc1c(Br)cc(C[NH2+]CCNC(=O)c2nonc2N)cc1OC,C40744438_decoy,TRY1,Decoy,0,-7.00534,-6.76,-3.02,-5.894358487669779
O=C1[C@@H]2[C@@H](C(=O)N1CC[NH2+]Cc1ccccc1)[C@](CO)(C(=O)[O-])[NH2+][C@H]2c1ccc(/C=C/c2ccccc2)cc1,C33918625_decoy,TRY1,Decoy,0,-8.35328,-8.53,-1.6,-6.6162922747117525
C[NH2+]C1CCN(c2cc(C)c3nc([C@H]4C(=O)N=CC=C4NC[C@@H](O)c4cccc(Cl)c4)[nH]c3c2)CC1,C52550760_decoy,TRY1,Decoy,0,-10.4718,-7.88,-2.14,-7.211729697601436
COc1ccc2[nH]cc(CCNC3=[NH+][C@@H](c4ccccc4)N4C(=O)C[C@@H](C)N[C@H]4N3)c2c1,C39357287_decoy,TRY1,Decoy,0,-7.97657,-6.4,-3.25,-5.548689056016208
CSc1ccc([C@H]2[NH+]=C(NCCc3c[nH]c4ccccc34)N[C@@H]3N[C@@H](C)CC(=O)N32)cc1,C39357298_decoy,TRY1,Decoy,0,-10.3866,-5.55,-1.27,-6.181830852422026
CC1=C(C[NH2+]CCCc2n[nH]c(N)c2C#N)[C@H](C)N(Cc2c(Cl)cccc2Cl)N1,C39940014_decoy,TRY1,Decoy,0,-8.88623,-8.11,-3.93,-7.793228281809076
O=C(C[C@H]1NO[C@@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63807085_decoy,TRY1,Decoy,0,-10.5467,-7.29,-4.17,-7.727039811421653
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1nc(N)nc(Nc2ccccc2)n1,C64352909_decoy,TRY1,Decoy,0,-10.745,-7.58,-3.49,-7.789335911915336
C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)N[C@@H](CCCC(N)=[NH2+])C(=O)OC)CC[C@]4(C)[C@H]3CC[C@@]21C,C08762532_decoy,TRY1,Decoy,0,-10.8842,-8.97,-2.41,-8.386092300462677
CC[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2c(O)[nH]c(=O)n(Cc3ccc(OC)cc3)c2=O)[NH2+]1,C08764232_decoy,TRY1,Decoy,0,-8.67607,-6.01,-1.8,-5.531037408134484
NC(=O)CC[C@@H]1[NH2+][C@]2(C(=O)Nc3c(Cl)cccc32)[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)[C@H]12,C08790905_decoy,TRY1,Decoy,0,-9.97196,-6.8,-4.95,-0.4964719119365223
Cc1cc(Cl)c2c(c1)[C@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C08791308_decoy,TRY1,Decoy,0,-6.98061,-7.24,-1.83,-5.684582735239493
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC(C)(C)[NH2+]C4(C)C)cc2)C1,C04177853_decoy,TRY1,Decoy,0,-8.55585,-6.19,-2.13,-5.209465132550335
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC(C)(C)[NH2+]C4(C)C)cc2)C1,C04177854_decoy,TRY1,Decoy,0,-9.01848,-6.81,-3.98,-5.692415178854436
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC(C)(C)[NH2+]C4(C)C)cc2)C1,C04177855_decoy,TRY1,Decoy,0,-8.8568,-7.92,-3.67,-5.579639154887003
COc1ccc(OC)c(NC(=O)[C@H]2C[C@@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(Cl)cc23)c1,C08995966_decoy,TRY1,Decoy,0,-8.5943,-5.69,-3.14,-5.510417725557523
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(Cl)cc23)c1,C08995967_decoy,TRY1,Decoy,0,-7.26329,-5.37,-1.78,-4.789142477814292
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(Cl)cc23)c1,C08995968_decoy,TRY1,Decoy,0,-7.53799,-5.18,-1.44,-4.892509963452657
COc1ccc(OC)c(NC(=O)[C@H]2C[C@H]([C@@H](C)O)[NH2+][C@]23C(=O)Nc2ccc(Br)cc23)c1,C09129953_decoy,TRY1,Decoy,0,-7.91108,-4.82,-3.37,-5.180846114919326
Cc1c(Cl)ccc2c1NC(=O)[C@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21,C09359505_decoy,TRY1,Decoy,0,-9.15661,-8.53,-2.37,-9.622692120532086
NC(=O)C1CCN(C(=O)C[NH+]2[C@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@@H]3CCCC[C@@H]32)CC1,C10384388_decoy,TRY1,Decoy,0,-9.45301,-6.94,-2.97,-7.389485505872967
NC(=O)C1CCN(C(=O)C[NH+]2[C@@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@@H]3CCCC[C@@H]32)CC1,C10384398_decoy,TRY1,Decoy,0,-9.95438,-6.79,-3.59,-6.779387505734931
NC(=O)C1CCN(C(=O)C[NH+]2[C@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@H]3CCCC[C@@H]32)CC1,C10384409_decoy,TRY1,Decoy,0,-10.1804,-6.62,-3.35,-7.097866867761158
NC(=O)C1CCN(C(=O)C[NH+]2[C@@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@H]3CCCC[C@@H]32)CC1,C10384419_decoy,TRY1,Decoy,0,-9.65827,-7.55,-4.5,-6.601790666485525
CC[C@@H](CO)/[NH+]=C/[C@]12CC[C@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O,C12660401_decoy,TRY1,Decoy,0,-9.82582,-7.69,-3.56,-6.531087880296613
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3Cl)C(=O)[C@H]21,C02127075_decoy,TRY1,Decoy,0,-8.44648,-7.0,-1.32,-5.48715426511054
CCOc1ccccc1-n1c(=O)[nH]c(O)c([C@@H]2[NH2+]CCc3c2[nH]c2ccc(OC)cc32)c1=O,C02127285_decoy,TRY1,Decoy,0,-8.11955,-6.46,-2.21,-5.452923397346642
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)[NH2+][C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1CCc1ccccc1,C12882650_decoy,TRY1,Decoy,0,-9.1363,-7.88,-2.29,-6.334365323676558
Cc1cc(Cl)c2c(c1)[C@@]1([NH2+][C@@H](CC(N)=O)[C@H]3C(=O)N(CCc4ccccc4)C(=O)[C@H]31)C(=O)N2,C12886618_decoy,TRY1,Decoy,0,-10.1487,-8.29,-1.18,-8.953631012705868
CC(=O)Nc1ccc(Nc2nc(Nc3ccc(NC(C)=O)cc3)nc(N3CC[NH+](C)CC3)n2)cc1,C09273039_decoy,TRY1,Decoy,0,-9.58961,-9.09,-1.95,-8.194930642181285
COc1ccc(Cl)cc1NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C14923407_decoy,TRY1,Decoy,0,-10.1929,-6.92,-1.33,-6.649329306822373
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC(C)(C)[NH2+]C4(C)C)cc2)C1,C17244490_decoy,TRY1,Decoy,0,-8.98998,-7.2,-5.09,-5.854046789504864
Nc1[nH]c(=O)[nH]c(=O)c1[C@H](c1cccc(C(F)(F)F)c1)N1CCN(c2cccc[nH+]2)CC1,C23865291_decoy,TRY1,Decoy,0,-6.04678,-6.89,-0.94,-5.070261647565137
COc1ccccc1Nc1nc(NC[C@@H](c2ccco2)[NH+]2CCCC2)nc(N)c1[N+](=O)[O-],C35681902_decoy,TRY1,Decoy,0,-7.42094,-7.09,-1.87,-7.452220641816771
CC[C@@H](C)[C@H](NC(=O)C1=C(O)Nc2ccccc2N1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C36569253_decoy,TRY1,Decoy,0,-9.79732,-8.69,-2.6,-10.636295642321366
CCCCN(C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CC(C)(C)[NH2+]C3(C)C)cc1,C04177759_decoy,TRY1,Decoy,0,-8.4624,-4.76,-4.28,-4.793358404713121
O=C(NCc1cc2cc(Cl)ccc2[nH]1)[C@H]1C[C@@H]2[NH2+][C@@H](c3ccc4c(c3)OCO4)C[C@@H](C(F)(F)F)N2N1,C39440413_decoy,TRY1,Decoy,0,-10.3496,-8.36,-3.83,-7.466574646803897
O=S(=O)(Oc1ccccc1)c1ccc([C@H](CNO)N2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39534240_decoy,TRY1,Decoy,0,-9.13199,-8.42,-2.85,-8.847547578069184
CC1=C(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@H](C)ON1,C39597938_decoy,TRY1,Decoy,0,-9.39936,-8.88,-2.49,-8.792143754857468
Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)c1F,C39661795_decoy,TRY1,Decoy,0,-8.95979,-7.14,-3.08,-6.03992218678964
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39661853_decoy,TRY1,Decoy,0,-10.3916,-7.88,-1.72,-7.084817082912053
[H]/N=C\CN(C/C=N/[H])S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)NC)CC[NH+](CC)C3)cc1,C23714494_decoy,TRY1,Decoy,0,-10.0297,-5.54,-3.07,-6.134225984577042
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645216_decoy,TRY1,Decoy,0,-7.95747,-6.38,-3.55,-5.58559545999058
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645229_decoy,TRY1,Decoy,0,-9.09276,-5.6,-2.17,-5.679536225149571
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C=C(C(=O)CO)C[C@@H]3O[C@H]1C[C@@H]([NH3+])[C@@H](O)[C@H](C)O1,C40741424_decoy,TRY1,Decoy,0,-11.3541,-9.1,-1.64,-7.382688946605292
CC[NH+](CC)CCNc1nc(N)c([N+](=O)[O-])c(Nc2sc3c(c2C(N)=O)CCC3)n1,C41301868_decoy,TRY1,Decoy,0,-8.14803,-6.69,-1.89,-7.698951845436576
O=C1[C@H]2[C@@H](c3ccc(/C=C/c4ccccc4)cc3)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]2C(=O)N1CC[NH2+]Cc1ccccc1,C44173141_decoy,TRY1,Decoy,0,-7.94709,-7.11,-2.16,-6.487351387160443
C[NH2+]C1CCN(c2cc(C)c3nc([C@@H]4C(=O)N=CC=C4NC[C@@H](O)c4cccc(Cl)c4)[nH]c3c2)CC1,C52550763_decoy,TRY1,Decoy,0,-10.9011,-7.31,-1.32,-7.06297223720661
COc1ccccc1[C@@H]1[NH+]=C(NCCc2c[nH]c3ccccc23)N[C@@H]2N[C@@H](C)CC(=O)N21,C39357292_decoy,TRY1,Decoy,0,-8.71767,-7.5,-2.28,-5.814577828699909
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1N[NH+]=C(N2CCOCC2)N1c1cccc(F)c1,C39938529_decoy,TRY1,Decoy,0,-10.369,-6.61,-2.42,-6.941003527777888
O=C(C[C@@H]1NO[C@@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1)Nc1ccc(F)cc1F,C63807086_decoy,TRY1,Decoy,0,-7.92138,-7.75,-3.86,-5.717478370322454
CC(C)[NH+](C[C@H](O)COc1cccc2[nH]ccc12)C[C@H](O)COc1cccc2[nH]ccc12,C65743329_decoy,TRY1,Decoy,0,-8.29622,-8.09,-1.51,-9.042501591111312
C[NH+](CCCNC(=O)[C@@]1(O)c2ccccc2NC(=O)N1c1ccccc1)Cc1ccccc1,C03670313_decoy,TRY1,Decoy,0,-8.48549,-8.94,-1.26,-15.12430684319943
COc1ccc(Cl)cc1NC(=[NH2+])Nc1nc(=O)cc(CSc2ccc(Cl)cc2)[nH]1,C08411002_decoy,TRY1,Decoy,0,-9.7885,-5.44,-2.05,-5.527356291293842
CC(C)[NH+]1CCc2c(sc(NC(=O)CCCSc3ccc(Cl)cc3)c2C(N)=O)C1,C09474908_decoy,TRY1,Decoy,0,-10.1755,-6.94,-1.97,-6.912772651951991
CCOc1ccc(N2C(=O)Nc3ccc(Br)cc3[C@@]2(O)C(=O)NCCC[NH+]2CCCC2)cc1,C03619944_decoy,TRY1,Decoy,0,-7.91533,-5.98,-2.52,-5.989646171110985
CC[C@@H](CO)[NH2+]C[C@@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C02299200_decoy,TRY1,Decoy,0,-9.33698,-7.44,-2.2,-6.879064310373035
CC[C@H](CO)[NH2+]C[C@@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C12437245_decoy,TRY1,Decoy,0,-8.12439,-6.48,-2.79,-6.3935267548809405
CC[C@H](CO)[NH2+]C[C@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C12437246_decoy,TRY1,Decoy,0,-8.5025,-7.66,-3.93,-6.381050823375117
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F,C12782905_decoy,TRY1,Decoy,0,-9.24274,-8.23,-2.06,-7.456373279397566
COc1ccc(C[NH+](CC(=O)Nc2sccc2C(N)=O)[C@@H](C)Cc2cccs2)cc1,C14713105_decoy,TRY1,Decoy,0,-7.20209,-6.04,-1.09,-6.895174128990935
COc1ccc(C[NH+](CC(=O)Nc2sccc2C(N)=O)[C@H](C)Cc2cccs2)cc1,C14713108_decoy,TRY1,Decoy,0,-8.85105,-7.06,-0.8,-8.855469493398756
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccccc4OC(F)(F)F)c3)cc12,C14961753_decoy,TRY1,Decoy,0,-8.60172,-7.48,-2.68,-7.221485444960856
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4cccc(OC(F)(F)F)c4)c3)cc12,C14961757_decoy,TRY1,Decoy,0,-8.40578,-8.26,-2.99,-6.758519566388653
Cc1n[nH]c2ccc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(OC(F)(F)F)cc4)c3)cc12,C14961761_decoy,TRY1,Decoy,0,-8.96033,-8.52,-3.55,-7.890446314318896
CC(C)CCn1cnc2sc3c(c2c1=O)CC[C@H]([NH2+]CCc1ccc(S(N)(=O)=O)cc1)C3,C15002481_decoy,TRY1,Decoy,0,-9.04536,-7.27,-2.16,-7.088962551535379
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C15477128_decoy,TRY1,Decoy,0,-9.33181,-8.03,-3.22,-8.025331337482553
COc1cc(C[NH2+][C@H](C)C23CC4CC(CC(C4)C2)C3)cc(Br)c1OCC(N)=O,C16576119_decoy,TRY1,Decoy,0,-8.67208,-5.44,-4.7,-5.74509618372522
CC[NH+](CC)CCC[C@@H](C)Nc1cccc2c1C(=O)c1c(c(O)c3ccccc3c1O)C2=O,C17046173_decoy,TRY1,Decoy,0,-8.26415,-6.52,-3.21,-5.886776843000606
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2,C14476257_decoy,TRY1,Decoy,0,-8.7937,-5.31,-3.86,-5.521723544155625
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2,C14476255_decoy,TRY1,Decoy,0,-7.57346,-6.75,-5.88,-5.093458879051848
COc1ccccc1/C=C/C[NH+]1CCNC(=O)[C@@H]1CC(=O)NCCc1c[nH]c2ccccc12,C20855485_decoy,TRY1,Decoy,0,-8.52309,-5.7,-1.98,-5.110851998986196
C[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1ccccc1OC(F)(F)F,C25241216_decoy,TRY1,Decoy,0,-9.66374,-7.11,-2.36,-6.774682451938222
O=C(C[NH+]1CCC(NC(=O)NCc2ccccc2OC(F)(F)F)CC1)Nc1ccccc1,C26283123_decoy,TRY1,Decoy,0,-7.62463,-8.01,-2.31,-6.627775288558647
Cc1c(OC(=O)CC[NH3+])c(=O)ccn1CCCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1,C26994314_decoy,TRY1,Decoy,0,-8.84502,-6.77,-3.77,-6.050021336840051
CC[C@H](CO)[NH2+]C[C@@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2cc(C)cc(C)c21,C00707005_decoy,TRY1,Decoy,0,-6.54139,-6.51,-1.01,-5.179226288430385
CC[C@@H](CO)[NH2+]C[C@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2cc(C)cc(C)c21,C28296658_decoy,TRY1,Decoy,0,-7.41312,-6.73,-1.94,-5.498512145033829
CC[C@H](CO)[NH2+]C[C@H](O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2cc(C)cc(C)c21,C00707004_decoy,TRY1,Decoy,0,-6.63663,-5.01,-1.3,-4.944140000030201
COc1ccc(CCNc2nc(-c3ccccc3)c3c(N)n(-c4ccc(C(C)C)cc4)[nH+]c3n2)cc1,C35576886_decoy,TRY1,Decoy,0,-9.62396,-7.38,-3.62,-6.481663578025384
COc1cc(C[NH2+]C(C)(C)CC(C)(C)C)cc(I)c1OCC(N)=O,C36612902_decoy,TRY1,Decoy,0,-8.88933,-5.78,-3.82,-8.32377504093831
C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccc(C[NH2+]C(C)(C)C)cc1Cl,C38270151_decoy,TRY1,Decoy,0,-8.76613,-6.34,-1.92,-5.97569549197448
CCNC(=S)NNC(=O)CS[C@H]1C(=O)[NH+]=c2ccc(Cl)cc2=C1c1ccccc1,C39430996_decoy,TRY1,Decoy,0,-9.94582,-7.0,-0.89,-6.35621314544034
COc1ccc(N2C[C@@H](C[NH2+]CCSc3cnn[nH]3)[C@H](c3ccccc3Cl)N2)cc1,C39461381_decoy,TRY1,Decoy,0,-8.83451,-7.07,-1.12,-7.053156209905219
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39631996_decoy,TRY1,Decoy,0,-10.9607,-5.54,-3.83,-6.836396919548031
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674071_decoy,TRY1,Decoy,0,-9.27544,-8.97,-1.0,-8.008088044379924
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674072_decoy,TRY1,Decoy,0,-9.82665,-8.62,-3.75,-9.25986487135147
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674073_decoy,TRY1,Decoy,0,-8.63447,-6.77,-2.14,-5.755245756153295
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@H]1NN[C@@H](c2cccc(C)c2)[NH+]1CCC(=O)[O-],C39709869_decoy,TRY1,Decoy,0,-8.45416,-7.64,-3.34,-7.496694795955249
CCCC[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)cs1,C43227042_decoy,TRY1,Decoy,0,-10.5249,-8.8,-2.97,-7.054381030667015
CCCC[C@@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)cs1,C43227043_decoy,TRY1,Decoy,0,-11.1021,-6.86,-2.93,-6.606589725250397
CCCC[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)cs1,C43227044_decoy,TRY1,Decoy,0,-10.3891,-8.41,-1.41,-7.15290485398229
CSCC[C@H]([NH3+])c1nc(C(=O)NC[C@]2(C)CCC[C@@]3(C)c4ccc(C(C)C)cc4CC[C@H]23)cs1,C43227050_decoy,TRY1,Decoy,0,-11.5735,-7.14,-4.45,-7.667055947927047
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)cc1,C25788427_decoy,TRY1,Decoy,0,-8.02888,-7.1,-3.9,-5.657653126469393
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)cc1,C25788430_decoy,TRY1,Decoy,0,-9.21839,-7.92,-3.54,-6.878362749162929
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)cc1,C25788436_decoy,TRY1,Decoy,0,-8.2153,-7.0,-3.11,-5.879333846724467
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](CNCc2ccc(C#CCCO)cc2)C[C@@]1(C)CO,C55091206_decoy,TRY1,Decoy,0,-9.50625,-5.5,-2.88,-5.678376396525148
COc1ccc(Cl)cc1NC(=[NH2+])Nc1nc(CSc2ccc(Cl)cc2)cc(=O)[nH]1,C09312879_decoy,TRY1,Decoy,0,-10.5246,-8.26,-3.4,-8.061922103845184
O=C(CCC1=N[C@@H](NC(=O)NC2CCCCC2)SC1)NCCC1=c2ccccc2=[NH+]C1,C64409163_decoy,TRY1,Decoy,0,-8.50038,-8.12,-2.43,-6.090591538180199
O=C(CCC1=N[C@H](NC(=O)NC2CCCCC2)SC1)NCCC1=c2ccccc2=[NH+]C1,C64409164_decoy,TRY1,Decoy,0,-9.68004,-6.7,-1.65,-6.435318444101135
O=C(COc1ccccc1[C@H]1NN[C@@H](c2ccccc2)O1)NCCC1=c2ccccc2=[NH+]C1,C64503440_decoy,TRY1,Decoy,0,-8.3041,-5.99,-2.21,-5.66030896110344
O=C(COc1ccccc1[C@H]1NN[C@H](c2ccccc2)O1)NCCC1=c2ccccc2=[NH+]C1,C64503445_decoy,TRY1,Decoy,0,-7.80169,-7.05,-2.19,-6.761078034266107
O=C(COc1ccccc1[C@@H]1NN[C@@H](c2ccccc2)O1)NCCC1=c2ccccc2=[NH+]C1,C64503448_decoy,TRY1,Decoy,0,-8.02703,-7.25,-3.62,-6.286036978591927
CC[C@@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C04161164_decoy,TRY1,Decoy,0,-6.32428,-5.29,-1.94,-4.8651261626751845
CC[C@H](C(=O)NC(C)(C)C)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C04161165_decoy,TRY1,Decoy,0,-8.02978,-6.92,-0.15,-8.916035546014388
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)C(c1ccc(Br)cc1)c1ccc(Br)cc1,C04962268_decoy,TRY1,Decoy,0,-10.2526,-6.78,-2.1,-11.355632217946084
Cc1ccc(Br)cc1C(c1cc(Br)ccc1C)[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO,C04962276_decoy,TRY1,Decoy,0,-9.27815,-6.88,-0.26,-14.11142888007124
C=CCc1ccc(O)c(-c2cc([C@H]3Oc4c(-c5cc(CC=C)ccc5O)cc(O)cc4[C@@H]3CO)ccc2O)c1,C05839613_decoy,TRY1,Decoy,0,-10.4626,-8.71,-3.07,-7.860871539288676
CC(C)(C)NC(=O)[C@H](c1ccc(Cl)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1,C06074874_decoy,TRY1,Decoy,0,-7.85022,-4.22,-3.84,-5.454931894695847
CCC(C)(C)NC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06462138_decoy,TRY1,Decoy,0,-8.47725,-6.42,-2.48,-6.9200516667844045
Oc1c(Br)cc(/C=N/Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)c(O)c1Br,C08694752_decoy,TRY1,Decoy,0,-10.5627,-8.83,-2.71,-8.806889389590213
Cc1cc(C(O)(c2ccc(Nc3ccccc3)cc2)c2ccc(Nc3ccccc3)cc2)ccc1N,C12358848_decoy,TRY1,Decoy,0,-10.1055,-8.98,-1.55,-10.27016561491848
COCCNC(=O)[C@@H](c1ccc(F)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C12467254_decoy,TRY1,Decoy,0,-7.4406,-5.71,-0.88,-6.13627736975816
COCCNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C,C12467447_decoy,TRY1,Decoy,0,-7.49882,-4.8,-1.59,-5.23932008263195
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccc(F)cc2)c(C)c1,C12473646_decoy,TRY1,Decoy,0,-7.15459,-7.11,-3.13,-7.509549540332488
Cc1nn(Cc2c(Cl)cccc2Cl)c(C)c1/C=C/C(=O)NC(C(N)=O)C(N)=O,C12789928_decoy,TRY1,Decoy,0,-8.66224,-7.07,-2.42,-6.135944752555607
C=CCc1ccc(O)c(-c2cc([C@H]3Oc4c(-c5cc(CC=C)ccc5O)cc(O)cc4[C@H]3CO)ccc2O)c1,C14585187_decoy,TRY1,Decoy,0,-11.2619,-6.05,-2.74,-7.852990136567401
C=CCc1ccc(O)c(-c2cc([C@@H]3Oc4c(-c5cc(CC=C)ccc5O)cc(O)cc4[C@@H]3CO)ccc2O)c1,C14585189_decoy,TRY1,Decoy,0,-10.1396,-7.33,-3.64,-9.435873013116924
C=CCc1ccc(O)c(-c2cc([C@@H]3Oc4c(-c5cc(CC=C)ccc5O)cc(O)cc4[C@H]3CO)ccc2O)c1,C01632270_decoy,TRY1,Decoy,0,-11.339,-8.27,-3.05,-8.377416096277042
Cc1c(Cl)cccc1NC(=O)CNC(=O)CNc1ccccc1SCC(N)=O,C15360101_decoy,TRY1,Decoy,0,-8.23264,-6.93,-3.54,-5.872599739127605
COc1ccc(N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@@H](O)[C@@H](O)CO)cc1,C15774879_decoy,TRY1,Decoy,0,-9.84384,-6.61,-1.14,-7.807495538821694
COc1ccc(N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@H](O)[C@@H](O)CO)cc1,C15774881_decoy,TRY1,Decoy,0,-9.241,-7.36,-1.12,-7.683091309225111
COc1ccc(N/N=C(\c2nc3cc(Cl)ccc3[nH]c2=O)[C@H](O)[C@H](O)CO)cc1,C15774885_decoy,TRY1,Decoy,0,-8.84401,-7.1,-0.47,-6.221680012172173
CCc1cccc(CC)c1Nc1sc(C(=O)c2cc(C)ccc2C)c(N)c1C(N)=O,C15862825_decoy,TRY1,Decoy,0,-9.01435,-6.91,-1.12,-7.226361540868273
CCc1nc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nc(N)c1-c1ccc(Cl)cc1,C22978472_decoy,TRY1,Decoy,0,-8.59658,-8.27,-3.92,-8.348035273256803
Cc1ccccc1Nc1nc(N)nc(CNC[C@@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)n1,C13133951_decoy,TRY1,Decoy,0,-9.21485,-9.78,-2.04,-11.03766244122062
Cc1ccccc1Nc1nc(N)nc(CNC[C@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)n1,C13133952_decoy,TRY1,Decoy,0,-7.63119,-8.75,-3.14,-7.948281420922094
CCCCCC(=O)NC(=S)/N=c1\[nH]c(C)c(C(/C=C/c2ccc(Cl)cc2)=N/NC(N)=S)s1,C25585248_decoy,TRY1,Decoy,0,-11.1383,-6.49,-2.3,-7.932787913025745
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1cccc(Cl)c1,C36485056_decoy,TRY1,Decoy,0,-6.93339,-6.33,-3.94,-6.013093744959529
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(C(=O)c1cccc(O)c1O)c1cccc(Cl)c1,C36485057_decoy,TRY1,Decoy,0,-9.19143,-6.14,-2.86,-6.498086395458012
CC(C)(C)NC(=O)[C@@H](c1c(O)cc(O)cc1O)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500736_decoy,TRY1,Decoy,0,-6.95444,-6.21,-3.38,-5.918794072248927
CCCN(C(=O)c1c(O)cccc1O)[C@@H](C(=O)NC(C)(C)C)c1c(O)cc(O)cc1O,C36570975_decoy,TRY1,Decoy,0,-7.58433,-5.75,-1.45,-5.9039290491308405
Cc1ccc(CN(C(=O)c2ccc(O)cc2)[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36597179_decoy,TRY1,Decoy,0,-7.99352,-5.82,-2.06,-6.038893985338314
CCCCNC(=O)[C@H](c1c(O)cc(O)cc1O)N(Cc1ccc(C)o1)C(=O)c1cccc(O)c1O,C36597693_decoy,TRY1,Decoy,0,-8.06869,-6.01,-2.06,-6.363450388230342
Cc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC2CCCC2)c2ccc(C)o2)cc1,C12714555_decoy,TRY1,Decoy,0,-8.16406,-5.71,-1.18,-6.202417284585639
CCCCN(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)c1c(N)n(CCCC)c(=O)[nH]c1=O,C12895156_decoy,TRY1,Decoy,0,-9.18908,-7.09,-3.47,-6.603055881728912
COc1ccc(C2=C[C@@H]([C@H]3NN[C@@H](SCC(=O)Nc4c(C)cccc4C)N3N)N=N2)cc1,C39016424_decoy,TRY1,Decoy,0,-9.91363,-5.71,-1.01,-5.976764154966651
CC(C)(C)c1cc(/C=[NH+]/CC(O)C/[NH+]=C/c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1,C09850500_decoy,TRY1,Decoy,0,-9.32154,-7.49,-3.48,-9.684847135785567
O=C(C[C@H]1CS[C@H](NC(=O)NCc2cccs2)N1)NCCc1c[nH]c2ccccc12,C39709750_decoy,TRY1,Decoy,0,-9.77934,-8.35,-1.95,-7.79589494136828
CCc1cc(CC)c(Cc2c(CC)cc(CC)c(/C=N/NC(N)=O)c2CC)c(CC)c1/C=N/NC(N)=O,C08780889_decoy,TRY1,Decoy,0,-8.03713,-7.34,-4.27,-6.391193518354335
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1ccc(OC(F)(F)F)cc1,C40784545_decoy,TRY1,Decoy,0,-8.20876,-6.9,-3.5,-5.393094180498544
CC[NH+](CC)c1ccc(Nc2nc(Nc3ccc([NH+](CC)CC)cc3)nc(N3CC[NH+](C)CC3)n2)cc1,C22827586_decoy,TRY1,Decoy,0,-10.9121,-7.91,-2.44,-8.462600461619747
NS(=O)(=O)c1ccc(NNC(=S)Nc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1,C16218266_decoy,TRY1,Decoy,0,-9.5649,-7.28,-2.95,-6.343542234646169
O=C(COC[C@H](O)N/N=C1\C(O)=Nc2ccccc21)N/N=C1\C(O)=Nc2ccccc21,C02885555_decoy,TRY1,Decoy,0,-7.80553,-8.94,-1.82,-8.74002330060866
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1cccc(Cl)c1,C58994051_decoy,TRY1,Decoy,0,-9.15446,-8.74,-3.01,-9.187469137062774
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1ccccc1Br,C58994059_decoy,TRY1,Decoy,0,-9.02064,-9.14,-1.95,-8.180519071285742
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1cc(Cl)ccc1Cl,C58994074_decoy,TRY1,Decoy,0,-10.0446,-10.05,-3.43,-9.078500831259332
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1ccc(F)cc1F,C58994080_decoy,TRY1,Decoy,0,-9.4269,-8.69,-4.15,-7.431504482692218
O=C(CSc1n[nH]c(N/N=C/c2ccc(O)cc2O)n1)Nc1cc(F)ccc1F,C58994263_decoy,TRY1,Decoy,0,-9.27063,-9.65,-1.57,-10.714268705310191
Nn1c(N/N=C/c2ccc(O)cc2O)nnc1SCC(=O)C1C2CC3CC(C2)CC1C3,C20292302_decoy,TRY1,Decoy,0,-10.2183,-9.65,-2.6,-10.3217415568113
CC[NH+](CC)c1ccc(CN(CCC[NH+](C)C)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C21264113_decoy,TRY1,Decoy,0,-8.62655,-5.63,-3.3,-6.075737038799124
O=C(CSc1n[nH]c(N/N=C/c2cc(Br)cc(Br)c2O)n1)NCCO,C59819178_decoy,TRY1,Decoy,0,-9.68701,-4.95,-2.29,-4.907616076285866
COc1cc(NCCCNc2c3ccc(Cl)cc3[nH+]c3ccc(OC)cc23)c2ncccc2c1,C04821504_decoy,TRY1,Decoy,0,-8.87283,-7.84,-2.19,-6.870216379717633
C/C(=N\Nc1ccccc1)[C@H](C[NH+](C)C)[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O,C05824337_decoy,TRY1,Decoy,0,-7.68255,-6.74,-2.96,-5.565157707092845
Cc1cc(C)c2c(c1)c(-c1ccccc1)c(-c1ccccc1)n2C[C@H](O)C[NH2+]Cc1ccccc1,C02083392_decoy,TRY1,Decoy,0,-6.75396,-7.57,-2.75,-6.636450078222904
O[C@@H](C[NH2+]Cc1ccco1)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21,C08432035_decoy,TRY1,Decoy,0,-8.8051,-8.12,-1.83,-6.914199383672242
COc1c(Br)cc2c(cc(C)n2-c2ccccc2)c1OC[C@H](O)C[NH2+]C(C)C,C08453910_decoy,TRY1,Decoy,0,-7.86428,-6.86,-1.79,-5.582639428009486
CCN(CCCNC(=O)c1ccc2c(c1)NC(=O)[C@H]([NH+]1CCCCC1)S2)c1ccccc1,C08812866_decoy,TRY1,Decoy,0,-8.69874,-7.47,-3.64,-6.686915626125878
CCN(CC)c1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(OC)cc2)cc1,C02423791_decoy,TRY1,Decoy,0,-8.56943,-6.03,-1.12,-5.910071955573318
CC(C)[C@@H]([NH2+]CC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1Cl)c1ccc(F)cc1,C09314522_decoy,TRY1,Decoy,0,-8.83244,-7.4,-5.08,-5.8744871863424
CC[NH+](CC)CCCNC(=O)c1nn2c(c1Cl)N[C@H](c1cccs1)C[C@H]2C(F)(F)F,C02300043_decoy,TRY1,Decoy,0,-8.94032,-5.41,-5.71,-5.356250964482246
CCCCc1nc(C[NH+]2CCc3c([nH]c4ccccc34)[C@H]2c2cccc(OC)c2OC)c[nH]1,C11664165_decoy,TRY1,Decoy,0,-8.08424,-7.3,-0.61,-7.181821951615971
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)cc2[nH]c1=O)C(=S)Nc1ccc(C)cc1C,C12635435_decoy,TRY1,Decoy,0,-8.44674,-6.19,-1.76,-6.550032817731315
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)cc2[nH]c1=O)C(=S)Nc1cc(C)ccc1C,C12635443_decoy,TRY1,Decoy,0,-8.4855,-7.52,-1.28,-6.774738109320614
CC[NH+]1CCC[C@@H]1CN(Cc1cc2ccc(C)c(C)c2[nH]c1=O)C(=S)Nc1cccc(C)c1C,C12635564_decoy,TRY1,Decoy,0,-8.19547,-7.32,-1.49,-7.54914152339801
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)c(C)c2[nH]c1=O)C(=S)Nc1cccc(C)c1C,C12635567_decoy,TRY1,Decoy,0,-8.29357,-6.33,-2.35,-6.156219409482466
CC[NH+](CC)CCCN(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)Nc1ccccc1Cl,C12645887_decoy,TRY1,Decoy,0,-9.11769,-6.56,-1.44,-7.196841380746429
CC[NH+](CC)CCN(Cc1cc2cc(C)c(C)cc2[nH]c1=O)C(=O)Nc1cccc(Cl)c1,C12704565_decoy,TRY1,Decoy,0,-9.41121,-7.54,-1.19,-8.574627712512914
CC[NH+](CC)CCN(Cc1cc2c(C)ccc(C)c2[nH]c1=O)C(=O)Nc1cccc(Cl)c1,C12705957_decoy,TRY1,Decoy,0,-7.90805,-6.5,-2.43,-7.346745645534598
Cc1cc(C)c2cc(CN(Cc3cccs3)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2c1,C06301514_decoy,TRY1,Decoy,0,-8.48525,-6.06,-3.32,-7.164825418849513
COc1cccc([C@H](CNC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)[NH+]2CCCC2)c1,C12773151_decoy,TRY1,Decoy,0,-9.26149,-7.06,-1.93,-7.570835449394639
Cc1cc(C)c2[nH]c(=O)c(CN(Cc3ccc(F)cc3)C(=S)NCCC[NH+](C)C)cc2c1,C06300413_decoy,TRY1,Decoy,0,-9.09276,-5.6,-4.69,-5.68394738366567
CCOc1ccccc1C[NH+]1CCC(O)(c2ccc3oc(C(=O)NCC(C)C)cc3c2)CC1,C14984486_decoy,TRY1,Decoy,0,-8.68786,-7.97,-2.47,-7.113178882591661
Cc1ccc(C[NH+]2CCN(C(=S)NCC(=O)NCCc3ccc(Cl)cc3)CC23CCCCC3)cc1,C20687349_decoy,TRY1,Decoy,0,-10.3478,-6.36,-2.18,-6.587501202348523
CC[NH+](CC(=O)NCC(=O)Nc1c(C)cccc1C)Cc1ccc(Br)s1,C20814927_decoy,TRY1,Decoy,0,-7.90115,-5.55,-2.84,-6.265820666774401
O=[N+]([O-])c1ccc(NCC[NH2+]Cc2ccc(-c3ccc(Br)cc3Cl)o2)cc1,C20875660_decoy,TRY1,Decoy,0,-7.68533,-5.25,-1.6,-5.228205140265389
COc1ccc(CN(Cc2ccccc2C)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C21263597_decoy,TRY1,Decoy,0,-7.88729,-5.78,-1.72,-5.681708775199499
C[NH+](CC(=O)Nc1ccccc1Br)CC(=O)Nc1ccccc1SC(F)F,C23038615_decoy,TRY1,Decoy,0,-7.42117,-6.66,-3.0,-5.657447153893786
O[C@@H](COc1ccccc1)C[NH+]1CCC(Nc2nccc3nc(C(F)(F)F)ccc23)CC1,C24906232_decoy,TRY1,Decoy,0,-7.67068,-7.3,-1.13,-5.559085074699122
CC1CC[NH+]([C@@H](CNC(=O)[C@@H](NC(=O)c2c(F)cccc2F)C(C)C)c2cccs2)CC1,C25382061_decoy,TRY1,Decoy,0,-9.02757,-7.79,-3.05,-7.809620122166328
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCC[NH+](Cc2c(Cl)cccc2Cl)C1,C30940007_decoy,TRY1,Decoy,0,-8.15421,-6.61,-3.74,-5.955458858506142
CCCCCCc1cc2cc(-c3nc(-c4cc(Cl)ccc4OC)cs3)c(=[NH2+])oc2cc1O,C03073021_decoy,TRY1,Decoy,0,-10.0906,-5.65,-4.36,-6.433630275867693
CCc1cccc2c([C@@H](CC(=O)NCC[NH+]3CCCCC3)c3ccc(F)cc3F)c[nH]c12,C35560197_decoy,TRY1,Decoy,0,-9.15025,-6.84,-0.82,-8.380209746646393
CC[C@@H](O)C[NH+](Cc1ccccc1)Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1,C35746497_decoy,TRY1,Decoy,0,-8.0861,-8.04,-4.91,-7.018678394959872
CCc1cccc2c([C@H](CC(=O)N[C@H](C)CCC[NH+](CC)CC)c3ccc(Cl)cc3)c[nH]c12,C35888717_decoy,TRY1,Decoy,0,-9.53759,-6.35,-3.12,-6.381312393504925
Cc1ccc(-c2csc3nc(C[NH+](C[C@H](O)COC(C)(C)C)C(C)C)[nH]c(=O)c23)cc1,C36205626_decoy,TRY1,Decoy,0,-8.41958,-6.35,-2.86,-5.688641661604215
COC[C@H](O)C[NH+](Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1)C1CCCCC1,C36207111_decoy,TRY1,Decoy,0,-9.36912,-7.77,-2.48,-7.329379260008221
CC[NH+]1CCC[C@H]1CN(Cc1cc2ccc(C)cc2[nH]c1=O)C(=S)Nc1ccc(F)cc1,C01325961_decoy,TRY1,Decoy,0,-8.7457,-7.52,-1.31,-7.690990962614722
Cc1cc[nH+]c(N[C@@H](c2ccc(OC(F)F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547659_decoy,TRY1,Decoy,0,-7.41408,-7.41,-1.61,-7.036869924592051
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC[C@@H](C)Oc2ccccc2Cl)C2(CC[NH2+]CC2)C1,C39666359_decoy,TRY1,Decoy,0,-9.0216,-6.75,-2.03,-6.567239422740362
CCOc1cc(C[NH2+]CCCCO)cc(Br)c1OCc1ccc(Cl)cc1,C40720973_decoy,TRY1,Decoy,0,-8.80646,-4.89,-1.99,-5.81604190849025
CCOc1cc(C[NH2+]CCCCCO)cc(Br)c1OCc1c(F)cccc1Cl,C40740598_decoy,TRY1,Decoy,0,-8.37348,-5.42,-2.1,-5.972709620238885
Clc1ccc(OCc2ccc(Cl)c(Cl)c2)c(C[NH2+]CCc2c[nH]c3ccccc23)c1,C40743464_decoy,TRY1,Decoy,0,-10.0572,-6.58,-1.95,-8.10432242500127
COc1cc(C[NH2+]CCCO)cc(Br)c1OCc1ccc(Cl)c(Cl)c1,C40743677_decoy,TRY1,Decoy,0,-10.6882,-4.75,-3.04,-6.648105287642162
CCCNC(=O)C[NH+]1CCC(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1,C29225164_decoy,TRY1,Decoy,0,-6.56954,-5.86,-1.47,-4.967436719461443
CC(C)c1ccc(CN(C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)[C@H](C)c2ccccc2)cc1,C21263193_decoy,TRY1,Decoy,0,-8.753,-6.82,-1.73,-6.678852000472666
CC[NH2+]CCCNCc1cc(Br)c(OCc2ccc(Cl)cc2)c(OCC)c1,C13734923_decoy,TRY1,Decoy,0,-8.62936,-4.59,-4.45,-5.190354908987928
C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2)CCOCC1)C(=O)Nc1ccccc1OC(F)F,C60036317_decoy,TRY1,Decoy,0,-7.71145,-6.49,-3.49,-6.798672015300818
O=C(C[NH+](Cc1cccc(F)c1)C[C@H]1CCCO1)Nc1ccc2[nH]c(C(F)(F)F)nc2c1,C60245113_decoy,TRY1,Decoy,0,-7.92856,-7.58,-4.02,-6.352699011727547
Cc1ccc(C)c(N/C(=N\C(=O)c2cccc(N(C)C)c2)NCCC2=c3ccccc3=[NH+]C2)c1,C63589154_decoy,TRY1,Decoy,0,-8.86652,-7.16,-2.61,-6.225489656376296
CC(C)c1cc2c(=O)[nH]c(CSCC(=O)NCCC3=c4ccccc4=[NH+]C3)nc2s1,C63807049_decoy,TRY1,Decoy,0,-9.43872,-7.51,-1.89,-6.620800998928175
CCOc1ccccc1N/C(=N/C(=O)c1ccccc1F)NCCC1=c2ccccc2=[NH+]C1,C65329903_decoy,TRY1,Decoy,0,-8.02811,-7.48,-3.42,-7.721938785220677
CC[NH+](CC)CCCN(Cc1cc2c(C)cc(C)cc2[nH]c1=O)C(=S)Nc1ccc(C)cc1,C06078159_decoy,TRY1,Decoy,0,-7.62283,-7.02,-1.79,-7.412813546264055
CC[NH+](CC)CCCNC(=S)N(Cc1cc2c(C)cc(C)cc2[nH]c1=O)C1CCCCC1,C06193116_decoy,TRY1,Decoy,0,-7.17328,-5.85,-2.34,-5.721102982954381
CC[NH+](CC)CCCNC(=S)N(Cc1ccccc1)Cc1cc2ccc(C)c(C)c2[nH]c1=O,C06193222_decoy,TRY1,Decoy,0,-8.36565,-6.63,-2.67,-7.397325795930596
CC[NH+](CC)CCN(Cc1cc2cc(C)cc(C)c2[nH]c1=O)C(=S)Nc1ccccc1OC,C06078320_decoy,TRY1,Decoy,0,-7.40367,-4.19,-2.98,-4.658241925902619
CCOc1ccc2[nH]c(=O)c(CN(CC[NH+](CC)CC)C(=S)NCc3ccccc3)cc2c1,C06193364_decoy,TRY1,Decoy,0,-8.67036,-6.67,-1.36,-6.079642503443225
CC[NH+](CC)CCN(Cc1cc2ccc(OC)cc2[nH]c1=O)C(=S)Nc1ccc(C)cc1,C06078388_decoy,TRY1,Decoy,0,-7.89059,-5.03,-1.8,-5.551656056694218
CCOc1ccc2[nH]c(=O)c(CN(CCC[NH+](C)C)C(=S)NC3CCCCC3)cc2c1,C06196575_decoy,TRY1,Decoy,0,-9.88344,-5.98,-2.59,-6.98990906188222
CCc1ccc2[nH]c(=O)c(CN(C[C@@H]3CCCO3)C(=S)NCCC[NH+](CC)CC)cc2c1,C06197755_decoy,TRY1,Decoy,0,-9.39102,-6.63,-1.69,-9.387293992929292
CCOc1cc(C[NH2+]C2CCCCC2)cc(Br)c1OCC(=O)NC(C)(C)C,C08443863_decoy,TRY1,Decoy,0,-8.48706,-6.35,-1.27,-5.509396172921931
CC[NH+]1CCC(NC(=O)CSc2nnc(Nc3ccc(OC(F)(F)F)cc3)s2)CC1,C10095179_decoy,TRY1,Decoy,0,-7.94152,-6.39,-1.34,-5.421959654465736
COc1ccccc1[C@@H](CNC(=O)[C@H](NC(=O)c1ccccc1F)C(C)C)[NH+]1CCCC1,C12791922_decoy,TRY1,Decoy,0,-8.97523,-7.6,-1.43,-6.563297239614781
COc1ccc(CN(Cc2cc3cc(C)ccc3[nH]c2=O)C(=S)NCCC[NH+](C)C)cc1,C06408339_decoy,TRY1,Decoy,0,-8.28296,-7.22,-3.89,-7.051531647746571
Cc1cc(C)c2c(c1)c(-c1ccccc1)c(-c1ccccc1)n2C[C@H](O)C[NH2+]CCc1ccccc1,C02083428_decoy,TRY1,Decoy,0,-7.35425,-6.25,-1.97,-5.996370758689955
c1ccc(C(CCc2nc(CC[NH2+]CCCCCc3cccnc3)c[nH]2)c2ccccc2)cc1,C13530336_decoy,TRY1,Decoy,0,-9.27155,-7.24,-3.32,-6.6147383888145
CCOc1cc(C[NH2+]CCCCCO)cc(Br)c1OCc1ccccc1F,C13726990_decoy,TRY1,Decoy,0,-7.53638,-5.95,-2.75,-5.0316345363097
S=C(NCCCCN(Cc1ccc(Br)cc1)c1cccc[nH+]1)NCCCc1ccccc1,C13782013_decoy,TRY1,Decoy,0,-10.1264,-5.82,-1.65,-7.199464033493627
O=[N+]([O-])c1ccc(NCC[NH2+]Cc2cccc(OCc3ccc(Cl)cc3Cl)c2)cc1,C16399617_decoy,TRY1,Decoy,0,-8.54916,-7.3,-3.45,-6.900861437762255
CCCOc1ccc(Br)cc1C[NH2+]CCNc1ccc([N+](=O)[O-])cc1Cl,C20929309_decoy,TRY1,Decoy,0,-8.5121,-5.26,-3.21,-5.6124628521748985
COc1cccc(CN(C[C@H]2CCCO2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1OC,C21263471_decoy,TRY1,Decoy,0,-8.41775,-5.97,-2.3,-5.745522927581574
COc1ccc(OC)c(CN(Cc2ccco2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C21263753_decoy,TRY1,Decoy,0,-8.41045,-5.47,-4.45,-5.657451440230591
C=CCNC(=O)C[NH+]1CCN(CC(=O)Nc2sc3c(c2C(=O)c2ccccc2)CCCC3)CC1,C22781812_decoy,TRY1,Decoy,0,-9.42912,-7.19,-3.74,-6.6571133522497465
CC[NH+](CC)[C@@H](CNC(=O)[C@@H](CCSC)NC(=O)c1ccco1)c1ccccc1Cl,C30713527_decoy,TRY1,Decoy,0,-7.69649,-6.19,-3.07,-6.613141670326695
CC[NH+](CC)[C@H](CNC(=O)[C@H](CCSC)NC(=O)c1ccco1)c1ccccc1Cl,C30713537_decoy,TRY1,Decoy,0,-7.76862,-6.08,-4.39,-7.263128427704225
CCCCCOc1ccc(C(=O)Nc2sc3c(c2C(=O)OC)CC(C)(C)[NH2+]C3(C)C)cc1,C35112160_decoy,TRY1,Decoy,0,-8.43108,-6.91,-3.21,-5.844160479290932
C=CCN1C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(C(=O)OCC)=C1CN1CC[NH2+]CC1,C35640704_decoy,TRY1,Decoy,0,-7.37584,-5.5,-1.21,-5.598364636309719
Cc1ccc(-c2csc3nc(C[NH+](C[C@@H](O)COC(C)C)C(C)C)[nH]c(=O)c23)cc1C,C35745573_decoy,TRY1,Decoy,0,-9.76875,-7.22,-3.46,-7.350847615548482
Cc1ccccc1-c1csc2nc(C[NH+](CCC(C)C)C[C@H](O)COCC(C)C)[nH]c(=O)c12,C35745856_decoy,TRY1,Decoy,0,-8.50251,-6.69,-3.68,-6.978098636934374
Cc1ccccc1-c1csc2nc(C[NH+](C[C@H](O)COc3ccccc3)C(C)C)[nH]c(=O)c12,C35747235_decoy,TRY1,Decoy,0,-8.44456,-8.0,-1.17,-6.766717875367698
CC(C)c1cc2c(=O)[nH]c(C[NH+](Cc3ccccc3)C[C@H](O)COC(C)(C)C)nc2s1,C35781005_decoy,TRY1,Decoy,0,-8.14281,-7.71,-2.47,-8.139729055216957
O=c1[nH]c(C[NH+](C[C@@H](O)COCc2ccccc2)C2CCCCC2)nc2sc3c(c12)CCC3,C36159061_decoy,TRY1,Decoy,0,-9.94985,-7.69,-3.41,-8.911170090397244
CCC[C@H](O)C[NH+](CCCOC)Cc1nc2scc(-c3ccc(C)c(C)c3)c2c(=O)[nH]1,C36205385_decoy,TRY1,Decoy,0,-9.07036,-6.16,-2.65,-7.509215617973002
CC[C@H](O)C[NH+](CCN1CCOCC1)Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1,C36206489_decoy,TRY1,Decoy,0,-8.63524,-6.76,-2.35,-6.834125390435244
C=CCC[C@@H](O)C[NH+](CCOC)Cc1nc2scc(-c3cc(C)ccc3C)c2c(=O)[nH]1,C36207080_decoy,TRY1,Decoy,0,-8.67185,-5.98,-3.42,-6.179923338753689
C=CCC[C@H](O)C[NH+](CCCOC)Cc1nc2scc(-c3ccc(C)cc3C)c2c(=O)[nH]1,C36207971_decoy,TRY1,Decoy,0,-9.32309,-6.33,-3.82,-7.728550181612506
CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1,C36735693_decoy,TRY1,Decoy,0,-9.69762,-6.35,-1.79,-7.203206369347349
CCOC(=O)c1c(-c2ccc(-c3ccccc3)cc2)csc1NC(=O)CNCC[NH+](C)C,C22037733_decoy,TRY1,Decoy,0,-6.89963,-7.21,-1.54,-5.590710679518267
CC(C)(C)c1ccc([C@H](O)CCC[NH+]2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1,C03831511_decoy,TRY1,Decoy,0,-8.14215,-6.59,-4.08,-5.70898368716147
CC(C)(C)c1ccc([C@@H](O)CCC[NH+]2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1,C03812892_decoy,TRY1,Decoy,0,-6.34035,-7.95,-3.91,-5.464876333853624
CCn1cc(/C=C(\NC(=O)c2ccccc2Cl)C(=O)NCCCn2cc[nH+]c2)c2ccccc21,C08606513_decoy,TRY1,Decoy,0,-9.07134,-5.71,-2.31,-6.030614373051998
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1,C36694529_decoy,TRY1,Decoy,0,-8.16903,-7.34,-1.58,-7.197712623498001
CCCCCCC(=O)N1C[C@@H](C(=O)NCc2cc(F)cc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39600480_decoy,TRY1,Decoy,0,-9.57555,-5.35,-1.07,-6.334676119142971
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccccc2OCC)C2(CC[NH2+]CC2)C1,C39652757_decoy,TRY1,Decoy,0,-8.54023,-7.32,-1.15,-8.094378538037471
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC[C@@H](C)Oc2ccc(C)cc2)C2(CC[NH2+]CC2)C1,C39666206_decoy,TRY1,Decoy,0,-9.93494,-7.88,-3.8,-8.383214822361738
COc1cc(C[NH2+]CCCCO)cc(Br)c1OCc1ccc(F)cc1Cl,C40744273_decoy,TRY1,Decoy,0,-10.5417,-5.35,-2.0,-5.846712410470659
CC[NH+](CC)[C@@H](CNC(=O)C[C@@H]1Sc2ccc(C(F)(F)F)cc2NC1=O)c1cccc(OC)c1,C45928654_decoy,TRY1,Decoy,0,-9.21043,-7.33,-2.26,-8.401783662417971
CC(C)(C)c1ccc(OC[C@H](O)C[NH+]2CCC(NS(=O)(=O)c3cccs3)CC2)cc1,C46551245_decoy,TRY1,Decoy,0,-7.0387,-7.71,-2.23,-6.601633028631351
COc1ccc(-n2cc(C[NH2+]CCSc3c[nH]nn3)c(-c3ccccc3Cl)n2)cc1,C19730763_decoy,TRY1,Decoy,0,-8.61515,-6.58,-0.85,-7.936745008274757
O=C(CCNC(=O)Cc1ccccc1)NC[C@@H](C1=c2ccccc2=[NH+]C1)c1ccccc1Cl,C63925999_decoy,TRY1,Decoy,0,-8.68163,-8.29,-2.72,-7.5288501023008445
Cc1ccc(NC(=O)[C@H]2N=N[C@@H](CCCC(=O)NCCC3=c4cc(C)ccc4=[NH+]C3)S2)cc1,C64491499_decoy,TRY1,Decoy,0,-10.2034,-8.1,-1.97,-6.798545401664256
Cc1ccccc1NC(=O)[C@@H]1N=N[C@@H](CCCC(=O)NCCC2=c3ccccc3=[NH+]C2)S1,C64538902_decoy,TRY1,Decoy,0,-8.91913,-9.19,-2.42,-7.230582969171061
CCOc1ccc(N2C(=O)Nc3ccccc3[C@]2(O)C(=O)NCCC[NH+]2CCCCC2)cc1,C03670304_decoy,TRY1,Decoy,0,-9.27154,-6.15,-0.7,-7.840472421361308
CCOc1ccccc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCCCCC1,C00706230_decoy,TRY1,Decoy,0,-9.33911,-5.01,-1.61,-6.000425624403218
CCOc1ccc(N2C(=O)Nc3ccccc3[C@@]2(O)C(=O)NCCC[NH+]2CCCCC2)cc1,C03670303_decoy,TRY1,Decoy,0,-7.92748,-5.98,-2.84,-6.389001491197867
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2cccc(Cl)c2Cl)nnn1-c1nonc1N,C08442773_decoy,TRY1,Decoy,0,-9.23002,-6.64,-1.77,-6.999365291753481
COc1cccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)c1OC,C08781127_decoy,TRY1,Decoy,0,-7.8476,-6.52,-3.46,-5.876869174608204
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2ccc(Cl)cc2Cl)nnn1-c1nonc1N,C09041778_decoy,TRY1,Decoy,0,-9.19472,-5.33,-2.05,-6.929682596819844
CCOC(=O)c1sc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c(C(=O)OC)c1C,C09305427_decoy,TRY1,Decoy,0,-8.39358,-7.18,-3.76,-6.03229471774188
COc1ccccc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+](C)C1CCCCC1,C09479714_decoy,TRY1,Decoy,0,-9.06068,-8.5,-2.74,-7.893615414455769
C[NH+](CC(=O)NC(=O)NCCC1=CCCCC1)CC(=O)Nc1ccccc1Br,C09813869_decoy,TRY1,Decoy,0,-9.67948,-7.47,-2.21,-8.418394112914605
CC[NH+]1CCc2c(sc(NC(=O)CCCS(=O)(=O)c3ccc(F)cc3)c2C(N)=O)C1,C09914330_decoy,TRY1,Decoy,0,-10.1603,-7.43,-1.75,-7.731903946361603
COc1cc(OC)c(C2=CC[NH+](CC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)CC2)c(OC)c1,C11066391_decoy,TRY1,Decoy,0,-8.20187,-7.57,-2.27,-10.284727711908268
Cc1ccccc1OC[C@@H](O)Cn1c(N2CC[NH+](CCO)CC2)nc2c1c(=O)[nH]c(=O)n2C,C06444550_decoy,TRY1,Decoy,0,-9.26915,-5.84,-1.54,-6.193079820638316
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)CCOc2ccc(Cl)cc2)c(=O)[nH]c1=O,C15449762_decoy,TRY1,Decoy,0,-8.18887,-5.11,-2.28,-5.547809384886532
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl,C16557376_decoy,TRY1,Decoy,0,-8.84313,-7.22,-3.02,-6.529402729496784
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl,C16557378_decoy,TRY1,Decoy,0,-7.81188,-6.87,-3.67,-5.752559607160635
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)OCCO2,C20155084_decoy,TRY1,Decoy,0,-8.66213,-6.43,-1.83,-6.268154442241492
O=C(C[NH2+]C[C@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)OCCO2,C20155087_decoy,TRY1,Decoy,0,-8.62619,-7.51,-3.6,-6.963901621490936
O=C1NC[C@@H](CCC(=O)N2CCCC2)[NH+]2C[C@@H](NC(=S)NCCN3CCOCC3)C[C@@H]12,C15707537_decoy,TRY1,Decoy,0,-8.61328,-7.0,-1.52,-6.523267245002053
Cc1ccccc1OC[C@H](O)C[NH2+]CCN1CCN(C[C@H](O)COc2ccccc2C)CC1,C22787727_decoy,TRY1,Decoy,0,-8.95951,-6.66,-2.62,-5.852802970899009
Cc1ccccc1OC[C@H](O)C[NH2+]CCN1CCN(C[C@@H](O)COc2ccccc2C)CC1,C22787740_decoy,TRY1,Decoy,0,-7.93351,-6.98,-3.47,-6.076495562091347
Cc1c(Nc2ccc(C[NH2+]C[C@H](O)CN3CCOCC3)cc2)c(=O)n(-c2ccccc2)n1C,C13113297_decoy,TRY1,Decoy,0,-7.38753,-7.23,-1.75,-5.42635318001464
CC[NH+](CCC(=O)Nc1sc2c(c1C#N)CCC2)CC(=O)Nc1ccc(NC(C)=O)cc1,C24896876_decoy,TRY1,Decoy,0,-9.65597,-7.69,-1.69,-7.09373117922095
CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccccc1Cl,C25147214_decoy,TRY1,Decoy,0,-8.10081,-6.66,-1.34,-5.797124320361293
CC[NH+](CC)Cc1nnn(-c2nonc2N)c1C(=O)N/N=C/c1ccc(C(F)(F)F)cc1,C02242815_decoy,TRY1,Decoy,0,-7.36503,-8.24,-3.79,-9.381898664823533
COc1cccc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCCC2)c1OC,C27497450_decoy,TRY1,Decoy,0,-8.01361,-8.28,-3.19,-7.646103962852956
CCOC(=O)C1=C(C[NH+]2CCC[C@H](C(=O)Nc3ccccc3)C2)NC(=O)N[C@@H]1c1ccco1,C27572809_decoy,TRY1,Decoy,0,-8.80163,-7.57,-1.86,-7.722806509155194
CC(C)c1oc2c(C[NH+](CCO)CCO)c(O)ccc2c(=O)c1-c1nc2ccccc2s1,C28121181_decoy,TRY1,Decoy,0,-7.28543,-6.91,-3.31,-7.281135155214211
CCc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C2CCCCC2)cc1,C09307242_decoy,TRY1,Decoy,0,-8.04787,-7.83,-3.6,-7.151294599863753
COCCNC(=O)CC[C@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]C1CCN(C(C)=O)CC1,C35442600_decoy,TRY1,Decoy,0,-8.57505,-6.5,-2.33,-6.409345883603884
COc1cccc(/C=[NH+]/CCNC(=O)c2cc3n(n2)[C@@H](C(F)(F)C(F)(F)F)C[C@@H](C)N3)c1O,C22711539_decoy,TRY1,Decoy,0,-7.35199,-7.96,-3.51,-7.632504565281482
COc1ccc(OC)c(NC(=O)c2c(NC(=O)C[NH2+]Cc3ccco3)sc3c2CCC3)c1,C06552866_decoy,TRY1,Decoy,0,-8.29419,-6.85,-3.82,-6.809613417285478
CC[NH+](CC)Cc1c(C(=O)N/N=C/c2c(Cl)cccc2Cl)nnn1-c1nonc1N,C08443061_decoy,TRY1,Decoy,0,-8.46512,-7.19,-1.83,-7.731569461536951
CCOc1ccccc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCC(C)CC1,C03633210_decoy,TRY1,Decoy,0,-7.69853,-6.51,-3.12,-5.978543177866441
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C=C(c2ccc(OCCc3ccccc3)cc2)NN1,C39016639_decoy,TRY1,Decoy,0,-8.33991,-8.31,-3.12,-6.484908194161962
CCCCCCC(=O)N1C[C@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685828_decoy,TRY1,Decoy,0,-8.50064,-6.28,-3.22,-8.438481232349984
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685856_decoy,TRY1,Decoy,0,-9.04669,-4.71,-1.0,-6.118781246000636
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39693426_decoy,TRY1,Decoy,0,-8.87566,-6.48,-1.53,-6.560586581259814
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@@H]1NN[C@H](c2ccc(OC)cc2)[NH+]1CC(=O)[O-],C39708416_decoy,TRY1,Decoy,0,-8.38345,-5.7,-1.61,-5.71432354973553
COc1cccc([C@H](C[NH2+]C[C@H](O)COC[C@@H]2CCCO2)c2c[nH]c3ccccc23)c1OC,C40459138_decoy,TRY1,Decoy,0,-8.80377,-5.52,-3.28,-6.930894720781692
COc1cccc([C@H](C[NH2+]C[C@@H](O)COC[C@@H]2CCCO2)c2c[nH]c3ccccc23)c1OC,C40459142_decoy,TRY1,Decoy,0,-8.34218,-5.03,-3.12,-5.431201127037324
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])c1ccc(Cl)cc1Cl,C40658830_decoy,TRY1,Decoy,0,-8.21877,-6.91,-3.23,-6.0325566489855
CC(=O)N1CCC([NH2+][C@H]2CC(C)(C)[C@@H]3C[C@@](C)(O)CC[C@@]23CCC(=O)NCCN2CCOCC2)CC1,C43547728_decoy,TRY1,Decoy,0,-10.0553,-5.52,-3.07,-6.002667445949949
COCCNC(=O)CC[C@@]12CC[C@](C)(O)C[C@H]1C(C)(C)C[C@@H]2[NH2+]C1CCN(C(C)=O)CC1,C44681606_decoy,TRY1,Decoy,0,-8.37898,-7.05,-2.41,-7.840489886717815
CCc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(Cc3ccc(OC)c(F)c3)CC2)n1,C45411016_decoy,TRY1,Decoy,0,-8.58248,-6.38,-1.84,-5.517072292924793
CCOC(=O)C1=C(C[NH+]2CCC[C@H](C(=O)Nc3ccccc3)C2)NC(=O)N[C@H]1c1ccco1,C45606835_decoy,TRY1,Decoy,0,-7.786,-7.31,-2.19,-6.146126584593715
CCCCn1c(N)c(N(CC)C(=O)C[NH+](Cc2ccc(C(C)C)cc2)C2CC2)c(=O)[nH]c1=O,C15520277_decoy,TRY1,Decoy,0,-8.54674,-6.67,-2.87,-6.141858885792182
COc1ccc(-[n+]2c(SCC(=O)NCCC3=CCCCC3)nc3[nH]nc(C)c3c2N)cc1,C49539801_decoy,TRY1,Decoy,0,-10.7805,-8.9,-1.53,-14.314905935366198
CCCc1ccc(-c2cc(NC(=O)NC[C@H](c3ccco3)[NH+]3CCCC3)n(CCO)n2)cc1,C60330591_decoy,TRY1,Decoy,0,-10.061,-7.3,-1.89,-7.945129385667061
O=C(CCCCCN1C(=O)c2ccccc2N[C@@H]1O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63376389_decoy,TRY1,Decoy,0,-9.05565,-8.31,-1.47,-6.3700521605230325
CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccc(NC(=O)[C@H](C)n2cncn2)cc1,C63405736_decoy,TRY1,Decoy,0,-9.1931,-7.97,-2.35,-7.993828329108601
O=C(CC12CC3CC(CC(C3)C1)C2)Nc1cccc2nc(NCC[NH2+]CCO)ccc12,C03818225_decoy,TRY1,Decoy,0,-9.64966,-6.33,-2.67,-5.62618896317839
CCc1cccc2c1NC(=O)[C@@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C02136680_decoy,TRY1,Decoy,0,-8.38616,-6.72,-2.05,-6.236533710097665
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C02136682_decoy,TRY1,Decoy,0,-8.9526,-7.93,-1.13,-9.024354824660875
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C02136688_decoy,TRY1,Decoy,0,-9.14257,-7.28,-1.37,-8.468847727954715
CC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCC[NH+](C)C,C04222256_decoy,TRY1,Decoy,0,-8.71915,-6.82,-3.43,-6.839132075003131
Nc1nonc1C(=O)NCC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1,C02436402_decoy,TRY1,Decoy,0,-7.93711,-7.25,-1.68,-8.106685942102734
CC[NH+](CC)CCN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC(C)(C)C)c1ccc(Cl)cc1,C06511784_decoy,TRY1,Decoy,0,-8.22143,-6.0,-1.61,-6.274529664370469
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C08551993_decoy,TRY1,Decoy,0,-8.27163,-6.02,-2.66,-6.333832415619204
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3cccc(Cl)c3C)n2)s1,C09938586_decoy,TRY1,Decoy,0,-11.6982,-5.59,-3.39,-9.071757918318328
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(CC[NH+]2CCOCC2)C(=O)c2snc(C(N)=O)c2N)cc1,C12701936_decoy,TRY1,Decoy,0,-9.8737,-6.34,-1.18,-8.3033021042354
Cc1ccc(SCc2cc(=O)nc(NC(=[NH2+])Nc3ccc4c(c3)OCCO4)[nH]2)cc1,C03873224_decoy,TRY1,Decoy,0,-9.9873,-7.37,-3.95,-6.832602321669348
COCCNC(=S)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)Nc3ccccc3)[NH+]2C1,C15708104_decoy,TRY1,Decoy,0,-7.14758,-5.32,-2.64,-5.151192706135976
CCOc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2)cc(Br)c1OCC(N)=O,C16688329_decoy,TRY1,Decoy,0,-8.77454,-5.21,-4.32,-6.37941676261346
COc1ccc(/C=N/[NH+]=C(\N)c2nonc2N)cc1CSc1nnc(C)s1,C17082862_decoy,TRY1,Decoy,0,-9.75399,-7.32,-2.41,-7.96042486222198
CCNC(=O)N[C@H]1CC[C@]2(C)CC[C@H]([C@H](C)C(=O)NCC[NH+]3CCCC3)[C@H](O)[C@H]2[C@@H]1C,C20467332_decoy,TRY1,Decoy,0,-8.40364,-6.9,-2.19,-5.7614513680179815
COc1cccc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)c1OCC(N)=O,C20872546_decoy,TRY1,Decoy,0,-8.2812,-6.71,-3.01,-5.859281852206778
C[NH+](CC(=O)Nc1ccccc1Br)Cc1nc(N)nc(Nc2ccc(Cl)cc2)n1,C23038676_decoy,TRY1,Decoy,0,-8.68014,-6.66,-1.76,-6.222791234372336
CCCCCCc1cc2cc(/C(N)=[NH+]\NC(=O)c3cccc([N+](=O)[O-])c3)c(=O)oc2cc1O,C27496690_decoy,TRY1,Decoy,0,-8.2971,-7.24,-2.97,-6.994845053988643
CC1=CCC[C@@H](C)[C@]1(C)CC/C(C)=C/CC/C(=C\CS(=O)(=O)CC[NH+]=C(N)N)CO,C17218656_decoy,TRY1,Decoy,0,-10.8519,-6.42,-2.41,-9.532445718668846
NS(=O)(=O)c1ccc(CC[NH2+]C[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1,C32682396_decoy,TRY1,Decoy,0,-7.45094,-5.77,-1.8,-4.938784328748906
CC[C@@H](C)[C@@H](NC(=O)CCCCC[NH3+])C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C33498037_decoy,TRY1,Decoy,0,-11.6088,-7.63,-3.33,-9.70612815259721
C[NH2+]C[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)COC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1,C33738405_decoy,TRY1,Decoy,0,-8.35738,-6.59,-3.54,-7.631051061269131
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)NCC[NH2+]C[C@H](O)COc1cccc2ccccc12,C35395426_decoy,TRY1,Decoy,0,-9.08676,-7.36,-2.82,-7.960056956981066
[O-][C@@H](COc1ccc(OC[C@H](O)C[NH2+]C[C@@H]2CCCO2)cc1)[NH2+]C[C@@H]1CCCO1,C33927853_decoy,TRY1,Decoy,0,-8.85758,-6.18,-1.38,-5.921275930814422
[O-][C@@H](COc1ccc(OC[C@H](O)C[NH2+]C[C@H]2CCCO2)cc1)[NH2+]C[C@@H]1CCCO1,C33927855_decoy,TRY1,Decoy,0,-8.79398,-5.81,-1.82,-5.641201974830782
O=[N+]([O-])c1ccc([O-])c(C[NH2+]CCCCCC[NH2+]Cc2cc([N+](=O)[O-])ccc2O)c1,C36081791_decoy,TRY1,Decoy,0,-7.4434,-5.97,-4.11,-6.0870544272382325
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C03830997_decoy,TRY1,Decoy,0,-7.95831,-4.81,-2.14,-4.904710545218194
COCCC(=O)N[C@@H]1c2cc(N[C@@H](C)C(C)(C)O)c[nH+]c2N(CCc2c[nH]c3ccccc23)[C@@H]1C(=O)OC,C39344770_decoy,TRY1,Decoy,0,-9.43173,-7.49,-3.85,-9.704810325201752
COCCC(=O)N[C@@H]1c2cc(N[C@H](C)C(C)(C)O)c[nH+]c2N(CCc2c[nH]c3ccccc23)[C@@H]1C(=O)OC,C39344771_decoy,TRY1,Decoy,0,-8.90287,-7.06,-1.64,-6.867477560044172
O=C(NC[C@H]1N[C@@H](c2ccccc2)CS1)c1ccc(C[NH+]2CCC[C@H]2CO)[nH]c1=O,C39445388_decoy,TRY1,Decoy,0,-7.65613,-6.24,-3.77,-4.990713234055394
CS(=O)(=O)Nc1ccc(CC2=NO[C@H](C3=CC4=C(CC[NH3+])C=N[C@@H]4C=C3)N2)cc1,C39947078_decoy,TRY1,Decoy,0,-9.94022,-7.41,-1.58,-6.890661933549716
CS(=O)(=O)Nc1ccc(CC2=NO[C@H](C3=CC4=C(CC[NH3+])C=N[C@H]4C=C3)N2)cc1,C39947080_decoy,TRY1,Decoy,0,-10.4037,-7.06,-1.45,-6.206962005764891
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccccc1C,C40744446_decoy,TRY1,Decoy,0,-8.46255,-7.53,-2.71,-7.479677414226333
COc1cccc(C[NH2+]CCNC(=O)c2nonc2N)c1OCc1ccc(Cl)c(Cl)c1,C40744449_decoy,TRY1,Decoy,0,-7.99088,-7.48,-2.55,-7.250766054791331
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OC(C)C,C40744462_decoy,TRY1,Decoy,0,-8.1028,-6.67,-1.55,-7.021746548881463
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OCc1ccccc1C,C40744489_decoy,TRY1,Decoy,0,-7.50818,-6.7,-4.42,-5.795304872442043
Nc1nonc1C(=O)NCC[NH2+]Cc1cc(Br)ccc1OCc1ccc(Cl)c(Cl)c1,C40744521_decoy,TRY1,Decoy,0,-10.4195,-8.24,-2.19,-8.693316449031252
Cc1c(C(N)=O)cc(-c2cc(-c3ccccc3)no2)n1[C@@H](Cc1ccc(O)cc1)C(=O)NCC[NH+]1CCCC1,C43225960_decoy,TRY1,Decoy,0,-9.81762,-6.73,-1.49,-6.808398837602242
Cc1cc(C)cc(NCc2ccc3[nH+]c(NC[C@H](O)CO)n(Cc4[nH+]c(C)ccc4[O-])c3c2)c1,C29134124_decoy,TRY1,Decoy,0,-9.87107,-7.03,-2.88,-6.28317577724541
Cc1nnc(SCc2cc(=O)[nH]c(NC(=[NH2+])Nc3ccccc3Sc3ccccc3)n2)s1,C15978689_decoy,TRY1,Decoy,0,-9.77155,-7.48,-2.05,-7.381943713930502
COc1ccc(-c2cc(N)c(C(=O)NNC(=O)CCCC3=c4ccccc4=[NH+]C3)s2)cc1,C63182702_decoy,TRY1,Decoy,0,-9.02435,-7.14,-1.86,-5.717404120261624
CC1=C(C[NH2+]CCCc2n[nH]c(N)c2C#N)[C@@H](C)N(Cc2c(Cl)cccc2Cl)N1,C39940013_decoy,TRY1,Decoy,0,-8.16105,-7.38,-2.5,-9.925801651431316
COc1ccc2c(c1)=C(CCNC(=O)CC[C@H]1NN[C@H](C(=O)Nc3ccccc3)S1)C[NH+]=2,C63686259_decoy,TRY1,Decoy,0,-9.12344,-6.74,-2.52,-7.241012915107037
CCc1ccccc1Nc1nc(N)nc(CN2C(=O)N[C@H](CC3=c4ccccc4=[NH+]C3)C2=O)n1,C63726272_decoy,TRY1,Decoy,0,-7.64956,-7.74,-2.85,-6.953269271483726
Cc1cc(OC[C@H](O)C[NH2+]C[C@H](O)COc2ccc(Cl)c(C)c2)ccc1Cl,C02685830_decoy,TRY1,Decoy,0,-9.74955,-5.75,-2.51,-6.753103277755976
Cc1cc(OC[C@@H](O)C[NH2+]C[C@H](O)COc2ccc(Cl)c(C)c2)ccc1Cl,C02685832_decoy,TRY1,Decoy,0,-9.86068,-6.23,-1.83,-9.055697346342512
Cc1cc(OC[C@H](O)C[NH2+]C[C@@H](O)COc2ccc(Cl)c(C)c2)ccc1Cl,C02685833_decoy,TRY1,Decoy,0,-9.77601,-7.08,-2.83,-7.434132722472668
O=C(C1=C(O)C(=O)N(CC[NH2+]CCO)[C@H]1c1ccc(Cl)cc1)c1ccccc1,C04576455_decoy,TRY1,Decoy,0,-7.80567,-5.37,-0.35,-6.106248223174238
COc1cc(C[NH2+][C@H](C)C23CC4CC(CC(C4)C2)C3)cc(Cl)c1OCC(N)=O,C04618963_decoy,TRY1,Decoy,0,-8.82075,-6.13,-1.74,-6.121100309556608
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccccc2OCc2ccc(F)cc2)cc1,C05306369_decoy,TRY1,Decoy,0,-7.42366,-7.8,-2.53,-6.273521134570297
N#Cc1ccc(OC[C@@H](O)C[NH2+]C[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1,C06949597_decoy,TRY1,Decoy,0,-8.02141,-8.8,-1.26,-7.874336158188157
N#Cc1ccc(OC[C@@H](O)C[NH2+]C[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1,C06949601_decoy,TRY1,Decoy,0,-7.59017,-7.78,-3.43,-6.209304903190204
N#Cc1ccc(OC[C@H](O)C[NH2+]C[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1,C06949606_decoy,TRY1,Decoy,0,-8.29916,-8.24,-1.18,-7.7190241829145565
N#Cc1ccc(OC[C@H](O)C[NH2+]C[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1,C06949609_decoy,TRY1,Decoy,0,-8.37239,-6.5,-2.54,-6.29990674700333
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccc(OCc3cccs3)cc2)cc1,C07523975_decoy,TRY1,Decoy,0,-8.29289,-5.95,-2.86,-6.219323691151922
C=CC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1ccc(Cl)s1,C08164305_decoy,TRY1,Decoy,0,-10.5542,-6.92,-2.17,-7.017254877429089
CCOc1cc(C[NH2+]C2CCCCCCC2)cc(Br)c1OCC(N)=O,C08253714_decoy,TRY1,Decoy,0,-7.88803,-5.56,-4.97,-5.369682822988233
CC[NH+]1CCc2c(sc(NC(=O)CCCSc3ccccc3)c2C(N)=O)C1,C09472778_decoy,TRY1,Decoy,0,-10.5118,-6.96,-2.6,-7.443535082857016
CCC[NH+](CCC)CCCNC(=O)c1ccc2c(c1)NC(=O)[C@H](CSCc1ccccc1C)N2,C09490584_decoy,TRY1,Decoy,0,-9.05664,-7.22,-2.21,-6.868638163953897
Cc1c(Cl)cccc1NC(=O)CNC(=O)C[NH2+][C@@H](c1ccccc1)c1cccs1,C09729944_decoy,TRY1,Decoy,0,-8.32866,-7.69,-1.08,-7.244077641514654
Cc1c(Cl)cccc1NC(=O)CNC(=O)C[NH2+][C@H](c1ccccc1)c1cccs1,C09729947_decoy,TRY1,Decoy,0,-7.85478,-8.14,-1.87,-7.4524216886418895
CCOc1ccc(C[NH2+]CCc2ccc(S(N)(=O)=O)cc2)cc1Br,C10475139_decoy,TRY1,Decoy,0,-8.48868,-4.18,-5.05,-0.6267825777007361
CCOc1c(Cl)cc(C[NH2+]CCc2ccc(S(N)(=O)=O)cc2)cc1Cl,C10475149_decoy,TRY1,Decoy,0,-8.87136,-3.59,-3.46,-5.197502398935896
C=CCC(O)(CC=C)C[NH2+]C1CCN(c2ccc(NC(=O)C3CCCC3)cc2)CC1,C12218846_decoy,TRY1,Decoy,0,-9.16989,-6.25,-3.29,-5.914161214117684
CC(C)(CO)CNC(=O)C[C@H]1C(=O)NCC[NH+]1Cc1ccccc1C(F)(F)F,C12703324_decoy,TRY1,Decoy,0,-7.29721,-6.37,-2.2,-6.122854982270833
CC(C)(CO)CNC(=O)C[C@@H]1C(=O)NCC[NH+]1Cc1ccccc1C(F)(F)F,C12703329_decoy,TRY1,Decoy,0,-7.4838,-7.12,-1.64,-5.695087946975606
CCCn1c(N)c(C(=O)C[NH+](Cc2ccco2)Cc2cccs2)c(=O)[nH]c1=O,C12890117_decoy,TRY1,Decoy,0,-6.4235,-7.12,-3.24,-7.614273157113534
CCCCN(C(=O)C[NH+]1C[C@H](C)C[C@@H](C)C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13063284_decoy,TRY1,Decoy,0,-7.29203,-6.8,-1.12,-5.722362195553584
Cc1c(-c2ccc(O)cc2)n(CCCC[NH2+]Cc2ccccn2)c2ccc(O)cc12,C13649981_decoy,TRY1,Decoy,0,-7.78395,-7.13,-2.15,-5.516834019966112
Cc1ccccc1OCC[NH+](C)[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C15099860_decoy,TRY1,Decoy,0,-9.35043,-7.03,-1.89,-7.252969535656173
Cc1ccc(OCC[NH+](C)[C@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1,C15102862_decoy,TRY1,Decoy,0,-9.58149,-7.09,-2.48,-7.206564293576535
Cc1ccc(OCC[NH+](C)[C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1,C15102863_decoy,TRY1,Decoy,0,-9.37098,-7.31,-2.0,-7.002313166038143
Cc1ccc(OCC[NH+](C)CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1,C15102893_decoy,TRY1,Decoy,0,-9.72448,-7.25,-2.06,-7.402102306580163
COc1ccc(C(=O)C2=C(O)C(=O)N(CC[NH2+]CCO)[C@H]2c2cccs2)cc1,C04818067_decoy,TRY1,Decoy,0,-8.39045,-5.42,-1.42,-5.9808927062728126
CC(C)CNC(=S)NNC(=O)C1CC[NH+](Cc2ccc(F)cc2Cl)CC1,C20352218_decoy,TRY1,Decoy,0,-7.68082,-7.07,-3.54,-5.218370216750464
CCOc1ccccc1NC(=O)CCSc1nc2n[nH]c(C)c2c(=[NH2+])n1-c1cccc(Cl)c1,C03032094_decoy,TRY1,Decoy,0,-8.56651,-8.58,-1.23,-7.802298887029212
Cn1nnnc1SCC[NH2+]Cc1cc(Br)ccc1OCC(N)=O,C20873080_decoy,TRY1,Decoy,0,-8.69581,-6.64,-3.53,-7.6099551628584035
O=C(C[NH+](Cc1ccc(C(=O)NCC(F)(F)F)cc1)C1CC1)NC(=O)NCCC1=CCCCC1,C29698457_decoy,TRY1,Decoy,0,-8.91647,-8.29,-2.54,-7.30978211836983
CSCC[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1,C29787177_decoy,TRY1,Decoy,0,-8.27586,-5.99,-1.37,-5.685744511363869
COCCCNC(=O)c1cc(NC(=O)Nc2ccc(C)cc2C)ccc1N1CC[NH+](Cc2ccccc2)CC1,C34718526_decoy,TRY1,Decoy,0,-8.26461,-7.64,-3.05,-6.459128208833593
Cc1cccc(C)c1NC(=O)C[NH+](C)[C@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C09684335_decoy,TRY1,Decoy,0,-8.3972,-8.4,-3.43,-6.978466633850314
CCOC(=O)[C@@H]1NN(c2ccccc2C)C(=O)C[C@H]1[NH2+]CCc1c[nH]c2ccccc12,C39387614_decoy,TRY1,Decoy,0,-8.70927,-7.59,-3.36,-7.048428750633222
CCOC(=O)[C@H]1NN(c2ccccc2C)C(=O)C[C@@H]1[NH2+]CCc1c[nH]c2ccccc12,C39387615_decoy,TRY1,Decoy,0,-7.15889,-8.07,-1.13,-6.037173525563496
Cc1ccc([C@@H]2NN(c3cccc(F)c3)C[C@H]2C[NH2+]CCSc2nc[nH]n2)o1,C39420918_decoy,TRY1,Decoy,0,-8.66134,-6.45,-1.43,-6.776491798403572
Cc1ccc([C@@H]2NN(c3cccc(F)c3)C[C@@H]2C[NH2+]CCSc2nc[nH]n2)o1,C39420920_decoy,TRY1,Decoy,0,-9.13959,-5.72,-2.21,-5.731443403756046
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1,C40146746_decoy,TRY1,Decoy,0,-8.18768,-6.26,-5.26,-6.122189984108187
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1,C40146747_decoy,TRY1,Decoy,0,-8.13366,-6.4,-2.64,-5.92723710567099
CSCCNC(=O)[C@H]1C[NH2+]C[C@@H]1C(=O)NCCc1ccc(Cl)cc1Cl,C43223233_decoy,TRY1,Decoy,0,-9.33186,-4.58,-1.48,-5.998677031078757
CCC(CC)[C@@H](CNC(=O)Nc1ccc(N2CCNC(=O)C2)cc1)[NH+]1CCCC1,C58155453_decoy,TRY1,Decoy,0,-9.2916,-5.68,-2.1,-5.708046356743442
CCC(CC)[C@H](CNC(=O)Nc1ccc(N2CCNC(=O)C2)cc1)[NH+]1CCCC1,C58155456_decoy,TRY1,Decoy,0,-8.59425,-6.18,-0.67,-6.812787753444836
C[NH+](CCCNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1)Cc1ccccc1,C58647264_decoy,TRY1,Decoy,0,-7.32492,-6.56,-3.07,-7.184144437914172
CCOc1ccc(CCNC(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1OCC,C59113962_decoy,TRY1,Decoy,0,-8.04515,-5.96,-3.05,-5.354080443090687
Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)[C@@H]([NH3+])CC(C)C)cc2)cc1,C59148005_decoy,TRY1,Decoy,0,-9.19149,-6.64,-5.32,-5.806135964638071
Nc1nc(COC(=O)CCCC2=c3ccccc3=[NH+]C2)nc(Nc2ccccc2)n1,C63399318_decoy,TRY1,Decoy,0,-8.16228,-8.65,-3.55,-8.77785591915917
CCc1ccc2[nH]c(=O)c(CN(CCO)C(=S)NCCC[NH+](CC)CC)cc2c1,C04131981_decoy,TRY1,Decoy,0,-9.37963,-5.34,-1.47,-6.329536093550561
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2ccc(C)c(C)c2[nH]c1=O,C04132290_decoy,TRY1,Decoy,0,-7.52732,-6.28,-1.56,-6.1032260767498565
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C04132857_decoy,TRY1,Decoy,0,-7.91095,-6.38,-2.09,-5.875357846621978
CCOc1ccc2[nH]c(=O)c(CN(CCCO)C(=S)NCCC[NH+](C)C)cc2c1,C04133057_decoy,TRY1,Decoy,0,-8.37411,-5.75,-3.84,-6.465505328195802
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2ccc(OC)cc2[nH]c1=O,C04133120_decoy,TRY1,Decoy,0,-6.60549,-5.56,-4.26,-6.340877244506426
O=[N+]([O-])c1ccc(NCC[NH2+]C[C@@H](O)COc2cccc3ccccc23)c2nonc12,C05260574_decoy,TRY1,Decoy,0,-6.9376,-5.94,-3.05,-5.649784660564781
O=[N+]([O-])c1ccc(NCC[NH2+]C[C@H](O)COc2cccc3ccccc23)c2nonc12,C05260577_decoy,TRY1,Decoy,0,-7.05393,-6.23,-2.08,-5.06559790170086
CCOc1cc2c(NCCC[NH+](CCO)CCO)ncnc2c(OCC)c1OCC,C05648436_decoy,TRY1,Decoy,0,-8.072,-5.11,-3.47,-5.361725017012768
CCCCn1c(N)c(N(C(=O)C[NH+](C)Cc2ccco2)C2CCCC2)c(=O)[nH]c1=O,C07523307_decoy,TRY1,Decoy,0,-7.41219,-4.89,-2.74,-5.583670447947706
CCC[NH+](Cc1nc(N)nc(Nc2ccccc2C)n1)Cc1nnc(-c2ccco2)o1,C07494451_decoy,TRY1,Decoy,0,-7.34819,-7.67,-3.27,-7.247089306798948
CCOc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](CC)CC)cc1,C02329547_decoy,TRY1,Decoy,0,-8.48891,-6.94,-4.21,-6.875287406359793
O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@@H](c1cccs1)[NH+]1CCOCC1,C08710914_decoy,TRY1,Decoy,0,-8.2048,-7.55,-2.4,-6.472212791470663
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1cccs1)[NH+]1CCOCC1,C08721153_decoy,TRY1,Decoy,0,-9.03397,-7.14,-6.18,-6.015833742429482
COc1ccc(SCCCC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)cc1,C09473033_decoy,TRY1,Decoy,0,-9.30627,-5.3,-1.56,-5.610166202883911
COCC[NH+](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)Cc1nnc(-c2cccs2)o1,C09666110_decoy,TRY1,Decoy,0,-8.37559,-7.69,-2.45,-7.827491118171157
C=C(Cl)COc1nc2cc(OC)c(OC)cc2cc1C[NH2+][C@@H](CC(C)C)C(N)=O,C12451618_decoy,TRY1,Decoy,0,-10.1129,-6.34,-2.68,-7.5347518479432605
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F,C12782902_decoy,TRY1,Decoy,0,-8.84613,-8.24,-3.2,-7.558006251566329
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccc(Br)s2)c(=O)[nH]c1=O,C12859106_decoy,TRY1,Decoy,0,-8.3603,-6.39,-2.01,-9.740498644388952
CCN(CC)c1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2C[NH+](C)C)cc1,C03640460_decoy,TRY1,Decoy,0,-8.73049,-6.73,-4.8,-6.591457653035904
CCCCn1c(N)c(N(CC)C(=O)C[NH+]2CCC[C@H](C(=O)OCC)C2)c(=O)[nH]c1=O,C15402223_decoy,TRY1,Decoy,0,-8.16194,-5.51,-4.59,-5.669762204447134
CCN(CC)C(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)Nc3ccccc3)C[NH+]12,C15708664_decoy,TRY1,Decoy,0,-7.54369,-6.33,-2.94,-7.184057987424294
CCCn1c(N)c(C(=O)C[NH+](C)Cc2ccc(OC)c(OC)c2OC)c(=O)[nH]c1=O,C16561841_decoy,TRY1,Decoy,0,-6.54268,-6.42,-3.17,-5.663313469026945
CCn1cc(C[NH2+]CCNC(=O)C(=O)Nc2sc(C)c(C)c2C(=O)OC)c(C)n1,C02733876_decoy,TRY1,Decoy,0,-8.54944,-7.07,-2.5,-7.4078240899579
CCOC(=O)c1c(NC(=O)C[NH+](C)Cc2cnn(CC)c2C)sc(C(N)=O)c1C,C17092751_decoy,TRY1,Decoy,0,-8.79491,-6.22,-2.7,-5.8725016394838
Cc1nn(C)cc1C[NH+](C)CC(=O)Nc1sc(C(N)=O)c(C)c1C(=O)OC(C)C,C17092754_decoy,TRY1,Decoy,0,-8.61653,-6.9,-1.78,-6.909836457600523
COC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)C[NH+]1CCN(CCO)CC1,C19372448_decoy,TRY1,Decoy,0,-7.92694,-6.92,-2.02,-5.79345275054614
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C04132707_decoy,TRY1,Decoy,0,-6.58078,-5.23,-2.1,-4.788809398692804
COc1cc(C[NH2+]C[C@@H](C)O)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCO2,C20877027_decoy,TRY1,Decoy,0,-8.51018,-6.5,-3.29,-5.537873689334167
Cc1nc(CCNCc2cccc(OC[C@H](O)C[NH+]3CCC(O)CC3)c2)sc1C,C20906459_decoy,TRY1,Decoy,0,-9.75517,-6.71,-4.16,-6.863936390113065
CCOC(=O)C1=C(CN2CC[NH+](CC(=O)NCCCOC)CC2)NC(=O)N[C@H]1CC,C21704929_decoy,TRY1,Decoy,0,-8.13185,-5.46,-1.94,-5.396779482644752
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccc(F)cc2F)c(=O)[nH]c1=O,C22964850_decoy,TRY1,Decoy,0,-8.2227,-6.7,-2.31,-5.946217365453582
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)CCCOc1ccc(F)cc1,C30268463_decoy,TRY1,Decoy,0,-9.0712,-5.84,-2.56,-6.669991843685982
COc1cc(N)c(Cl)cc1C(=O)CCC1CC[NH+](CCNS(C)(=O)=O)CC1,C00600432_decoy,TRY1,Decoy,0,-8.47056,-5.98,-2.44,-7.140015735437488
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cc1,C06084346_decoy,TRY1,Decoy,0,-7.30279,-7.13,-1.37,-5.700364121862012
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cc1,C06084349_decoy,TRY1,Decoy,0,-8.63355,-6.84,-2.82,-6.230359522692591
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(=O)NC[C@H](c2ccco2)[NH+](C)C)cc1,C06084354_decoy,TRY1,Decoy,0,-8.07539,-6.14,-2.55,-5.887329791359053
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccsc2)nnn1-c1nonc1N,C03633083_decoy,TRY1,Decoy,0,-8.52863,-6.93,-4.55,-7.097642559773006
COCCNC(=O)COc1ccc(OCC[NH2+]C[C@@H](O)COc2ccccc2)cc1,C03995758_decoy,TRY1,Decoy,0,-7.7902,-5.54,-3.23,-5.269853504802689
CCCCCOc1ccc(C2=C[C@@H](C(=O)N/N=C/C3=c4ccccc4=[NH+]C3)NN2)cc1,C39021245_decoy,TRY1,Decoy,0,-8.4487,-8.82,-1.55,-6.96587285859261
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601737_decoy,TRY1,Decoy,0,-7.31544,-7.09,-2.73,-5.857519203808526
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39631358_decoy,TRY1,Decoy,0,-9.62527,-7.3,-0.82,-7.778847673963106
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])c1cccc(Cl)c1,C40658625_decoy,TRY1,Decoy,0,-7.83116,-7.13,-1.61,-6.618987573968346
COc1ccccc1C[NH2+][C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@@]12CCC(=O)NCCN1CCOCC1,C43547730_decoy,TRY1,Decoy,0,-9.99929,-7.4,-2.46,-7.101899075906252
CCCCOc1ccc(OCCCC)c2c1N[C@]1([NH2+]2)C(=O)Nc2ccc([N+](=O)[O-])cc21,C04421201_decoy,TRY1,Decoy,0,-8.76411,-6.76,-2.1,-7.191891073851014
CCc1nnc(NC(=O)C[NH2+]CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1,C58866847_decoy,TRY1,Decoy,0,-6.24219,-6.97,-3.36,-5.21145173586175
CCCCC[NH+](CC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O)C(C)C,C59350271_decoy,TRY1,Decoy,0,-7.23424,-5.58,-4.25,-5.553605667522692
C=CCN1[C@H](CC2=c3ccccc3=[NH+]C2)NN[C@@H]1SCC(=O)NCc1ccccc1,C63289604_decoy,TRY1,Decoy,0,-9.44546,-7.79,-2.31,-8.015150427930822
O=C(CS[C@H]1Nc2ccccc2C(=O)N1NC(=O)CCC1=c2ccccc2=[NH+]C1)NC[C@H]1CCCO1,C63708499_decoy,TRY1,Decoy,0,-9.11418,-6.45,-2.33,-6.76151762135409
CCN[C@H]1NN=C(SCC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)OC)S1,C63855249_decoy,TRY1,Decoy,0,-8.31269,-6.83,-1.43,-6.258332250540699
CCN[C@H]1NN=C(SCC(=O)N[C@H](CC2=c3ccccc3=[NH+]C2)C(=O)OC)S1,C63855251_decoy,TRY1,Decoy,0,-8.69345,-6.56,-2.2,-7.440864870525274
CC[NH+](CC)CCCNC(=S)N(CCO)Cc1cc2ccc(C)cc2[nH]c1=O,C04131623_decoy,TRY1,Decoy,0,-6.1894,-5.52,-2.22,-4.629349222698851
Cc1cc(C)c2cc(CN(CCCO)C(=S)NCCC[NH+](C)C)c(=O)[nH]c2c1,C04132467_decoy,TRY1,Decoy,0,-7.67612,-6.35,-2.74,-5.6053067276959005
Cc1ccc(C)c2[nH]c(=O)c(CN(CCCO)C(=S)NCCC[NH+](C)C)cc12,C04132880_decoy,TRY1,Decoy,0,-7.67142,-6.52,-2.05,-6.137733212201723
CCOC(=O)C1=C(C[NH2+]Cc2ccccc2Cl)NC(=O)N[C@H]1c1cccs1,C05007062_decoy,TRY1,Decoy,0,-9.10801,-6.99,-1.27,-10.69649513764665
CC[C@H](c1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)o1)[NH+](C)C,C02726058_decoy,TRY1,Decoy,0,-9.82974,-6.22,-0.97,-8.141666621431074
CCCCCNC(=O)C[NH+]1CC[C@@]2(O)CCCC[C@H]2[C@@H]1c1ccc(O)c(OC)c1,C04062565_decoy,TRY1,Decoy,0,-9.09661,-6.41,-2.06,-6.660712261045218
C[C@]1(CSc2ccccc2C(=O)NCc2ccccc2C[NH+]2CCOCC2)NC(=O)NC1=O,C09883864_decoy,TRY1,Decoy,0,-8.65924,-7.73,-1.52,-7.68739808468435
CC(C)S(=O)(=O)c1ccc(CC(=O)Nc2sc3c(c2C(N)=O)CC[NH+](Cc2ccccc2)C3)cc1,C12070733_decoy,TRY1,Decoy,0,-9.06061,-6.77,-1.75,-5.827426655098979
CC(C)(C)NS(=O)(=O)c1ccc(NCCC[NH2+]C2CCCCC2)c([N+](=O)[O-])c1,C12537233_decoy,TRY1,Decoy,0,-7.78747,-4.5,-4.03,-5.02658742526916
Cc1ncc(CO)c(CO)c1OC[C@H](O)C[NH+]1CCN(c2ccc(F)cc2)CC1,C05552004_decoy,TRY1,Decoy,0,-8.05427,-7.18,-1.57,-5.536297708449884
CCCCN(C(=O)C[NH+](C)C1CCCCCC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C14705218_decoy,TRY1,Decoy,0,-8.26818,-5.78,-4.64,-5.770810363511189
C[NH+](CCOc1ccccc1F)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C15046912_decoy,TRY1,Decoy,0,-9.95352,-7.45,-1.57,-7.179763124003104
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)CCOc1ccc(F)cc1,C15101720_decoy,TRY1,Decoy,0,-9.03932,-7.05,-1.55,-6.480729300665892
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+](C)CCOc1ccc(F)cc1,C15101721_decoy,TRY1,Decoy,0,-9.22407,-6.77,-1.91,-7.02062911803297
C=CC[NH+](CC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C)Cc1ccc(Cl)s1,C15411363_decoy,TRY1,Decoy,0,-9.84005,-7.03,-0.97,-6.811249693522135
CC(=O)NCCNC(=O)C[C@@H]1CC[NH2+]C[C@@H]1Cc1cc(CC2CCCCC2)on1,C15673652_decoy,TRY1,Decoy,0,-9.2639,-6.1,-3.09,-7.187814702722515
COc1ccc(C(=O)C2=C(O)C(=O)N(CC[NH2+]CCO)[C@@H]2c2ccccc2F)cc1,C04818057_decoy,TRY1,Decoy,0,-8.59217,-5.87,-1.78,-6.234606060783464
Cc1nnc(C[NH2+]Cc2cc(Cl)ccc2OC[C@H](O)C[NH+]2CCCCCC2)[n-]1,C19335324_decoy,TRY1,Decoy,0,-8.46178,-6.89,-2.43,-7.698651970389072
CCNc1nc2nc(SCC(=O)Nc3c(Cl)cccc3Cl)nn2c(NCC)[nH+]1,C00629348_decoy,TRY1,Decoy,0,-9.47756,-6.02,-2.61,-6.661498365356246
C[NH+](CCc1ccccn1)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNS(=O)(=O)c1ccccc1,C20465872_decoy,TRY1,Decoy,0,-6.96189,-5.43,-2.15,-5.204522132795519
CC(C)CN(C[C@@H](O)[C@@H]([NH3+])Cc1ccc(OCc2ccccc2)cc1)S(=O)(=O)c1ccc2c(c1)OCO2,C22012689_decoy,TRY1,Decoy,0,-8.71092,-7.64,-3.03,-6.361489148106418
CC[C@H]1CCCC[NH+]1CC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C23991369_decoy,TRY1,Decoy,0,-7.35448,-6.26,-2.97,-5.560994098745723
COc1cc(OC)cc(C(=O)N[C@H](CCSC)C(=O)N2CCC3(CC2)[NH2+]CCc2[nH]cnc23)c1,C25107565_decoy,TRY1,Decoy,0,-7.91748,-6.18,-3.06,-5.919677359562362
COCCn1c(N)c(C(=O)C[NH+](C)Cc2ccccc2C(F)(F)F)c(=O)[nH]c1=O,C25533231_decoy,TRY1,Decoy,0,-5.84641,-6.61,-1.52,-5.008585096718413
C[NH+](CC(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1)CC(=O)Nc1ccccc1Br,C13149689_decoy,TRY1,Decoy,0,-8.28412,-6.31,-2.5,-5.340103169756239
CC(C)(Cc1ccc(NS(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1)[NH2+]C[C@H](O)c1cccnc1,C26944941_decoy,TRY1,Decoy,0,-9.34655,-8.01,-3.4,-7.446452332772034
COc1ccc(-c2c/c(=[NH+]\CCCCC[C@H]([NH3+])C(=O)[O-])c3cc(C)ccc3o2)cc1,C28395388_decoy,TRY1,Decoy,0,-8.07803,-7.55,-1.78,-6.714277574439672
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)c1sc2[nH+]c(C)cc(C)c2c1N,C28996963_decoy,TRY1,Decoy,0,-9.46397,-6.41,-2.17,-6.75901054104569
CCCCN(C(=O)C[NH+](C)C1CCCCC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C07786420_decoy,TRY1,Decoy,0,-7.91229,-6.48,-2.25,-7.003330267377668
CSCC[C@H]([NH3+])c1nc(C(=O)NCC(=O)c2ccc(Br)cc2)co1,C33713169_decoy,TRY1,Decoy,0,-11.5275,-5.5,-3.38,-6.37874334412666
CCNc1nc2nc(SCC(=O)Nc3cc(Cl)ccc3Cl)nn2c(NCC)[nH+]1,C35682788_decoy,TRY1,Decoy,0,-8.9989,-6.48,-2.35,-5.86370336342751
CC(C)[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(C)C[C@@H]4CCCO4)cc3)c2C(N)=O)C1,C17113380_decoy,TRY1,Decoy,0,-9.32386,-6.74,-4.3,-7.078415976680605
Cc1cccc(C)c1NC(=O)C[NH+](C)[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C09684332_decoy,TRY1,Decoy,0,-6.83027,-6.45,-1.19,-5.5811893533433325
Cc1ccc(C)c(N2C[C@H](C[NH2+]CCSc3cnn[nH]3)[C@H](c3ccccc3)N2)c1,C39455296_decoy,TRY1,Decoy,0,-8.61128,-7.9,-1.33,-6.555119188505501
Cc1ccc(C)c(N2C[C@@H](C[NH2+]CCSc3cnn[nH]3)[C@H](c3ccccc3)N2)c1,C39455297_decoy,TRY1,Decoy,0,-7.59928,-6.91,-0.9,-6.343845135720514
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631224_decoy,TRY1,Decoy,0,-9.3205,-5.58,-1.97,-6.525255507673446
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39631543_decoy,TRY1,Decoy,0,-10.3736,-7.42,-1.0,-6.904659969631022
CC[C@H](C)CC(=O)N1C[C@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632021_decoy,TRY1,Decoy,0,-9.37269,-6.03,-1.54,-6.55696300034774
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39632025_decoy,TRY1,Decoy,0,-8.75433,-5.99,-2.34,-6.808863972131373
Cc1c(C(N)=O)cc(-c2cc(-c3ccccc3)no2)n1[C@@H](C)C(=O)NCC[NH+](C)C,C44145040_decoy,TRY1,Decoy,0,-8.66283,-6.31,-2.04,-6.955763198277277
OCCNc1[nH+]c2ccccc2n1C[C@H](O)COc1ccc(Br)cc1,C46342332_decoy,TRY1,Decoy,0,-8.52642,-6.67,-1.44,-7.295630106684238
COCCC[NH2+]Cc1cc(S(N)(=O)=O)cnc1Sc1ccc(F)c(F)c1,C49112323_decoy,TRY1,Decoy,0,-8.24798,-5.14,-1.8,-5.7244158287349824
Cc1c(C[NH2+]Cc2ccccc2CN2CCCC2=O)c2ccccc2n1CC(N)=O,C55054512_decoy,TRY1,Decoy,0,-8.17093,-6.79,-2.74,-6.123699513460413
CC[NH+](CC)[C@H](CNC(=O)NCC(=O)Nc1ccc(F)c(F)c1)c1ccsc1,C42346541_decoy,TRY1,Decoy,0,-8.62286,-6.84,-1.71,-6.049330819772253
CC(C)CN(C(=O)C[NH+](C)CC1CCCC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C47699717_decoy,TRY1,Decoy,0,-7.65019,-5.7,-2.73,-5.968274937697377
C=CC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1ccc(OC)cc1,C59423187_decoy,TRY1,Decoy,0,-9.52628,-7.28,-1.62,-7.310943094097788
CC[NH+](CC)Cc1cccc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)c1,C59876412_decoy,TRY1,Decoy,0,-9.42846,-6.51,-2.78,-8.050735388464313
CCCCN1C(=O)N=C([O-])[C@@H](N(Cc2ccccc2)C(=O)CCC2=c3ccccc3=[NH+]C2)[C@H]1[NH3+],C63399212_decoy,TRY1,Decoy,0,-9.10834,-7.42,-3.93,-7.012625212460959
CCCCN1C(=O)N=C([O-])[C@H](N(Cc2ccccc2)C(=O)CCC2=c3ccccc3=[NH+]C2)[C@@H]1[NH3+],C63399215_decoy,TRY1,Decoy,0,-6.54664,-7.79,-2.46,-8.195590542411185
C[NH+]1CCN(CCCNC(=O)C2CCC(CNc3[nH]c(=S)nc4ccccc34)CC2)CC1,C20646075_decoy,TRY1,Decoy,0,-8.97756,-7.48,-1.66,-6.677583716227334
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1O,C04252631_decoy,TRY1,Decoy,0,-9.85044,-10.23,-2.23,-11.570217756676486
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1O,C04252636_decoy,TRY1,Decoy,0,-9.06673,-8.15,-2.33,-7.710933884106986
Nc1nc(N)nc(NCCSSCCNc2nc(N)nc(N)n2)n1,C05371902_decoy,TRY1,Decoy,0,-7.79907,-7.42,-2.66,-10.22501674331378
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(O)c1O,C13424696_decoy,TRY1,Decoy,0,-8.90743,-7.87,-3.62,-8.456581005714222
OC[C@@H]1O[C@@H](Nc2ccccc2N[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C15135221_decoy,TRY1,Decoy,0,-5.96828,-5.63,-1.6,-4.713356155209384
OC[C@@H]1O[C@H](Nc2ccc(N[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)[C@H](O)[C@H](O)[C@@H]1O,C04417836_decoy,TRY1,Decoy,0,-5.08848,-6.9,-1.78,-4.631735917169735
Nc1cc(N)nc(SCc2nnc(CSc3nc(N)cc(N)n3)n2N)n1,C20428856_decoy,TRY1,Decoy,0,-9.40371,-7.38,-3.1,-7.27649290523145
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)cc1,C22048718_decoy,TRY1,Decoy,0,-5.8203,-7.12,-2.73,-6.124563539606656
Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)cc1,C22048733_decoy,TRY1,Decoy,0,-4.55951,-8.35,-1.69,-5.983121583782805
Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C22048757_decoy,TRY1,Decoy,0,-5.32363,-8.06,-2.58,-1.951404613291267
Nc1nc2c(nc(N/N=C/c3ccc(O)cc3O)n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C27475354_decoy,TRY1,Decoy,0,-9.21706,-9.04,-2.12,-9.637853923691427
Nc1nc2c(nc(N/N=C/c3ccc(O)cc3O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1,C27475359_decoy,TRY1,Decoy,0,-9.05074,-10.23,-1.02,-12.4479272612141
Nc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)cc1,C35636325_decoy,TRY1,Decoy,0,-6.22636,-5.27,-1.17,-4.784310894493127
Nc1nc2c(nc(N/N=C/c3ccc(O)cc3O)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1,C36047070_decoy,TRY1,Decoy,0,-8.33323,-9.45,-1.14,-8.223917167956683
Nc1nc(N)nc(NCCNc2nc(N)nc(NCCNc3nc(N)nc(N)n3)n2)n1,C38634455_decoy,TRY1,Decoy,0,-8.59651,-8.61,-2.51,-8.411176435064705
OC[C@@H]1O[C@@H](Nc2ccccc2N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C04005970_decoy,TRY1,Decoy,0,-5.50347,-6.28,-3.32,-4.650814236036585
Nc1nc(N)nc(N/N=C/c2ccc(/C=N/Nc3nc(N)nc(N)n3)cc2)n1,C15777315_decoy,TRY1,Decoy,0,-7.49457,-6.83,-1.87,-5.6859897854083625
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(O)c1O,C43465389_decoy,TRY1,Decoy,0,-9.09257,-9.53,-2.91,-8.105550040864296
O=C(/C=C/c1ccc(O)c(O)c1)c1c(O)cc(O[C@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(O)c1O,C43465391_decoy,TRY1,Decoy,0,-8.69454,-9.5,-2.1,-7.696044797178439
Nc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1,C44019181_decoy,TRY1,Decoy,0,-4.60252,-7.39,-2.32,-8.50001638249295
Nc1ccc(O[C@@H]2O[C@@H](CO)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@@H]2O)cc1,C44135705_decoy,TRY1,Decoy,0,-6.7548,-7.17,-2.81,-6.158056215892893
OC[C@@H]1O[C@H](Nc2ccc(N[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)cc2)[C@@H](O)[C@H](O)[C@@H]1O,C04417841_decoy,TRY1,Decoy,0,-4.32689,-7.75,-2.24,-4.601305098119815
OC[C@@H]1O[C@H](Nc2ccccc2N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@@H]1O,C04005967_decoy,TRY1,Decoy,0,-4.67852,-4.85,-1.24,-4.290862906306713
CC[NH2+][C@@H]1C[C@H]([NH3+])[C@@H](O[C@H]2OC(C[NH3+])=CC[C@H]2N)[C@H](O)[C@H]1O[C@@H]1OC[C@](C)(O)[C@H]([NH2+]C)[C@H]1O,C15449299_decoy,TRY1,Decoy,0,-9.55727,-6.6,-3.52,-9.382636359630387
CCC(O)(O)C1=C([N+](=O)[O-])C=C[C@](O)(C(O)(O)CC)[C@@]1(N)C(O)(O)CC,C64033671_decoy,TRY1,Decoy,0,-7.43025,-4.93,-2.41,-5.895186257276964
O=c1[nH]c(=O)n(-c2cccc(Cl)c2)c(O)c1[C@@H]1[NH2+]CCc2ccccc21,C02355840_decoy,TRY1,Decoy,0,-7.66936,-6.86,-1.89,-5.099675488784721
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)[NH+]1CCCCCCC1,C08339031_decoy,TRY1,Decoy,0,-8.16498,-6.47,-1.84,-5.455197384679114
NS(=O)(=O)c1ccc(CC[NH2+]Cc2c(F)cccc2Cl)cc1,C02181814_decoy,TRY1,Decoy,0,-7.0474,-6.02,-1.93,-5.061918938929829
[NH2+]=c1oc2cc(O)ccc2cc1C(=O)Nc1cccc(Cl)c1Cl,C04949726_decoy,TRY1,Decoy,0,-7.41334,-6.37,-1.23,-5.689295421816047
Cc1noc2c1[C@H](c1ccccc1)C(C#N)=C([NH3+])[C@H]2c1cccc(O)c1,C04639681_decoy,TRY1,Decoy,0,-7.77546,-7.24,-0.01,-5.271766550253249
Nc1cc(Cl)cc(Cl)c1NC(=O)CCC[NH+]1CCSCC1,C20560378_decoy,TRY1,Decoy,0,-9.18554,-6.04,-0.12,-5.610155110745303
C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)C(=O)NC(=O)NC1CC1,C27352671_decoy,TRY1,Decoy,0,-7.1844,-7.0,-1.51,-5.412311993976587
C[C@@H]([NH2+]Cc1cccc(Br)c1)c1ccc2[nH]c(=O)[nH]c2c1,C37163146_decoy,TRY1,Decoy,0,-7.89256,-5.81,-1.36,-5.217174041499885
C[C@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1cccc(S(N)(=O)=O)c1,C37284521_decoy,TRY1,Decoy,0,-8.80645,-6.89,-1.55,-6.342361905787929
C[C@H]([NH2+][C@H](C)c1cccc(S(N)(=O)=O)c1)c1ccc(Cl)s1,C37284522_decoy,TRY1,Decoy,0,-9.03185,-6.86,-1.58,-6.465438228577879
C[C@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1cccc(S(N)(=O)=O)c1,C37284523_decoy,TRY1,Decoy,0,-10.532,-6.21,-0.48,-6.467220142486254
[NH3+][C@@H](c1cncc(Br)c1)c1ccc2c(c1)CCCC(=O)N2,C37371317_decoy,TRY1,Decoy,0,-7.98022,-7.41,-1.63,-6.911427727739608
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1cc(F)ccc1Br,C37371415_decoy,TRY1,Decoy,0,-6.9474,-6.82,-2.08,-4.528735444087213
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1ccc(F)cc1Br,C37371435_decoy,TRY1,Decoy,0,-8.5562,-7.0,-1.23,-6.807236182128786
COc1c(Br)cc(Cl)cc1NC(=O)[C@](C)([NH3+])C1CC1,C37615079_decoy,TRY1,Decoy,0,-8.0508,-4.55,-2.25,-4.641160654059622
NS(=O)(=O)c1cccc(C[NH2+]Cc2cccc(Cl)c2Cl)c1,C37649856_decoy,TRY1,Decoy,0,-9.0306,-4.67,-2.25,-4.923473822832694
Nc1c[nH+]c2ccc(Br)cc2c1NCCc1cccnc1,C37717623_decoy,TRY1,Decoy,0,-6.83425,-5.72,-0.2,-4.018485997465771
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(C[C@@H](O)c1ccccc1)[C@@]2(C)O,C39211087_decoy,TRY1,Decoy,0,-7.31642,-5.95,-1.64,-4.549438700117061
C[NH2+][C@H](c1cc2ccccc2[nH]1)[C@@H]1N=NNN1c1ccc(Cl)cc1,C39224855_decoy,TRY1,Decoy,0,-6.07618,-6.17,0.01,-4.838712882546843
C[C@@H]1N=C(C2=C(C(F)(F)F)N=[NH+][C@@H]2c2ccc(O)c(O)c2O)CS1,C39984680_decoy,TRY1,Decoy,0,-8.83361,-6.46,-1.23,-6.316981829586823
C[C@H]1N=C(C2=C(C(F)(F)F)N=[NH+][C@@H]2c2ccc(O)c(O)c2O)CS1,C39984681_decoy,TRY1,Decoy,0,-8.01938,-4.88,-1.63,-5.065924799234142
C[C@H]1N=C(C2=C(C(F)(F)F)N=[NH+][C@H]2c2ccc(O)c(O)c2O)CS1,C39984683_decoy,TRY1,Decoy,0,-8.36473,-5.11,-0.54,-5.418739166065172
C[NH+]1CCN(c2ncnc(Nc3cc(Cl)ccc3Cl)c2N)CC1,C40726252_decoy,TRY1,Decoy,0,-8.57879,-6.52,-1.04,-5.016585854076386
CC(C)C[C@H](CO)[NH2+][C@@H]1C(=O)Nc2cc(F)c(Br)cc21,C42135337_decoy,TRY1,Decoy,0,-6.57492,-5.52,-1.04,-4.758482039174909
CC[NH+](CC(=O)Nc1c(N)cc(Cl)cc1Cl)CC(F)(F)F,C42737308_decoy,TRY1,Decoy,0,-8.04473,-5.39,-1.49,-5.354002365418159
CC[NH+](CC(=O)Nc1c(Cl)cc(N)cc1Cl)CC(F)(F)F,C42737355_decoy,TRY1,Decoy,0,-6.87667,-5.74,-1.53,-7.42868836467532
CC[C@@H]([NH3+])[C@@H](Sc1nc(C)n[nH]1)c1cccc(Br)c1,C43025309_decoy,TRY1,Decoy,0,-8.2223,-4.8,-1.76,-5.259066241764812
CC(C)(C)[NH+]1CCC(NC(=O)c2cc(N)ccc2Br)CC1,C45623747_decoy,TRY1,Decoy,0,-6.78752,-6.68,-0.79,-9.160842617319938
C[NH2+][C@@H](c1ccccc1C)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094505_decoy,TRY1,Decoy,0,-7.34668,-4.87,-1.47,-4.933623804014593
COc1cc(C[NH2+]C2(CO)CCC(C)CC2)cc(Br)c1O,C53113581_decoy,TRY1,Decoy,0,-8.1605,-4.87,-3.07,-5.058469943474826
CC[C@@H](C)NC(=O)[C@H](C)[NH+]1CCC(NC(=O)NC2CCCCC2)CC1,C55029204_decoy,TRY1,Decoy,0,-7.02752,-4.65,-2.3,-4.385492448639904
CC(=O)Nc1ccc(O)c(C(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c1,C55315744_decoy,TRY1,Decoy,0,-8.47105,-7.2,-1.0,-7.380974445981942
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)NCC(=O)NC(C)(C)C)C1,C54725669_decoy,TRY1,Decoy,0,-7.10423,-5.31,-2.36,-4.916432256625384
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)NCC(=O)NC(C)(C)C)C1,C54725671_decoy,TRY1,Decoy,0,-8.51451,-5.24,-1.86,-5.547685683032271
C[C@H](CC[NH+](C)C)NC(=O)NNC(=O)c1cc2c(s1)CCCCC2,C62506803_decoy,TRY1,Decoy,0,-8.65035,-4.72,-5.08,-5.86959377872109
C[C@H](CC[NH+](C)C)NC(=O)NNc1nc(Cl)c(Cl)cc1Cl,C62506835_decoy,TRY1,Decoy,0,-7.54676,-5.8,-4.28,-5.382701155488517
[NH3+][C@H]1CCCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Br,C63210115_decoy,TRY1,Decoy,0,-8.34884,-4.64,-2.59,-4.140492274787946
O=C(NC1CCCCCC1)[C@@H]1N[C@@H](CC2=c3ccccc3=[NH+]C2)NO1,C63295666_decoy,TRY1,Decoy,0,-8.38469,-7.27,-1.95,-6.144069570635948
COc1ccc2c(c1)OCC(N)=[NH+][C@@H]2c1cc(Cl)c(O)c(OC)c1,C63845005_decoy,TRY1,Decoy,0,-7.20017,-5.58,-4.14,-4.749977338517222
O=C(CC1=c2ccccc2=[NH+]C1)NNC(=O)Nc1cccc2ccccc12,C65356912_decoy,TRY1,Decoy,0,-7.68659,-9.09,-2.36,-6.726256577392936
CC1CC[NH+]([C@@H](C)CNC(=O)Nc2ccc(NC(=O)C(C)C)cc2)CC1,C65359045_decoy,TRY1,Decoy,0,-7.39943,-6.14,-1.66,-4.816732926908295
CC(C)Cc1cc([C@H]2[NH2+][C@H](C(C)C)NN2c2ccccc2)nc(=O)[nH]1,C65466998_decoy,TRY1,Decoy,0,-7.49564,-6.76,-2.73,-5.768521898885432
CC1CC[NH+]([C@H](C)CNC(=O)Nc2ccc(NC(=O)C(C)C)cc2)CC1,C65535572_decoy,TRY1,Decoy,0,-8.48327,-7.01,-2.05,-6.6017367848585495
COc1cc(C[NH2+]Cc2c[nH]nc2-c2cc3ccccc3o2)ccc1O,C65978538_decoy,TRY1,Decoy,0,-6.34801,-5.31,-1.56,-4.411498468715318
COc1cc(C[NH2+]Cc2c[nH]nc2-c2ccc(Cl)cc2)ccc1O,C65978662_decoy,TRY1,Decoy,0,-7.67484,-6.03,-2.49,-5.052662171001171
CC(C)(CN/C(N)=[NH+]/C[C@H]1CCCO1)c1ccc(Br)cc1,C66243235_decoy,TRY1,Decoy,0,-8.05392,-5.53,-1.73,-5.211115996750081
N/C(NCCc1ccc(F)c(Br)c1)=[NH+]\C[C@@H]1CCCO1,C66244148_decoy,TRY1,Decoy,0,-8.65839,-4.69,-1.41,-4.829518371348851
C[NH+](C)C1(CNC(=O)NNC(=O)Cc2ccccc2F)CCCCC1,C66908465_decoy,TRY1,Decoy,0,-6.78792,-6.55,-1.34,-6.616570214222248
NS(=O)(=O)c1cnc(NC[C@@H]2CCC[NH+]2CC2CCCCC2)s1,C67373407_decoy,TRY1,Decoy,0,-9.49956,-4.81,-2.15,-5.048376792767568
Cc1ccc([C@H](CNC(=O)NNC(=O)c2sccc2C)[NH+](C)C)cc1,C67411396_decoy,TRY1,Decoy,0,-7.53645,-7.16,-1.68,-5.766175753334552
COc1ccc(Cl)cc1-c1ccc2c(c1)C(=O)N1CC[C@H](NC(=O)[C@H]3CCC[NH2+]3)C[C@H]1C(=O)N2,C03840471_decoy,TRY1,Decoy,0,-7.98205,-6.35,-0.47,-4.943998987608981
COc1ccc(N2C(=O)[C@@H]3[C@H](Cc4c[nH]c5ccccc45)[NH2+][C@@]4(C(=O)Nc5ccc(C)cc54)[C@@H]3C2=O)cc1,C08791093_decoy,TRY1,Decoy,0,-8.6806,-8.13,-1.62,-7.592742596543706
C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3ccccc3)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1,C12653497_decoy,TRY1,Decoy,0,-10.1022,-7.09,-1.9,-6.866296930220521
CCc1[nH+]c(C)cc(NCC(=O)[C@@]2(O)CC[C@@H]3[C@H]4CCC5=CC(=O)CC[C@]5(C)[C@@H]4CC[C@@]32C)c1O,C12655062_decoy,TRY1,Decoy,0,-9.68726,-9.62,-2.04,-9.231746328626988
COc1cc2c(cc1OC)[C@H](c1c(O)[nH]c(=S)n(-c3ccc(Br)cc3)c1=O)[NH2+]CC2,C02137523_decoy,TRY1,Decoy,0,-8.02007,-5.47,-2.64,-5.103860550133795
COc1cc2c(cc1OC)[C@@H](c1c(O)[nH]c(=S)n(-c3ccc(Br)cc3)c1=O)[NH2+]CC2,C02137522_decoy,TRY1,Decoy,0,-8.13386,-5.98,-1.26,-5.401238899317877
COc1ccc(N2C(=O)[C@@H]3[C@H](Cc4c[nH]c5ccccc45)[NH2+][C@]4(C(=O)Nc5ccc(C)cc54)[C@@H]3C2=O)cc1,C12885560_decoy,TRY1,Decoy,0,-8.6218,-7.91,-1.42,-8.457798130443136
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C09356988_decoy,TRY1,Decoy,0,-8.78907,-9.63,-1.94,-9.14964344570539
CNC(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1cccc(NC(=O)Nc2ccc(F)c(Cl)c2)c1,C35337811_decoy,TRY1,Decoy,0,-9.46063,-7.95,-1.52,-6.884252961769867
C[NH+](C)CCNC(=O)[C@]1(OCc2ccccc2F)C[C@@H](O)[C@@H](O)[C@H](OCc2cccc(Cl)c2)C1,C37419945_decoy,TRY1,Decoy,0,-9.32194,-6.55,-1.72,-7.165451047398133
C[NH+](C)CCCNC(=O)[C@@]1(O)c2cc(Br)ccc2NC(=O)N1c1c(F)cccc1F,C03670624_decoy,TRY1,Decoy,0,-9.58065,-8.06,-0.5,-16.886430086550604
O=[P@@]1(Cc2ccccc2)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(c4ccccc4O)=C[C@@H]3C[C@@H]2CO1,C39466510_decoy,TRY1,Decoy,0,-7.71028,-6.64,-3.74,-5.920714419229043
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(O)C(S(=O)(=O)Oc4ccccc4)=C[C@H]3C[C@@H]2CO1,C39467576_decoy,TRY1,Decoy,0,-7.60508,-6.27,-2.26,-5.067370613914576
O=[P@@]1(c2ccccc2O)N[NH+]2C[C@@H]3C=C(O)C(S(=O)(=O)Oc4ccccc4)=C[C@H]3C[C@H]2CO1,C39467579_decoy,TRY1,Decoy,0,-7.48802,-9.0,-2.29,-5.7522707880556805
O=[P@@]1(S(=O)(=O)Oc2ccccc2)N[NH+]2C[C@@H]3C=C(c4ccccc4O)C(O)=C[C@@H]3C[C@@H]2CO1,C39469693_decoy,TRY1,Decoy,0,-6.44845,-6.72,-4.03,-4.961564183755751
C[C@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39631132_decoy,TRY1,Decoy,0,-9.7768,-7.25,-3.61,-6.600404765486551
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4cc(F)cc(F)c4)CC34CC[NH2+]CC4)c[nH]c12,C39684097_decoy,TRY1,Decoy,0,-9.14059,-8.84,-1.34,-7.996548715647482
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4cc(Cl)ccc4F)CC34CC[NH2+]CC4)c[nH]c12,C39684180_decoy,TRY1,Decoy,0,-10.0945,-8.43,-2.81,-8.737900798350072
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)[C@@H]4CSc5ccccc54)CC34CC[NH2+]CC4)c[nH]c12,C39684211_decoy,TRY1,Decoy,0,-9.32206,-7.37,-1.92,-6.081110512967519
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2,C40811709_decoy,TRY1,Decoy,0,-9.6954,-6.66,-0.86,-7.337046057313472
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2,C40813750_decoy,TRY1,Decoy,0,-10.3273,-7.37,-3.47,-6.160180496991229
CCc1[nH+]c(C)cc(NCC(=O)[C@]2(O)CC[C@H]3[C@H]4CCC5=CC(=O)CC[C@@]5(C)[C@@H]4CC[C@]32C)c1O,C43735934_decoy,TRY1,Decoy,0,-9.74391,-8.96,-1.4,-9.112878248121149
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C44713741_decoy,TRY1,Decoy,0,-8.4086,-8.55,-2.59,-6.713677378529709
CCc1[nH]c(C)c/c(=[NH+]\CC(=O)[C@@]2(O)CC[C@H]3[C@H]4CCC5=CC(=O)CC[C@]5(C)[C@@H]4CC[C@@]32C)c1O,C49573675_decoy,TRY1,Decoy,0,-10.2351,-9.88,-2.35,-16.00063798550375
CCc1[nH]c(C)c/c(=[NH+]\CC(=O)[C@@]2(O)CC[C@H]3[C@H]4CCC5=CC(=O)CC[C@]5(C)[C@H]4CC[C@@]32C)c1O,C35360999_decoy,TRY1,Decoy,0,-10.5218,-9.92,-3.91,-10.882633101039328
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(F)ccc(Cl)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737652_decoy,TRY1,Decoy,0,-10.7126,-6.79,-1.79,-6.500975465491678
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(F)cccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695711_decoy,TRY1,Decoy,0,-9.02831,-7.71,-1.69,-6.328156803223125
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(F)cc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695724_decoy,TRY1,Decoy,0,-8.5483,-6.93,-3.52,-6.184158493532573
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4cccnc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44737181_decoy,TRY1,Decoy,0,-8.2019,-7.04,-1.79,-5.225300912233188
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(Cl)cccc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44737043_decoy,TRY1,Decoy,0,-9.1608,-5.93,-2.01,-5.801217124612874
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4c(F)cccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695710_decoy,TRY1,Decoy,0,-8.95951,-7.68,-1.66,-7.329461322675668
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(F)cccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737059_decoy,TRY1,Decoy,0,-8.80438,-9.03,-2.13,-6.717869564788153
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4c(F)cccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737062_decoy,TRY1,Decoy,0,-9.39096,-8.0,-2.02,-6.710575850346389
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(F)cc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695725_decoy,TRY1,Decoy,0,-9.73669,-7.68,-1.61,-6.618674176325954
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(F)cc4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737121_decoy,TRY1,Decoy,0,-8.96491,-9.52,-0.77,-8.11297749280644
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(F)cc4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737124_decoy,TRY1,Decoy,0,-8.40166,-8.37,-1.0,-6.137321390155586
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(F)cc(F)c4)CC34CC[NH2+]CC4)[nH]c2c1,C39695734_decoy,TRY1,Decoy,0,-8.71849,-7.26,-1.47,-6.2212840094221535
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(F)cc(F)c4)CC34CC[NH2+]CC4)[nH]c2c1,C44737148_decoy,TRY1,Decoy,0,-8.99604,-8.32,-3.36,-7.1646389172971965
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4cc(Cl)cc(Cl)c4)CC34CC[NH2+]CC4)[nH]c2c1,C44737155_decoy,TRY1,Decoy,0,-9.37153,-6.84,-2.25,-6.444243917838838
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cccnc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C39695744_decoy,TRY1,Decoy,0,-8.92651,-7.27,-3.18,-6.290694606120619
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cccnc4Cl)CC34CC[NH2+]CC4)[nH]c2c1,C44737178_decoy,TRY1,Decoy,0,-10.1807,-8.95,-1.88,-7.329121491999761
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4c(Cl)ccc(C)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C44737287_decoy,TRY1,Decoy,0,-8.97435,-9.19,-3.05,-6.929670018470416
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4cc(Cl)ccc4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695811_decoy,TRY1,Decoy,0,-9.63514,-8.82,-3.57,-8.108261058244144
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3ccc(Cl)cc3cc2C(=O)Nc2cccc(Cl)c2)cc1,C59170547_decoy,TRY1,Decoy,0,-9.29824,-7.55,-0.86,-6.64403571878921
NC1=[NH+]c2nc3cc4c(cc3n2[C@@H](c2ccc(OCc3cn5ccccc5n3)cc2)N1)OCCCO4,C12506421_decoy,TRY1,Decoy,0,-9.37379,-8.37,-2.4,-5.8916692557447705
NC1=[NH+]c2nc3cc4c(cc3n2[C@H](c2ccc(OCc3cn5ccccc5n3)cc2)N1)OCCCO4,C12506425_decoy,TRY1,Decoy,0,-9.84257,-7.4,-2.11,-6.047170163463597
CCOc1cc([C@@H]2NC(N)=[NH+]c3nc4cc5c(cc4n32)OCCCO5)cc(Br)c1OC,C12507756_decoy,TRY1,Decoy,0,-8.99097,-5.75,-2.68,-5.202773242703224
Cc1sc(NC(=O)Cc2csc(-c3ccc(CN4CC[NH+](C)CC4)cc3)n2)c(C(N)=O)c1C,C62039471_decoy,TRY1,Decoy,0,-9.34533,-7.38,-2.33,-7.122741474042571
CCOc1c(Br)cc([C@@H]2NC(=[NH2+])Nc3nc4cc5c(cc4n32)OCCCO5)cc1OC,C12551858_decoy,TRY1,Decoy,0,-9.14512,-6.56,-3.55,-8.333360476906757
CC(=O)Nc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC3=c4ccccc4=[NH+]C3)C(=O)Nc3ccccc32)cc1,C64199021_decoy,TRY1,Decoy,0,-10.3118,-8.74,-0.95,-8.157814550819982
OC[C@@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@H](O)[C@@H]1O,C04534329_decoy,TRY1,Decoy,0,-7.35719,-5.72,-1.7,-4.865238602739167
OC[C@@H]1O[C@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@@H](O)[C@H](O)[C@@H]1O,C04534330_decoy,TRY1,Decoy,0,-7.40349,-7.69,-1.06,-5.532390989661983
COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@@]12C(=O)N(CC(N)=O)c1ccccc12,C04316713_decoy,TRY1,Decoy,0,-5.54361,-5.28,-2.32,-4.753682952737734
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12,C05759932_decoy,TRY1,Decoy,0,-8.09851,-6.36,-1.42,-5.694518531123727
COc1nc(N[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c(Br)c(=O)n1C,C05760558_decoy,TRY1,Decoy,0,-7.5973,-5.59,-1.34,-4.895458253699044
COc1cccc([C@@H]2c3cc4c(cc3O[C@H](NNC(N)=O)[C@H]2C)OCO4)c1O,C05956859_decoy,TRY1,Decoy,0,-9.06844,-7.8,-1.75,-5.76752417158443
Cc1ccc(-c2nnc(SCC(=O)Nc3sccc3C(N)=O)n2N)cc1,C06627883_decoy,TRY1,Decoy,0,-7.82775,-5.66,-1.08,-5.2289498005937975
COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)SCc1nc(N)nc(N)n1,C08704363_decoy,TRY1,Decoy,0,-8.99578,-6.48,-1.04,-6.650671625317695
CC(C)[C@H](Sc1nnc(COc2ccccc2F)n1N)C(=O)NC(N)=O,C08771044_decoy,TRY1,Decoy,0,-7.87924,-6.03,-2.66,-6.26766503498374
O=C(CCSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@@H]1O,C09956542_decoy,TRY1,Decoy,0,-5.42444,-7.19,-2.95,-5.93137775320679
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H](C)[C@@H](O)C[C@H]12,C13407270_decoy,TRY1,Decoy,0,-8.09436,-5.74,-1.28,-5.164777281983399
OC[C@@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@@H](O)[C@@H](O)[C@@H]1O,C15260398_decoy,TRY1,Decoy,0,-7.47979,-7.6,-1.87,-6.3376138866391
Cc1cc(C)cc(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1,C16218274_decoy,TRY1,Decoy,0,-8.08846,-6.28,-1.51,-5.894449972706963
NS(=O)(=O)c1ccc(NNC(=S)N[C@@H]2C[C@H]3CC[C@@H]2C3)c([N+](=O)[O-])c1,C16218319_decoy,TRY1,Decoy,0,-8.84813,-6.39,-2.96,-6.199756134397603
COc1cccc(C(c2c(O)cc(C)[nH]c2=O)c2c(O)cc(C)[nH]c2=O)c1O,C16266834_decoy,TRY1,Decoy,0,-7.35851,-5.33,-1.56,-5.0894329323958
Nc1nc(CSc2nnc(-c3ccco3)n2N)nc(Nc2ccc(F)cc2)n1,C16633028_decoy,TRY1,Decoy,0,-8.85614,-5.95,-2.06,-6.693314992742556
Cc1ccc(C)c(NC(=S)NNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1,C20834971_decoy,TRY1,Decoy,0,-7.23595,-5.57,-2.96,-5.239529625594823
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@@H](O)[C@H](O)[C@@H]1O,C22050241_decoy,TRY1,Decoy,0,-6.91108,-8.03,-2.21,-6.441057966351094
Cc1ccc(C)c(NC(=O)[C@@H]2CC(=O)Nc3nc(N4CCC(C(N)=O)CC4)[nH]c(=O)c32)c1,C22610501_decoy,TRY1,Decoy,0,-8.64273,-7.09,-0.62,-5.9309423703114375
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H](NC(N)=O)C(C)C,C27202355_decoy,TRY1,Decoy,0,-8.23465,-6.67,-3.32,-6.071733488287435
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@H](NC(N)=O)C(C)C,C27202368_decoy,TRY1,Decoy,0,-8.00782,-6.77,-2.39,-6.057677903919939
C[C@@H](Nc1ccc(NC(=O)NCc2ccco2)cc1)C(=O)NC(=O)NC1CC1,C29720232_decoy,TRY1,Decoy,0,-6.59769,-6.37,-2.47,-4.974687171941035
CC(=O)N[C@@H](CC(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1)c1ccc(C)cc1,C30984132_decoy,TRY1,Decoy,0,-8.37054,-8.66,-3.29,-9.340371398358116
CC(C)[C@H](OC(=O)c1nc(Cl)c(Cl)c(N)c1Cl)C(=O)NC(N)=O,C35380617_decoy,TRY1,Decoy,0,-9.88396,-5.7,-1.58,-6.48033495182621
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H](C)[C@@H](O)C[C@H]12,C13407266_decoy,TRY1,Decoy,0,-7.20285,-5.38,-1.74,-4.954202817972844
CC(=O)C=C=C1C(C)(C)C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@@]1(C)O,C35465752_decoy,TRY1,Decoy,0,-8.81358,-5.2,-2.16,-4.998595676897225
CC1=C[C@@H]([C@@H]2NN[C@@H](SCC(=O)Nc3cccc(Cl)c3C)N2N)N=N1,C39016332_decoy,TRY1,Decoy,0,-8.8667,-8.06,-2.71,-7.635578707340512
O=C(CCNC(=O)c1cccs1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558823_decoy,TRY1,Decoy,0,-8.81258,-7.57,-2.65,-7.2460607056248785
O=C(CCCNC(=O)c1ccco1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558824_decoy,TRY1,Decoy,0,-7.52379,-6.87,-3.74,-5.923360575314408
CC(=O)C=C=C1C(C)(C)C[C@@H](O)C[C@]1(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,C31155119_decoy,TRY1,Decoy,0,-6.88812,-6.09,-2.29,-5.291530148993466
Cc1ccc(S(=O)(=O)NNc2ncnc(Nc3ccc(C)cn3)c2N)cc1,C40794705_decoy,TRY1,Decoy,0,-7.92969,-7.54,-2.7,-6.078769555929201
Cc1ccc(C(=O)NNC(=O)c2oc3c(c2C)/C(=N/NC(N)=S)CCC3)cc1,C40824589_decoy,TRY1,Decoy,0,-8.41725,-7.47,-2.5,-7.444931988758234
CC(C)NC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1,C42642715_decoy,TRY1,Decoy,0,-7.85336,-7.87,-2.98,-6.087278064757689
CC(C)NC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C42642717_decoy,TRY1,Decoy,0,-8.02985,-7.8,-2.06,-7.267824911986455
COC(=O)C1=CO[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H](C)[C@@H](O)C[C@@H]12,C43763877_decoy,TRY1,Decoy,0,-8.73136,-7.05,-1.87,-6.037495840861952
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H](O)[C@H]1O,C44167631_decoy,TRY1,Decoy,0,-6.39171,-7.42,-2.59,-6.264227346439919
OC[C@@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H](O)[C@@H]1O,C44962912_decoy,TRY1,Decoy,0,-6.86941,-5.88,-1.22,-4.879014351967084
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](NC(N)=O)C(C)C,C46866524_decoy,TRY1,Decoy,0,-9.03747,-5.94,-2.14,-5.93174886421644
CCCCNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1,C56159591_decoy,TRY1,Decoy,0,-8.37889,-6.56,-3.72,-7.282582408344941
CC1=C(C(=O)N/N=C/c2ccc3c(c2)OCO3)[C@@H](c2ccc(O)cc2O)NC(=O)N1,C59385787_decoy,TRY1,Decoy,0,-8.34126,-7.7,-3.63,-6.14177504740223
CCC[C@H](NC(N)=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C,C60091456_decoy,TRY1,Decoy,0,-7.28739,-6.32,-2.5,-5.444808680234356
CC(C)CN1N[C@H](C)c2cc(C(=O)NCCCc3[nH]nc(N)c3C#N)sc21,C39936540_decoy,TRY1,Decoy,0,-8.88995,-7.63,-0.5,-7.738030789437935
CCC[C@@H](NC(N)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C,C63662774_decoy,TRY1,Decoy,0,-8.52963,-6.85,-2.54,-7.481116258049208
CC1=C(CCC(=O)N[C@@H]2S[C@@H](Nc3ccccc3)N[C@H]2C(N)=O)[C@H](C)N=N1,C63686307_decoy,TRY1,Decoy,0,-8.093,-6.05,-1.36,-5.776740263347091
CC1=C([C@H](C)C(=O)N[C@H]2S[C@@H](Nc3ccccc3)N[C@H]2C(N)=O)[C@@H](C)N=N1,C63686314_decoy,TRY1,Decoy,0,-7.44922,-6.36,-1.94,-5.654191209504141
Cc1nc2c(C(N)=O)ncn2c(C)c1CCC(=O)NNC(=O)NC1CCCC1,C65920140_decoy,TRY1,Decoy,0,-7.62012,-7.54,-1.8,-5.453949294415785
O=C(Nc1cc[nH]n1)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1,C66052160_decoy,TRY1,Decoy,0,-6.5615,-8.43,-1.04,-5.564579704260518
NC(=O)c1ncn2c(C(=O)NC3CCC(C(N)=O)CC3)cc(-c3ccco3)nc12,C66634922_decoy,TRY1,Decoy,0,-7.67538,-8.02,-1.12,-8.183711132498164
Cc1ccsc1C(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C67102459_decoy,TRY1,Decoy,0,-10.161,-8.01,-3.58,-6.434054883646292
CC(C)NC(=O)Nc1ccc(NC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1,C67246611_decoy,TRY1,Decoy,0,-8.01919,-6.75,-1.23,-6.753589063307125
CC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(C[C@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06074903_decoy,TRY1,Decoy,0,-8.19639,-6.24,-2.48,-8.958293210152032
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06546854_decoy,TRY1,Decoy,0,-9.00761,-5.73,-1.71,-8.938724866992326
COC(=O)C1=C(C)Nc2sc(C(N)=O)c(N)c2[C@H]1c1cc(OC)c(OC)c(OC)c1,C09302616_decoy,TRY1,Decoy,0,-8.46704,-6.39,-2.04,-8.670913299215142
Cc1occc1-c1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1N,C11385824_decoy,TRY1,Decoy,0,-11.2346,-7.71,-1.4,-6.855289251231488
C[C@H](C(=O)NC[C@H]1CCCO1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C12715231_decoy,TRY1,Decoy,0,-7.59103,-7.55,-0.27,-9.890795285911032
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)nc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05733458_decoy,TRY1,Decoy,0,-8.31678,-6.24,-1.68,-5.813678678217026
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)nc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C05733461_decoy,TRY1,Decoy,0,-7.21723,-5.93,-2.1,-5.123678557608933
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O,C14727307_decoy,TRY1,Decoy,0,-9.86227,-8.93,-2.35,-8.769585031255323
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,C14855702_decoy,TRY1,Decoy,0,-8.05134,-9.17,-3.27,-6.845982416582351
O=C(CNC(=O)c1ccc(Cl)cc1Cl)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C15625550_decoy,TRY1,Decoy,0,-9.49717,-8.27,-3.86,-6.825238191133745
O=C(N/N=C(\c1nc2cc(Cl)ccc2[nH]c1=O)[C@H](O)[C@H](O)CO)c1ccc(O)cc1,C15775253_decoy,TRY1,Decoy,0,-8.47487,-8.25,-3.42,-7.826213930714307
O=C(N/N=C(\c1nc2cc(Cl)ccc2[nH]c1=O)[C@H](O)[C@@H](O)CO)c1ccc(O)cc1,C15775255_decoy,TRY1,Decoy,0,-9.02554,-8.18,-1.58,-8.74170857201662
O=C(N/N=C(\c1nc2cc(Cl)ccc2[nH]c1=O)[C@@H](O)[C@H](O)CO)c1ccc(O)cc1,C15775257_decoy,TRY1,Decoy,0,-9.40286,-8.76,-1.64,-8.996559137374675
COc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)c1,C16215388_decoy,TRY1,Decoy,0,-7.66858,-8.43,-1.23,-7.653438063459117
O=C1NC(=O)C2=Nc3ccc(N4CCCCC4)cc3N(C[C@H](O)[C@H](O)[C@@H](O)CO)[C@@H]2N1,C16431246_decoy,TRY1,Decoy,0,-8.89617,-7.28,-2.87,-5.923535086544245
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c2n1,C16990696_decoy,TRY1,Decoy,0,-6.95757,-6.19,-2.4,-6.746935737648969
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c2n1,C13154311_decoy,TRY1,Decoy,0,-7.24514,-6.91,-2.64,-5.207589387468775
O=C1C=CC(O)(/C=C/C(=O)OC[C@H]2O[C@@H](Oc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)C=C1,C31165470_decoy,TRY1,Decoy,0,-8.38445,-8.91,-1.1,-10.787402748617064
CC(C)CC[C@@]1(O)C(=O)C(C)(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]1O,C31167830_decoy,TRY1,Decoy,0,-8.15528,-6.03,-4.32,-5.713080830951217
CC(C)CC[C@@]1(O)C(=O)C(C)(C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@H]1O,C31167838_decoy,TRY1,Decoy,0,-9.19455,-6.67,-5.0,-5.516056321304476
C[C@@H]1CC[C@@H]2C(C)(C)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]2(C)[C@@]1(O)CCC1=CCOC1=O,C31169001_decoy,TRY1,Decoy,0,-6.93747,-6.69,-2.62,-5.505208711715445
CCCc1cc(=O)oc2c(C)c(OCC(=O)N(C)C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)ccc12,C12892505_decoy,TRY1,Decoy,0,-9.02298,-7.63,-3.34,-6.453652932241091
CN(C)c1ccc(/C=N\Nc2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1,C33764918_decoy,TRY1,Decoy,0,-6.78773,-8.86,-1.27,-9.7997175897751
O=C(/C=C/c1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O,C34107347_decoy,TRY1,Decoy,0,-8.46407,-8.53,-1.89,-8.268516840077485
C=C[C@@H]1[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@@H]1Cc1[nH+]ccc2c1[nH]c1ccccc12,C35454583_decoy,TRY1,Decoy,0,-6.97269,-6.8,-2.46,-5.559897047678544
CC1=C(C(=O)O[C@H]2O[C@@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@H]2O)C(C)(C)CCC1,C35465943_decoy,TRY1,Decoy,0,-7.1434,-6.14,-3.59,-5.731521409099848
CC(C)(C)N(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC1CCCCC1)c1c(O)cc(O)cc1O,C36591386_decoy,TRY1,Decoy,0,-4.98311,-7.27,-1.98,-5.24713927814697
Cc1ccc(CN(C(=O)CO)[C@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36600362_decoy,TRY1,Decoy,0,-8.27935,-6.32,-0.45,-7.036253491205882
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1,C04467863_decoy,TRY1,Decoy,0,-6.80396,-6.23,-1.75,-5.122828285333714
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1,C04720755_decoy,TRY1,Decoy,0,-6.79284,-6.98,-2.21,-5.540460475255343
Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1,C04261942_decoy,TRY1,Decoy,0,-6.73376,-7.89,-2.29,-6.84586354366364
COc1ccc(C2=C[C@H]([C@@H]3NN[C@H](SCC(=O)Nc4nccs4)N3N)N=N2)cc1,C39016472_decoy,TRY1,Decoy,0,-9.38692,-7.21,-1.95,-7.915254184991782
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4nccs4)N3N)N=N2)cc1,C39016473_decoy,TRY1,Decoy,0,-9.68906,-8.63,-2.19,-7.951465838393859
CC[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCCC2)n1c(N)nnc1SCC(=O)OC,C40174054_decoy,TRY1,Decoy,0,-8.06589,-6.12,-4.41,-7.378238706686318
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O,C43465392_decoy,TRY1,Decoy,0,-6.02221,-7.2,-2.34,-6.564144891778657
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O,C43465395_decoy,TRY1,Decoy,0,-7.73804,-8.1,-2.39,-8.413243967494116
CC(=O)OC[C@@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@H]1O,C43465460_decoy,TRY1,Decoy,0,-9.52739,-8.39,-1.96,-8.521389404584017
N#C[C@@H]1CCCN1C(=O)C[NH2+]C12C[C@H]3C[C@@H](C1)CC(O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)(C3)C2,C44136655_decoy,TRY1,Decoy,0,-7.36373,-7.53,-3.22,-5.72630480800151
COc1cc([C@H]2C(C#N)=C(N)Oc3n[nH]c(-c4ccc(F)cc4)c32)ccc1OCC(N)=O,C00809448_decoy,TRY1,Decoy,0,-7.33788,-5.47,-0.54,-5.891428165424979
COc1cc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(-c4ccc(F)cc4)c32)ccc1OCC(N)=O,C00809447_decoy,TRY1,Decoy,0,-6.57975,-5.37,-2.9,-5.403866363053186
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2O)n1,C59879486_decoy,TRY1,Decoy,0,-9.61701,-5.19,-2.5,-5.589562578027783
Cc1c(C(N)=O)sc2[nH]c(S[C@@H](C)C(=O)Nc3cc(C=O)ccc3O)nc(=O)c12,C62038763_decoy,TRY1,Decoy,0,-8.94635,-7.11,-1.06,-6.762072885009878
Cc1c(C(N)=O)sc2[nH]c(S[C@H](C)C(=O)Nc3cc(C=O)ccc3O)nc(=O)c12,C62038764_decoy,TRY1,Decoy,0,-8.84462,-7.8,-0.76,-6.38671505794903
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccccc2)S1,C39938762_decoy,TRY1,Decoy,0,-9.18903,-8.71,-1.36,-7.4897665137404035
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccccc2)S1,C39938763_decoy,TRY1,Decoy,0,-8.58451,-7.0,-0.7,-6.358845175448802
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccccc2)S1,C39938764_decoy,TRY1,Decoy,0,-9.82742,-6.53,-1.34,-6.231428960802996
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccccc2)S1,C39938765_decoy,TRY1,Decoy,0,-8.65752,-5.69,-2.3,-5.8296035236285615
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccc(OC(F)(F)F)cc2)S1,C38639748_decoy,TRY1,Decoy,0,-10.0642,-8.57,-2.85,-8.788417973407315
[NH3+]C[C@H](COc1cccc2[nH]c3ccccc3c12)O[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O,C65734306_decoy,TRY1,Decoy,0,-6.10929,-7.15,-1.85,-7.855331752058434
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccccc2)nnn1-c1nonc1N,C02454403_decoy,TRY1,Decoy,0,-8.35855,-7.68,-2.92,-7.399500632837436
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1OC,C06546874_decoy,TRY1,Decoy,0,-7.31448,-6.72,-3.41,-7.260555754315962
CCOC(=O)CNC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(F)cc1,C06547183_decoy,TRY1,Decoy,0,-8.1928,-7.43,-1.66,-11.785967183658844
NC(=O)c1ccccc1NCc1c(C(=O)N/N=C/c2ccccc2F)nnn1-c1nonc1N,C09307668_decoy,TRY1,Decoy,0,-7.83357,-8.28,-1.88,-9.282601443820052
CCCCO[C@H]1[C@@H]2OC(C)(C)O[C@@H]2O[C@@H]1[C@H](O)CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1NC(C)=O,C10001629_decoy,TRY1,Decoy,0,-6.39461,-5.38,-3.73,-5.312955104121046
CCOc1cc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O,C10004225_decoy,TRY1,Decoy,0,-8.22984,-8.26,-1.1,-8.265107760364613
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1OC,C10004245_decoy,TRY1,Decoy,0,-7.52327,-8.36,-2.89,-9.012963677859272
Cc1cc(O)c(C(c2ccc(O)cc2)c2c(O)cc(C)n(CCO)c2=O)c(=O)n1CCO,C10217775_decoy,TRY1,Decoy,0,-8.65639,-6.06,-1.93,-6.024269254637971
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1OC,C12661546_decoy,TRY1,Decoy,0,-8.63895,-8.07,-1.36,-9.032777101380798
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1OC,C08964846_decoy,TRY1,Decoy,0,-8.16527,-7.94,-3.26,-8.071640803030615
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1OC,C08964847_decoy,TRY1,Decoy,0,-8.67149,-8.48,-1.78,-8.560549923964912
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1OC,C08964848_decoy,TRY1,Decoy,0,-7.93946,-8.2,-1.31,-8.403553345697679
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1OC,C08964849_decoy,TRY1,Decoy,0,-7.54931,-8.0,-1.78,-7.991704640967731
O=C(OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1,C13537964_decoy,TRY1,Decoy,0,-4.16632,-6.62,-2.13,-4.224161549805433
O=C(OC[C@H]1O[C@@H](OC(=O)c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O)c1ccc(O)c(O)c1,C13545555_decoy,TRY1,Decoy,0,-8.29876,-8.91,-3.04,-7.64083593495158
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1[C@@H](O)C[C@@]2(C)OC(C)=O,C14697367_decoy,TRY1,Decoy,0,-7.27492,-5.77,-3.43,-5.706416729576382
COC(=O)C1=CO[C@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1[C@@H](O)C[C@@]2(C)OC(C)=O,C14697369_decoy,TRY1,Decoy,0,-6.92745,-5.77,-3.13,-5.262465192837931
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1[C@@H](O)C[C@@]2(C)OC(C)=O,C14697371_decoy,TRY1,Decoy,0,-8.41705,-5.31,-1.16,-5.662019370850591
COC(=O)C1=CO[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H]1[C@@H](O)C[C@@]2(C)OC(C)=O,C14697373_decoy,TRY1,Decoy,0,-6.48159,-5.89,-2.01,-5.127685967316967
CCOc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)c1,C18996668_decoy,TRY1,Decoy,0,-8.73076,-8.23,-1.39,-7.6751883574407485
CCOc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1O,C19203745_decoy,TRY1,Decoy,0,-7.76529,-8.11,-1.54,-10.355287501332963
NC(=O)CSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc(Cl)ccc3O)n2)s1,C20834810_decoy,TRY1,Decoy,0,-11.6041,-7.89,-3.73,-8.092387844161243
C[C@H](OC(=O)c1csc(S(N)(=O)=O)c1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C21839520_decoy,TRY1,Decoy,0,-10.8903,-5.97,-2.71,-6.74133965226201
O=C(OCC1=C[C@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12)c1ccccc1,C31156322_decoy,TRY1,Decoy,0,-7.41508,-6.76,-1.26,-5.473265530496816
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3ccc(C#N)cc3)[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C1=O,C33519206_decoy,TRY1,Decoy,0,-7.08091,-8.53,-2.27,-7.549918946709553
CC(C)(C)N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1ccc(C#N)cc1,C33519209_decoy,TRY1,Decoy,0,-7.82831,-5.98,-2.5,-6.113000251221802
CCOc1ccc(/C=N/Nc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1O,C35188413_decoy,TRY1,Decoy,0,-7.96531,-7.78,-3.8,-7.0397568970742
CC1=C(C(=O)O[C@@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)C(C)(C)CCC1,C35465940_decoy,TRY1,Decoy,0,-7.09626,-7.84,-1.97,-5.734768663318615
CCCc1cc(=O)oc2c(C)c(OCC(=O)N(C)C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)ccc12,C36369702_decoy,TRY1,Decoy,0,-7.82386,-7.12,-2.67,-5.667278682070326
O=C1CC[C@@H](C(=O)N(Cc2ccco2)[C@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)N1,C36504531_decoy,TRY1,Decoy,0,-8.28694,-5.14,-2.26,-5.480589232343451
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1[C@H](O)C[C@]2(C)OC(C)=O,C35456543_decoy,TRY1,Decoy,0,-6.45791,-5.09,-3.93,-4.544269227692265
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1[C@H](O)C[C@@]2(C)OC(C)=O,C35456539_decoy,TRY1,Decoy,0,-7.09856,-5.38,-2.15,-5.334242467361532
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1[C@@H](O)C[C@]2(C)OC(C)=O,C35456535_decoy,TRY1,Decoy,0,-7.39048,-5.84,-3.3,-5.800345342202652
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1[C@@H](O)C[C@@]2(C)OC(C)=O,C35456531_decoy,TRY1,Decoy,0,-6.83158,-5.27,-1.81,-5.3070456875293885
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@H](OC(C)=O)C[C@]2(C)O,C31159570_decoy,TRY1,Decoy,0,-7.0365,-5.17,-3.53,-5.4282700808531175
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)cc1OC,C01823560_decoy,TRY1,Decoy,0,-7.55111,-7.98,-2.13,-7.624533324823427
Nc1nc(NCCCCCC[NH3+])nc2c1ncn2[C@@H]1O[C@@H]2CO[P@](=O)([O-])O[C@H]2[C@H]1O,C38580945_decoy,TRY1,Decoy,0,-7.35242,-5.99,-2.06,-5.977793643781518
COc1ccc(C2=C[C@@H]([C@H]3NN[C@@H](SCC(=O)Nc4cccc(C)n4)N3N)N=N2)cc1,C38985505_decoy,TRY1,Decoy,0,-8.63843,-6.98,-1.08,-6.641410134263241
COc1ccc(C2=C[C@@H]([C@H]3NN[C@H](SCC(=O)Nc4cccc(C)n4)N3N)N=N2)cc1,C38985507_decoy,TRY1,Decoy,0,-10.3195,-7.2,-1.81,-7.460474317603806
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@@H](SCC(=O)Nc4cccc(C)n4)N3N)N=N2)cc1,C38985510_decoy,TRY1,Decoy,0,-9.67238,-9.02,-1.69,-7.705804555565414
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4cccc(C)n4)N3N)N=N2)cc1,C38985512_decoy,TRY1,Decoy,0,-9.74494,-6.53,-1.37,-7.435366549568194
Cc1ccc(-c2csc(NC(=O)[C@@H](C)n3c(N)nnc3SCC#N)c2C(N)=O)cc1,C40173487_decoy,TRY1,Decoy,0,-7.65944,-5.93,-2.13,-6.764493227748309
Cc1ccc(-c2csc(NC(=O)[C@H](C)n3c(N)nnc3SCC#N)c2C(N)=O)cc1,C40173488_decoy,TRY1,Decoy,0,-7.31399,-4.83,-2.37,-5.415445769396247
NC(=O)c1c(Nc2nc(N3CCN(CCO)CC3)nc(N)c2[N+](=O)[O-])sc2c1CCC2,C41301803_decoy,TRY1,Decoy,0,-8.94473,-7.09,-3.75,-7.004467270152359
Nc1nc(NCCCCCC[NH3+])nc2c1ncn2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1O,C42854042_decoy,TRY1,Decoy,0,-7.41744,-5.99,-1.83,-5.532540133470156
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]1[C@H](OC(C)=O)C[C@]2(C)O,C43510511_decoy,TRY1,Decoy,0,-6.7917,-5.64,-1.57,-5.472781480560758
COc1ccc(/C=N/Nc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1OC,C09635865_decoy,TRY1,Decoy,0,-8.27748,-8.44,-2.86,-7.810661547014223
CC(=O)NNC(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59879554_decoy,TRY1,Decoy,0,-9.17139,-7.6,-2.48,-7.273373191176699
CC(/C=C/C(=O)NO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C\[C@@H](C)C(=O)c1ccc(N(C)C)cc1,C33953968_decoy,TRY1,Decoy,0,-8.06041,-8.98,-3.03,-6.735802602594071
CCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C05345891_decoy,TRY1,Decoy,0,-9.24702,-5.98,-1.62,-5.880126408101381
COCCOC(=O)c1c(NC(=O)C[NH2+]C[C@@H]2CCCO2)sc(C(N)=O)c1C,C05825056_decoy,TRY1,Decoy,0,-8.53445,-4.95,-0.37,-6.467859528827442
COCCOC(=O)c1c(NC(=O)C[NH2+]C[C@H]2CCCO2)sc(C(N)=O)c1C,C05825059_decoy,TRY1,Decoy,0,-10.6394,-6.07,-3.8,-8.144682686658218
O=[N+]([O-])c1ccc([C@H](O)[C@H](CO)[NH2+]C[C@H](O)COCc2ccc3c(c2)OCO3)cc1,C07238872_decoy,TRY1,Decoy,0,-7.08584,-7.12,-2.43,-6.2468465825145865
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Br)c1OC,C08469815_decoy,TRY1,Decoy,0,-7.49005,-6.35,-2.72,-6.347394313644023
COCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2c(C)cccc21,C12902407_decoy,TRY1,Decoy,0,-7.44212,-8.04,-0.51,-10.21171278572269
Cc1ccc(OC[C@H](O)Cn2c(NCCC[NH3+])nc3c2c(=O)[nH]c(=O)n3C)cc1,C05460894_decoy,TRY1,Decoy,0,-7.30612,-6.76,-2.74,-7.510103716173396
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C13298315_decoy,TRY1,Decoy,0,-7.1649,-4.92,-1.93,-4.618404189030581
O=C(Nc1ccsc1)N[C@H]1C[C@H]2C(=O)NC[C@@H](CCC(=O)N3CCC(O)CC3)[NH+]2C1,C15708731_decoy,TRY1,Decoy,0,-9.82475,-5.61,-2.16,-6.589700577701671
COc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCC(N)=O,C16195365_decoy,TRY1,Decoy,0,-7.76315,-6.8,-2.74,-6.618499627300436
C[C@]12CN3C[C@](c4ccccc4)(C[NH+](C1)[C@H]3[C@](C)(O)[C@](C)(O)[C@@](C)(O)CO)C2=O,C19339000_decoy,TRY1,Decoy,0,-8.16002,-4.71,-1.66,-5.07010041486131
CCn1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cn1,C20838034_decoy,TRY1,Decoy,0,-7.84754,-7.68,-2.58,-6.770988752464554
CCSc1ccc2n(c1)cc(-c1ccc(/C=N/Nc3nc(N)nc(N)n3)cc1)[n+]2C,C26831881_decoy,TRY1,Decoy,0,-7.5347,-7.34,-1.62,-4.859643006947358
CCC[n+]1c(N)c(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc2c(=O)n3ccccc3nc21,C26842467_decoy,TRY1,Decoy,0,-9.08678,-6.94,-3.14,-6.753251695030932
Nc1nc(N)nc(C[NH+]2CCN(Cc3ccc(-c4ccccc4F)s3)CC2)n1,C27905106_decoy,TRY1,Decoy,0,-8.82528,-5.42,-1.33,-4.774199274876092
Cc1sc2nc(C[NH+]3CCCC3)nc(SCc3nc(N)nc(N)n3)c2c1C,C28259746_decoy,TRY1,Decoy,0,-8.21863,-7.59,-0.79,-7.213399821294729
COc1cc([C@@H]2[NH+]=C(N)N=C(N)N2c2ccc(S(N)(=O)=O)cc2)cc(OC)c1OC,C12410619_decoy,TRY1,Decoy,0,-8.86841,-5.78,-1.51,-6.2114185670902815
CCn1c(-c2nonc2N)nc2c(C#CC(C)(C)O)ncc(OC[C@H]3CCC[NH2+]C3)c21,C34285211_decoy,TRY1,Decoy,0,-8.23418,-7.37,-1.82,-7.362094707456923
CC1(C)Cc2c(sc3nc(N4CC[NH+](CC(N)=O)CC4)n(CC(N)=O)c(=O)c23)CO1,C34734967_decoy,TRY1,Decoy,0,-8.22741,-7.09,-0.7,-5.498897973878708
NC(=O)Cn1c(N2CC[NH+](CC(N)=O)CC2)nc2sc3c(c2c1=O)CCCC3,C34747413_decoy,TRY1,Decoy,0,-8.25952,-5.8,-2.14,-6.25629008915928
COC(=O)[C@H](CC1=C2CC=CC=C2N=C1)NC(=O)[C@@H]1CN(C(=O)[C@H](C)[NH3+])CCN1,C39564108_decoy,TRY1,Decoy,0,-9.3911,-5.94,-3.23,-6.07365822107961
Cc1cc(-c2onc(C)c2C(=O)N2C[C@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)no1,C39661848_decoy,TRY1,Decoy,0,-9.36549,-7.51,-2.64,-6.475973307316759
Cn1cncc1C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661910_decoy,TRY1,Decoy,0,-8.50301,-5.91,-1.62,-6.595803443068126
Cn1cncc1C(=O)N1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661911_decoy,TRY1,Decoy,0,-8.79414,-9.02,-1.73,-8.312771371533163
Nc1nonc1[C@H]1Nc2ccccc2N1CC(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39940649_decoy,TRY1,Decoy,0,-7.85969,-8.46,-0.82,-6.969227808367492
Nc1nonc1[C@@H]1Nc2ccccc2N1CC(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39940650_decoy,TRY1,Decoy,0,-8.68308,-8.71,-1.69,-7.369385008951352
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C39953552_decoy,TRY1,Decoy,0,-8.54961,-4.59,-3.11,-5.364209449938964
CC1(C)CC(Nc2ncnc(NNC(=O)c3ccco3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40645234_decoy,TRY1,Decoy,0,-6.54768,-5.41,-3.25,-4.775501519920434
Nc1c(NNC(=O)c2ccc(Br)cc2)ncnc1Nc1cc[nH+]cc1,C40687624_decoy,TRY1,Decoy,0,-7.22728,-7.4,-1.21,-6.193062597060474
[NH3+]CCCC[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(F)cc2)[C@@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C43209337_decoy,TRY1,Decoy,0,-9.85453,-7.22,-1.35,-8.762316128614039
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44136619_decoy,TRY1,Decoy,0,-6.02078,-4.57,-2.95,-4.486267086344655
COc1cccc([C@H]([NH3+])CC(N)=O)c1OC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C,C44253896_decoy,TRY1,Decoy,0,-6.67909,-6.69,-2.03,-5.361759362167583
Cc1cccc(NC(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sccc3C(N)=O)CC2)c1C,C45511192_decoy,TRY1,Decoy,0,-9.18034,-7.36,-1.73,-6.708475435466029
CN(C)CCNC(=O)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2[NH+]=C(Nc3ccc(-n4cccn4)cc3)S[C@@H]21,C20504123_decoy,TRY1,Decoy,0,-10.1775,-5.54,-1.72,-6.695861258386874
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCCN(CC(=O)NC(C)(C)C)CC1,C22775916_decoy,TRY1,Decoy,0,-7.51468,-6.47,-1.07,-5.861047686332939
CC(=O)NCCNC(=O)c1cc(NCc2c[nH+]c(C)[nH]2)cc(S(=O)(=O)N(C)C)c1,C14745464_decoy,TRY1,Decoy,0,-7.22363,-7.05,-3.16,-7.965359709205613
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H](NCc3ccc4c(c3)OCO4)[C@@H]2O)CC1,C12529669_decoy,TRY1,Decoy,0,-7.13704,-7.83,-0.63,-5.473675955081728
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C,C39781303_decoy,TRY1,Decoy,0,-8.0672,-8.49,-1.46,-7.654812073489031
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C,C39781304_decoy,TRY1,Decoy,0,-7.36839,-7.83,-3.71,-6.652854977323134
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C,C39781305_decoy,TRY1,Decoy,0,-6.44608,-8.68,-1.98,-6.256499607276048
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C,C39781306_decoy,TRY1,Decoy,0,-9.21704,-6.31,-1.04,-7.568208091098131
C[C@H](NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccc(S(N)(=O)=O)cc1,C39933394_decoy,TRY1,Decoy,0,-9.60119,-7.82,-3.82,-7.654939502595367
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C1CC1,C39935429_decoy,TRY1,Decoy,0,-9.03737,-8.23,-2.5,-11.303400156823576
C[C@@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(c2cc[nH+]cc2)N1C1CC1,C39935430_decoy,TRY1,Decoy,0,-9.05211,-8.0,-2.5,-11.571676425616296
CC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(CCC#N)CCC#N)cc3)c2C(N)=O)C1,C08880954_decoy,TRY1,Decoy,0,-9.34834,-5.25,-4.22,-5.78411138119961
CCCCn1c(N)c(N(CCOC)C(=O)C[NH+]2CCc3cc(OC)c(OC)cc3C2)c(=O)[nH]c1=O,C09395864_decoy,TRY1,Decoy,0,-8.8608,-6.85,-3.12,-6.305745435644062
Cc1ccc(C2=NN(C(=O)C[NH2+][C@H](C)c3ccc(S(N)(=O)=O)cc3)[C@H](c3cccs3)C2)o1,C09466633_decoy,TRY1,Decoy,0,-9.47329,-6.93,-1.22,-7.958903861047529
C[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)Nc1cccc(S(=O)(=O)NC2=[NH+]CCC2)c1,C09516635_decoy,TRY1,Decoy,0,-8.42692,-8.53,-2.82,-6.5348820363808295
Cc1c(C#N)c(NC(=O)C[NH+]2CCC(C(=O)Nc3ccccc3O)CC2)n(C[C@H]2CCCO2)c1C,C09579207_decoy,TRY1,Decoy,0,-7.95971,-6.08,-3.66,-5.327505502822952
CN(C(=O)C[NH+](C)Cc1cc(=O)n2ccsc2n1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C09865474_decoy,TRY1,Decoy,0,-6.96794,-7.65,-2.73,-5.35333645510733
CCCn1c(N)c(C(=O)CSc2ccc(S(=O)(=O)N3CC[NH+](C)CC3)cn2)c(=O)[nH]c1=O,C09960454_decoy,TRY1,Decoy,0,-7.39953,-7.31,-2.31,-6.8802620043886975
CCCCN(C(=O)C[NH+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13062898_decoy,TRY1,Decoy,0,-8.10247,-6.62,-2.97,-5.753956034426135
Cc1cc([C@H](O)C[NH2+]CCCn2c(N3CCOCC3)nc3c2c(=O)n(C)c(=O)n3C)ccc1O,C13207401_decoy,TRY1,Decoy,0,-7.68938,-6.43,-4.07,-5.521948443204801
C[NH+]1CCN(S(=O)(=O)c2ccc(SCC(=O)Nc3sc4c(c3C(N)=O)CCC4)nc2)CC1,C09847267_decoy,TRY1,Decoy,0,-10.0029,-6.56,-1.99,-5.764455339891415
CC(C)CN(C(=O)C[NH+](Cc1ccco1)Cc1ccco1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C15448535_decoy,TRY1,Decoy,0,-7.72778,-6.17,-2.98,-5.764449212743571
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)C[NH+](C)CC(=O)N(CC)CC)c(=O)[nH]c1=O,C15484858_decoy,TRY1,Decoy,0,-7.81687,-6.36,-3.14,-7.368646143191935
C[C@@H](c1nnc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)n1-c1ccc(Cl)cc1)[NH+](C)C,C16685472_decoy,TRY1,Decoy,0,-8.582,-7.49,-2.13,-6.888152663837294
COC(=O)/C=C(\C(=O)OC)[C@]1(C)c2cc(C(=O)OC)c(C(=O)OC)c(N)c2C(=[NH2+])N1c1ccccc1,C16953296_decoy,TRY1,Decoy,0,-7.28518,-4.23,-3.06,-5.16411136581654
Cc1cc([C@@H](O)C[NH2+]CCCn2c(N3CCOCC3)nc3c2c(=O)n(C)c(=O)n3C)ccc1O,C17107042_decoy,TRY1,Decoy,0,-7.75464,-4.45,-1.17,-4.857876219573826
COCCn1c(N)c(C(=O)C[NH+]2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c(=O)[nH]c1=O,C22059248_decoy,TRY1,Decoy,0,-8.69014,-6.96,-3.21,-5.659299041863071
CC1=CC(=[N+](CCO)CCO)C=C/C1=C(/c1ccc([N+](=O)[O-])cc1)c1ccc(N(CCO)CCO)cc1C,C32451022_decoy,TRY1,Decoy,0,-9.08816,-4.88,-2.74,-6.821631966234566
CCOC(=O)c1c(NC(=O)[C@H](C)[NH2+]CC(=O)N[C@H]2CCS(=O)(=O)C2)sc2c1CC[C@@H](C)C2,C36386094_decoy,TRY1,Decoy,0,-9.56875,-6.62,-3.26,-6.431855884352536
CCOc1ccc(-[n+]2c(SCC(=O)Nc3ccc(Br)cc3)nc3[nH]nc(C)c3c2N)cc1,C37866409_decoy,TRY1,Decoy,0,-9.08022,-7.42,-0.8,-9.322172871155622
CCN1CCN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC[NH+](CC)C4)cc2)CC1,C36370261_decoy,TRY1,Decoy,0,-9.90149,-6.28,-2.81,-6.018377515074456
COC(=O)C[C@@H](c1ccc(OC[C@@H](O)C[NH2+]CCNC(=O)N2CCOCC2)cc1)[C@H]1COC(C)(C)O1,C38339196_decoy,TRY1,Decoy,0,-8.9829,-7.71,-2.65,-6.526302713597096
CC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCN(c3ccc(F)cc3)CC2)c1,C38597960_decoy,TRY1,Decoy,0,-8.51551,-7.4,-3.38,-6.299835598279091
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@H](c2ccco2)[NH+]2CCN(c3ccc(F)cc3)CC2)cc1,C38597962_decoy,TRY1,Decoy,0,-9.456,-8.28,-4.21,-7.492065082954838
Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601701_decoy,TRY1,Decoy,0,-8.29663,-7.15,-2.05,-6.814094651826153
CCn1nc(C)c(Br)c1C(=O)N1C[C@H](C(=O)NCCOCCO)C2(CC[NH2+]CC2)C1,C39601879_decoy,TRY1,Decoy,0,-8.02653,-6.29,-1.28,-5.9363677257808085
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)NCCOCCO)C3(CC[NH2+]CC3)C2)cc1Cl,C39601943_decoy,TRY1,Decoy,0,-9.9298,-6.51,-4.28,-6.715200153262212
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39631890_decoy,TRY1,Decoy,0,-9.71608,-5.64,-3.16,-6.752034077377232
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2ccc(N3CCOCC3)nc2)CC12CC[NH2+]CC2,C39631940_decoy,TRY1,Decoy,0,-10.6263,-7.47,-1.33,-7.598903331290495
COc1c(C(=O)N2C[C@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)csc1Cl,C39655549_decoy,TRY1,Decoy,0,-8.41516,-6.69,-0.93,-6.030136488065173
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)c1C,C39656025_decoy,TRY1,Decoy,0,-8.85276,-6.65,-5.76,-6.531371524230617
Cn1cncc1C(=O)N1C[C@@H](C(=O)NCc2ccccc2Sc2ccccc2CO)C2(CC[NH2+]CC2)C1,C39657787_decoy,TRY1,Decoy,0,-9.57869,-7.86,-4.23,-6.953039069747869
COc1cc(C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39674000_decoy,TRY1,Decoy,0,-8.55375,-6.12,-3.52,-5.8899489014606505
CC(=O)N1CCC(C(=O)N2C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)CC1,C39693478_decoy,TRY1,Decoy,0,-9.62023,-5.6,-3.0,-5.816144135197687
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2,C39693539_decoy,TRY1,Decoy,0,-9.13444,-8.09,-2.22,-6.950711380489765
Cc1nn(C)c2ncc(C(=O)N3C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39693570_decoy,TRY1,Decoy,0,-8.84812,-7.43,-1.98,-5.940078224841755
O=C(CCC[C@@H]1NN[C@H]2C(=O)N(c3ccc(Cl)cc3)CC=[N+]12)NCCc1c[nH]c2ccccc12,C39706698_decoy,TRY1,Decoy,0,-9.25404,-7.75,-1.69,-6.385209819098113
O=C(CCC[C@H]1NN[C@H]2C(=O)N(c3ccc(Cl)cc3)CC=[N+]12)NCCc1c[nH]c2ccccc12,C39706699_decoy,TRY1,Decoy,0,-8.24392,-9.21,-2.6,-7.440269617827359
O=C(CCC[C@@H]1NN[C@@H]2C(=O)N(c3ccc(Cl)cc3)CC=[N+]12)NCCc1c[nH]c2ccccc12,C39706700_decoy,TRY1,Decoy,0,-9.72546,-9.46,-1.47,-10.089660937986704
Cc1cccn2c(=O)c3cc(C(=O)Nc4nnc(SCc5ccccc5)s4)c(N)[n+](CCO)c3nc12,C39841150_decoy,TRY1,Decoy,0,-10.1275,-8.44,-3.25,-8.627078413130752
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])C(c1ccccc1)c1ccccc1,C40659384_decoy,TRY1,Decoy,0,-7.55619,-6.1,-4.0,-6.229038597314278
COc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(c2ccc(C4([NH+](C)CCO)CC4)cc2)CC3)cc1,C40977580_decoy,TRY1,Decoy,0,-9.23847,-7.7,-2.53,-7.147110180028604
CC(C)CN(C(=O)C[NH+](C)[C@@H](C)c1ccc(-n2cncn2)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C17306116_decoy,TRY1,Decoy,0,-8.32849,-6.47,-4.59,-5.9073156173383845
CC[C@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1cc(Cl)ccc1C)C(=O)NCc1ccco1,C33722069_decoy,TRY1,Decoy,0,-9.92838,-7.77,-1.87,-9.421020573789894
CC[C@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(C)c(Cl)c1)C(=O)NCc1ccco1,C33672663_decoy,TRY1,Decoy,0,-10.5964,-7.2,-0.56,-8.689630671886418
CC[C@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(Cl)c(C)c1)C(=O)NCc1ccco1,C33594509_decoy,TRY1,Decoy,0,-9.98638,-7.37,-2.43,-8.011222247403108
Cc1[nH]c(=O)[nH]c(=O)c1CSc1nnc([C@H](CC2=c3ccccc3=[NH+]C2)NC(=O)OC(C)(C)C)o1,C63411803_decoy,TRY1,Decoy,0,-9.92555,-8.8,-3.72,-9.266627911453751
CN1CNN=C1c1cccc(NC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(=O)c2cccs2)c1,C64076207_decoy,TRY1,Decoy,0,-9.51504,-6.06,-1.97,-6.6412909136273095
COCCNC(=O)CS[C@H]1NN[C@@H](N2CCN(C(=O)CC3=c4ccccc4=[NH+]C3)CC2)S1,C64409714_decoy,TRY1,Decoy,0,-7.27952,-7.32,-2.05,-6.01852508573343
COc1cc(C(=O)N[C@H](CCSC)C(=O)N2CCC3(CC2)NCCc2[nH]c[nH+]c23)cc(OC)c1OC,C13570713_decoy,TRY1,Decoy,0,-8.91728,-6.01,-1.85,-6.009520966673378
CCn1c(=O)c(=O)[nH]c2cc(C3=[NH+][C@H]([C@@H](NS(=O)(=O)c4ccccc4)C(C)C)ON3)ccc21,C64890614_decoy,TRY1,Decoy,0,-8.12837,-8.03,-3.98,-6.155025700942329
C[C@H](C(=O)NCC[NH+]1CCOCC1)[C@H]1CC[C@]2(C)Cc3sc(NC(=O)C[NH+](C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840945_decoy,TRY1,Decoy,0,-9.923,-7.28,-3.84,-6.643292840154118
C/C(O)=C(/C(=O)CCSC[C@H]([NH3+])C(=O)[O-])[C@@H](SC[C@H]([NH3+])C(=O)[O-])c1ccc(Cl)c(Cl)c1,C05520878_decoy,TRY1,Decoy,0,-8.38516,-5.36,-2.21,-5.895043991240737
CC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(C[C@@H]1CCCO1)C(=O)c1snc(C(N)=O)c1N,C06074898_decoy,TRY1,Decoy,0,-8.24835,-7.39,0.28,-9.178652570453488
CC(C)(C)NC(=O)[C@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(F)c1,C06075148_decoy,TRY1,Decoy,0,-8.87787,-7.28,-0.52,-10.158811816966375
CCCCO[C@@H]1[C@@H]2OC(C)(C)O[C@@H]2O[C@@H]1[C@H](O)CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1NC(C)=O,C10001628_decoy,TRY1,Decoy,0,-5.91514,-6.03,-2.29,-5.314865035976527
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC(C)(C)C)c1ccc(O)cc1,C12473783_decoy,TRY1,Decoy,0,-7.67801,-6.61,-1.64,-6.3381572160629664
COc1cc([C@@H](C(=O)NC(C)(C)C)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(C)cc2C)ccc1O,C12477900_decoy,TRY1,Decoy,0,-7.58565,-6.82,-4.25,-7.3782913455931585
Cc1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)o1,C12714686_decoy,TRY1,Decoy,0,-7.41229,-5.13,-0.17,-5.872298612421824
C/C=C/C(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@@H](O)[C@@H](O)[C@@H]1O,C14930834_decoy,TRY1,Decoy,0,-8.33125,-6.9,-2.57,-5.766048808011491
CCC[NH2+]C[C@H](O)CNc1ccc(NC[C@H](O)C[NH2+]CCC)c2c1C(=O)c1ccccc1C2=O,C17257085_decoy,TRY1,Decoy,0,-9.14625,-6.07,-2.39,-8.978476355644727
COc1ccc(-c2oc3cc(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c(O)c3c(=O)c2OC)cc1O,C03978769_decoy,TRY1,Decoy,0,-8.69496,-7.94,-2.05,-7.90278373268842
C[NH+](C)CCNC(=O)C[C@@H]1c2[nH+]c(NCc3ccccc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C20504791_decoy,TRY1,Decoy,0,-10.5456,-7.39,-2.21,-7.945178099420953
CC(C)n1cc(/C=N/Nc2nnc(SCCC(=O)Nc3ccc4c(c3)C(=O)NC4=O)n2N)cn1,C20921479_decoy,TRY1,Decoy,0,-8.95302,-8.37,-2.7,-7.28131513357864
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2N)c(O)c1,C21325872_decoy,TRY1,Decoy,0,-6.85694,-8.54,-1.73,-8.651393174657061
CCc1nc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)nc(N)c1-c1ccc(Cl)cc1,C25459653_decoy,TRY1,Decoy,0,-6.99171,-6.69,-3.06,-5.742650120129524
C/C(COc1ccc(Cl)cc1Cl)=N/Nc1nc2c(N)ncnc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O,C30973019_decoy,TRY1,Decoy,0,-7.953,-7.76,-0.99,-6.819036605915041
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)C=C[C@H]1O,C31163248_decoy,TRY1,Decoy,0,-10.0063,-9.11,-3.91,-7.944385900411569
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)C=C[C@H]1O,C31163257_decoy,TRY1,Decoy,0,-10.0009,-8.32,-3.94,-6.697533735063778
N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCN1CCN(C(=O)/C(C#N)=C\c2ccc(O)c(O)c2)CC1,C17259463_decoy,TRY1,Decoy,0,-9.79165,-8.33,-3.59,-7.056863139266966
C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](OCCO)Oc1ccc(C(=O)/C=C/c2ccc3c(c2)OCCO3)c(O)c1,C34898298_decoy,TRY1,Decoy,0,-9.8881,-6.55,-2.39,-6.447363517195851
CC(=O)N[C@H]1[C@@H](OC(=O)c2ccccc2)O[C@@H](CO)[C@@H](O[C@H]2O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]2O)[C@H]1O,C35203031_decoy,TRY1,Decoy,0,-5.37876,-6.03,-4.5,-4.644081750657099
C=C[C@H]1[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)OC=C(C(=O)[O-])[C@@H]1Cc1[nH+]ccc2c1[nH]c1ccccc12,C35454579_decoy,TRY1,Decoy,0,-6.79934,-8.0,-3.4,-7.980311140307318
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1[C@@H](O)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)C=C[C@@H]1O,C35458240_decoy,TRY1,Decoy,0,-9.25681,-7.68,-3.31,-6.9114709743663
CC1=C(C(=O)O[C@H]2O[C@@H](CO[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)C(C)(C)CCC1,C35465938_decoy,TRY1,Decoy,0,-7.40493,-8.22,-2.5,-6.518474335477928
Cc1ccc(CN(C(=O)[C@@H]2CCC(=O)N2)[C@@H](C(=O)NC2CCCCC2)c2c(O)cc(O)cc2O)o1,C36601089_decoy,TRY1,Decoy,0,-9.12552,-6.9,-2.22,-7.73197763261337
O=C(Cc1c[nH]c2ccccc12)OC[C@H]1O[C@@H](O[C@]2(CO)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O,C37009788_decoy,TRY1,Decoy,0,-5.5897,-8.16,-4.11,-7.281044313344116
CC(C)(CO)[NH2+]CC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)C[NH2+]C(C)(C)CO)c1Cl,C08830315_decoy,TRY1,Decoy,0,-8.66791,-5.35,-0.56,-6.647072232958776
COCCN(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC1CCCCC1)c1ccc(F)cc1,C06904802_decoy,TRY1,Decoy,0,-7.41677,-7.93,-2.08,-7.673902478172165
COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC,C31155381_decoy,TRY1,Decoy,0,-6.9906,-6.96,-3.0,-6.1366347550951765
[NH3+][C@@H](CCCCNS(=O)(=O)c1ccccc1F)C[NH2+][C@H]1CCc2cc(O)ccc2[C@H]1Cc1cccnc1,C38320265_decoy,TRY1,Decoy,0,-12.2159,-7.86,-3.4,-7.854033001906363
COc1c(O)cc(C(=O)O[C@]2(Oc3ccc(O)cc3)O[C@H](CO)[C@@](C)(O)[C@](C)(O)[C@@H]2C)cc1O,C38337976_decoy,TRY1,Decoy,0,-8.66571,-8.24,-1.64,-8.268094808991709
CCc1cccc(C)c1NC(=O)CS[C@@H]1NN[C@H]([C@@H]2C=C(c3ccc(Cl)cc3)N=N2)N1N,C38990113_decoy,TRY1,Decoy,0,-10.4413,-8.18,-1.78,-7.571901214675961
CCc1cccc(C)c1NC(=O)CS[C@@H]1NN[C@@H]([C@@H]2C=C(c3ccc(Cl)cc3)N=N2)N1N,C38990115_decoy,TRY1,Decoy,0,-10.3578,-5.75,-1.94,-6.465914111132805
CC(=O)Nc1ccc(NC(=O)CS[C@@H]2NN[C@@H]([C@@H]3C=C(c4ccc(Cl)cc4)N=N3)N2N)cc1,C39012080_decoy,TRY1,Decoy,0,-10.8522,-9.21,-2.92,-7.796547965862678
COc1cc([C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(=O)NC[C@H]2c2ccc(O)cc2)ccc1O,C39560217_decoy,TRY1,Decoy,0,-9.15568,-8.56,-2.82,-12.219748082557851
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCC(=O)Nc4ccc(F)c(Cl)c4)N3N)N=N2)cc1,C38990389_decoy,TRY1,Decoy,0,-10.1507,-8.8,-4.86,-8.445850756881782
NC(=O)NCCC[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cccs2)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21,C33904184_decoy,TRY1,Decoy,0,-7.50394,-6.14,-2.7,-6.268126612423535
C[C@]12CC[C@@H]3[C@](COC(=O)c4ccccc4)(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O1)O[C@]3(O)C2,C43722119_decoy,TRY1,Decoy,0,-5.77835,-7.72,-1.13,-6.41269698093725
Nc1nc(N[C@H](CO)Cc2ccccc2)nc2c1ncn2[C@@H]1C[C@H](n2ccccc2=O)[C@@H](O)[C@H]1O,C45338474_decoy,TRY1,Decoy,0,-9.53861,-7.89,-1.77,-7.619136753489608
C[C@@H]1CCc2c(sc(NC(=O)CCC(=O)Nc3sc4c(c3C(N)=O)CC[C@H](C)C4)c2C(N)=O)C1,C20572196_decoy,TRY1,Decoy,0,-8.88876,-5.67,-4.81,-6.613280643233038
Cc1nc(-c2ccoc2)c(-c2cnc3[nH]nc(C)c3n2)cc1OC[C@@H]([NH3+])CC1=c2ccccc2=[NH+]C1,C52569919_decoy,TRY1,Decoy,0,-8.1395,-7.36,-0.87,-6.055038480313865
CCc1[nH]c(C)c(CNc2cc(C(=O)N3CCC[NH+](C)CC3)cc(S(=O)(=O)NC(C)(C)C)c2)[nH+]1,C14534475_decoy,TRY1,Decoy,0,-8.07901,-6.13,-3.04,-5.7897104225939735
CC(=O)N[C@H]1[C@@H](C)NN(c2ccccc2)[C@H]1[NH+]1CCC(C(=O)NCCC2=c3ccccc3=[NH+]C2)CC1,C63694179_decoy,TRY1,Decoy,0,-8.63817,-6.57,-3.81,-5.87165119701747
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@H](SCC(=O)Nc2ccc(Br)cc2)O1,C63804810_decoy,TRY1,Decoy,0,-7.26566,-8.29,-1.02,-7.041259709849637
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@@H](SCC(=O)Nc2ccc(Br)cc2)O1,C63804818_decoy,TRY1,Decoy,0,-7.89952,-8.35,-3.64,-6.72515309611945
[H]/N=C1\C(C(N)=O)=C(NC2CCCCC2)S[C@@H]1C(=O)Nc1sc2c(c1C(=O)OC)CCCC2,C17777920_decoy,TRY1,Decoy,0,-11.2927,-7.62,-1.27,-7.39730056613823
C[C@H]1NNC(=O)C2=C1[C@@H](C)O[C@H]2NC(=O)CS[C@@H]1NN=C(Nc2ccc(OC(F)(F)F)cc2)S1,C38639746_decoy,TRY1,Decoy,0,-9.07502,-9.24,-2.51,-7.102150856039718
CCCC1=N[C@@H]2N[C@H](c3cccnc3)NN2C(Nc2cccc(C(=O)NC3[NH+]=c4ccccc4=[NH+]3)c2)=C1,C64791764_decoy,TRY1,Decoy,0,-7.80261,-7.2,-2.18,-4.897498175660269
CCCC1=N[C@H]2N[C@@H](c3cccnc3)NN2C(Nc2cccc(C(=O)NC3[NH+]=c4ccccc4=[NH+]3)c2)=C1,C64791772_decoy,TRY1,Decoy,0,-9.4175,-8.7,-1.45,-7.967530217974824
CCN(CC)C(=O)C[C@@H]1c2nc(NC(=O)N3CCOCC3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04222280_decoy,TRY1,Decoy,0,-10.6132,-6.05,-2.17,-7.455944610941808
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3Nc2nccc(-c3cccs3)n2)cc1,C05433864_decoy,TRY1,Decoy,0,-8.31155,-8.9,-2.2,-7.874836304557967
O=C(NC[C@H]1CCCO1)c1c[nH]c2ccc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)cc2c1=O,C06181429_decoy,TRY1,Decoy,0,-7.94751,-8.33,-3.12,-6.57935426966102
COC(=O)C[C@@H]1SC2=C(C(=O)Nc3ccc(C)cc3)[C@H](c3ccccc3Cl)C(C#N)=C(N)N2C1=O,C03770043_decoy,TRY1,Decoy,0,-8.09731,-4.71,-1.68,-5.307237950383504
O=C(NCCc1ccc(O)cc1)C(=O)NC[C@H](c1ccc2c(c1)OCO2)S(=O)(=O)c1cccs1,C08970025_decoy,TRY1,Decoy,0,-9.56772,-8.41,-4.61,-7.394116972321528
O=C(NCCc1ccc(O)cc1)C(=O)NC[C@@H](c1ccco1)S(=O)(=O)c1ccc2c(c1)OCO2,C09081606_decoy,TRY1,Decoy,0,-8.31793,-8.28,-2.16,-6.904364700849392
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc1,C09396274_decoy,TRY1,Decoy,0,-10.0306,-8.87,-2.54,-7.579479903039422
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1)C(=O)NC1CC1,C09889285_decoy,TRY1,Decoy,0,-7.81857,-6.35,-3.46,-5.40448920862146
Cc1cc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3sccc3C(N)=O)c3cnn(C(C)C)c3n2)c(C)o1,C10957269_decoy,TRY1,Decoy,0,-9.00013,-7.72,-2.54,-8.310317746157436
Cc1csc(CC(=O)NNC(=O)[C@H](C)SCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)n1,C12599355_decoy,TRY1,Decoy,0,-9.55681,-6.97,-3.65,-7.266542695551919
Cc1ccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1,C12702238_decoy,TRY1,Decoy,0,-8.45012,-5.97,-2.33,-5.471948052720374
C[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl,C12740878_decoy,TRY1,Decoy,0,-8.26368,-7.58,-3.66,-5.874163597807452
O=C(CCCC[C@@H]1[C@H]2NC(=O)N[C@@H]2CS1(=O)=O)Nc1ccc2nc(N3CCOCC3)sc2c1,C12818909_decoy,TRY1,Decoy,0,-11.1756,-7.82,-3.58,-9.19165093226401
COCCCN(C(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C12863420_decoy,TRY1,Decoy,0,-7.56945,-6.86,-1.22,-8.66689279652108
CC(C)CN(CC(=O)N1CCN(C(=O)c2cccs2)CC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12922643_decoy,TRY1,Decoy,0,-8.40876,-6.65,-3.56,-6.320229090871186
COc1ccccc1-n1c(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)nnc1-c1cccs1,C09716315_decoy,TRY1,Decoy,0,-10.0915,-7.14,-2.71,-6.932567017731516
COc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1,C13630289_decoy,TRY1,Decoy,0,-8.1653,-5.94,-2.36,-6.71266967194938
COc1ccccc1NC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)Nc2ccccc2OC)[C@@H]1c1cn(C)nc1C,C13960844_decoy,TRY1,Decoy,0,-7.57807,-5.9,-3.07,-5.268365417143374
COCCN(C(=O)c1cc(OC)c(Br)c(OC)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C15605436_decoy,TRY1,Decoy,0,-6.57643,-6.3,-2.69,-5.1411857925230855
Cc1cc(C)nc(N/C(=N/C(=O)CSc2nnc(C)s2)NCCc2c[nH]c3ccc(F)cc23)n1,C18077295_decoy,TRY1,Decoy,0,-10.6776,-6.33,-1.18,-7.254265741208031
CCOC(=O)CC1=C(C(=O)OCC)[C@]2(C(=O)O1)C(C(=O)OC)=C(N)Nc1ccc(Br)cc12,C20167486_decoy,TRY1,Decoy,0,-7.95027,-4.81,-2.0,-6.094860710389471
CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3sc4c(c3C(N)=O)CCCC4)CC2=O)cc1,C20973188_decoy,TRY1,Decoy,0,-10.5077,-7.2,-1.37,-7.105205887754083
COCCn1c(N)c(C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c(=O)[nH]c1=O,C21729747_decoy,TRY1,Decoy,0,-7.97612,-5.49,-2.01,-5.320868260541536
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1,C21967761_decoy,TRY1,Decoy,0,-8.36062,-7.97,-2.11,-6.14799611027536
CC(=O)NCc1ccc(-c2nc(NC(=O)c3cc(S(=O)(=O)NC(C)C)cn3C)sc2C)s1,C23151024_decoy,TRY1,Decoy,0,-10.6653,-7.98,-3.96,-7.721507541007122
O=[N+]([O-])c1ccc([C@H](O)[C@@H](CO)Nc2nc(CN3CCOCC3)nc3sc4c(c23)CCC4)cc1,C12806756_decoy,TRY1,Decoy,0,-9.30965,-7.1,-0.35,-6.126848597420875
Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N1CCN(S(=O)(=O)c2cc(C(N)=O)n(C)c2)CC1,C25537755_decoy,TRY1,Decoy,0,-8.53693,-6.95,-3.27,-5.860485669903477
C=CCn1c(Cc2csc(NC(=O)CCc3nc4sc5c(c4c(=O)[nH]3)CCC5)n2)n[nH]c1=S,C25682082_decoy,TRY1,Decoy,0,-11.3088,-5.07,-4.38,-7.014560495464618
CCc1cccc(CC)c1N1C(=O)[C@H]2[C@@H](c3ccc(OC)c(C)c3OC)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]2C1=O,C33617266_decoy,TRY1,Decoy,0,-6.61244,-6.37,-2.54,-5.3022476524401
CCCCN1C(=O)[C@H]2[C@@H](c3cccc(OC(F)(F)F)c3)[NH2+][C@@](Cc3ccc(O)cc3)(C(=O)[O-])[C@@H]2C1=O,C33751957_decoy,TRY1,Decoy,0,-7.98334,-6.56,-2.57,-5.983682496099114
COCCCN(C(=O)[C@@H]1CC(=O)N([C@H]2CCC[C@H](C)[C@H]2C)C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C36390215_decoy,TRY1,Decoy,0,-8.63813,-6.81,-2.72,-6.646965642414354
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc(O)cc2)N(Cc2ccco2)C(=O)[C@@H]2CCC(=O)N2)cc1,C36504493_decoy,TRY1,Decoy,0,-9.19835,-8.25,-2.65,-8.548096617637254
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc(O)cc2)N(Cc2ccco2)C(=O)[C@@H]2CCC(=O)N2)cc1,C36504494_decoy,TRY1,Decoy,0,-8.89519,-8.96,-2.88,-8.554711709223616
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccccc2O)N(Cc2ccco2)C(=O)[C@@H]2CCC(=O)N2)cc1,C36504557_decoy,TRY1,Decoy,0,-8.22718,-7.74,-2.36,-6.826444015900708
CC(=O)Nc1ccc(N(C(=O)CNC(=O)c2ccco2)[C@H](C(=O)NCc2ccco2)c2ccccc2)cc1,C12487275_decoy,TRY1,Decoy,0,-7.11526,-6.27,-3.29,-5.416843806948235
CC(C)CCN(C(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C23079955_decoy,TRY1,Decoy,0,-7.64112,-6.13,-1.87,-6.48303632211089
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1csc(N2CCOCC2)n1,C23079933_decoy,TRY1,Decoy,0,-9.71404,-6.91,-2.98,-6.993755613549123
CCOC(=O)[C@H]1CCc2sc(NC(=O)CCc3csc(NC(=O)c4ccc[nH]c4=O)n3)nc21,C38517100_decoy,TRY1,Decoy,0,-10.3873,-7.49,-1.58,-9.57250274880434
CCN1C[C@H](C(=O)N[C@@H](C)C(=O)NCCc2c[nH]c3ccc(F)cc23)C(=O)c2cc3c(cc21)OCO3,C38786989_decoy,TRY1,Decoy,0,-10.0321,-8.34,-2.59,-7.088870449694767
CCOC(=O)[C@@H]1[C@@H](C)[C@H](C(=O)Nc2ccccc2)S[C@@H]1NC(=O)CSc1ncnc2nc[nH]c12,C39153023_decoy,TRY1,Decoy,0,-8.981,-6.57,-1.49,-7.499608015450792
CCOC(=O)c1sc(NC(=O)c2ccc(S(=O)(=O)N(C)C[C@@H]3CCCO3)cc2)c(C(N)=O)c1C,C39737894_decoy,TRY1,Decoy,0,-8.93312,-5.9,-2.85,-5.959134545304679
C=CCn1c(S[C@@H](C)C(=O)/N=C2/NCCS2)nnc1[C@H](CO)NC(=O)c1ccc(OC)cc1,C39761106_decoy,TRY1,Decoy,0,-10.0825,-5.88,-2.89,-6.340076707162319
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)C2=Cc3cc(Br)ccc3OC2)cc1,C40117587_decoy,TRY1,Decoy,0,-7.29233,-7.65,-2.1,-6.325808953013807
CCCCN1C(=O)[C@H]2[C@@H](c3ccc4c(c3)OCCO4)[NH2+][C@@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@@H]2C1=O,C43221487_decoy,TRY1,Decoy,0,-8.29417,-6.81,-2.44,-6.117792914998764
CCc1cccc(CC)c1N1C(=O)[C@H]2[C@@H](c3ccc4c(c3)OCCO4)[NH2+][C@](C(=O)[O-])([C@@H](C)O)[C@@H]2C1=O,C43221889_decoy,TRY1,Decoy,0,-7.05743,-5.98,-1.47,-5.226044752798259
NS(=O)(=O)c1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1,C47152234_decoy,TRY1,Decoy,0,-8.19612,-5.98,-2.92,-5.674860980782055
COC(=O)C[C@H]1SC(=O)N/C1=N/N=C1\NC(=O)[C@@H](CC(=O)Nc2ccc(Br)cc2)S1,C13688358_decoy,TRY1,Decoy,0,-10.5075,-5.99,-4.5,-6.122644909599554
COc1ccc(CCN2C(=O)[C@@H]3[C@H]([C@@H](C)O)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC,C16022095_decoy,TRY1,Decoy,0,-9.14068,-5.98,-2.83,-6.489184545041305
C/C(=N\Nc1nc(SCC(=O)NCc2nnc(C(C)C)o2)n[nH]1)c1ccc(Br)cc1,C59880960_decoy,TRY1,Decoy,0,-10.5404,-7.59,-2.83,-7.8564879110028
COc1ccc([C@H]2c3cc(OC)c(OC)cc3CC(=O)N2NC(=O)c2cc(O)ccc2O)cc1OC,C59947416_decoy,TRY1,Decoy,0,-7.90739,-6.18,-1.36,-8.373670263252446
CC1CC[NH+](Cc2c(C(=O)N/N=C/c3c(F)cccc3Cl)nnn2-c2nonc2N)CC1,C02337169_decoy,TRY1,Decoy,0,-9.21417,-6.83,-2.19,-6.08280323287192
NC(=O)C1CC[NH+]([C@@H](c2ccc([N+](=O)[O-])cc2)c2sc3nc(-c4ccco4)nn3c2O)CC1,C09808353_decoy,TRY1,Decoy,0,-8.85834,-7.57,-1.03,-6.318217825588773
O=C1NCCCC[C@@H]1[NH2+]C1CCN(c2cccc(NS(=O)(=O)c3ccc(F)cc3)c2)CC1,C12149432_decoy,TRY1,Decoy,0,-9.27352,-7.21,-1.74,-6.088115771772624
C[C@@H](NC(=O)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O)c1cccs1,C12184701_decoy,TRY1,Decoy,0,-10.833,-6.41,-2.92,-6.141543610479026
CC1CC[NH+](Cc2nc(NCc3ccc(S(N)(=O)=O)cc3)c3c4c(sc3n2)CCC4)CC1,C13039470_decoy,TRY1,Decoy,0,-10.623,-7.33,-2.94,-9.329800484626675
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(S(=O)(=O)c4ccccc4C#N)CC3)n2)cc1,C09469187_decoy,TRY1,Decoy,0,-7.80381,-6.86,-3.31,-5.328472148306183
Cc1sc2nc(C[NH+]3CCC(C)CC3)nc(N[C@@H](C)c3cccc(S(N)(=O)=O)c3)c2c1C,C14247097_decoy,TRY1,Decoy,0,-9.90941,-6.72,-1.06,-6.308678821507582
O=C(NC[C@@H]1COCCO1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C15068092_decoy,TRY1,Decoy,0,-8.69836,-8.29,-3.0,-6.999451490814019
O=C(NC[C@H]1COCCO1)c1ccc(C[NH+]2CCC(O)(c3ccc(Cl)cc3)CC2)[nH]c1=O,C15068093_decoy,TRY1,Decoy,0,-10.0216,-8.0,-2.38,-6.365521550615715
C[NH+](CC(=O)NC(=O)Nc1ccc2c(c1)OCO2)CC(=O)Nc1ccccc1Br,C15143998_decoy,TRY1,Decoy,0,-8.29305,-8.73,-3.47,-9.39892760033451
Cc1c(Cl)cccc1Nc1nc(N)nc(C[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)n1,C19899237_decoy,TRY1,Decoy,0,-7.66428,-5.74,-1.39,-4.678538892006224
CC[NH+](CC(=O)Nc1ccc2c(c1)OCCO2)Cc1nc(N)c2c3c(sc2n1)CCCCC3,C22010555_decoy,TRY1,Decoy,0,-9.32829,-7.01,-2.18,-6.011341742278657
O=C(C[NH+]1CCN(CC(=O)NN2C(=O)NC3(CCCCC3)C2=O)CC1)Nc1cccc(F)c1,C22782920_decoy,TRY1,Decoy,0,-7.34563,-7.81,-1.9,-5.669019624156116
C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](CC(=O)N2CCCCCC2)CC1,C22792016_decoy,TRY1,Decoy,0,-10.3897,-7.53,-3.2,-7.365780832313991
C[C@H]1C[C@H](C)CN(C(=O)C[NH+]2CCN([C@@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)CC2)C1,C23372232_decoy,TRY1,Decoy,0,-11.5191,-6.52,-4.41,-6.9582560868394046
C/C(=N/NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCCC[C@@H]1C)c1ccc(Cl)s1,C25782720_decoy,TRY1,Decoy,0,-9.20033,-5.7,-3.19,-5.608532609628995
Nc1nc(C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)nc(Nc2ccc(F)cc2)n1,C15030583_decoy,TRY1,Decoy,0,-7.84536,-6.26,-1.41,-5.695461850858968
Cc1ccc(C)c(S(=O)(=O)N2CC[NH+]([C@H](C)c3nc(N)nc(Nc4ccccc4)n3)CC2)c1,C32850928_decoy,TRY1,Decoy,0,-7.15293,-7.04,-3.16,-5.670708660533851
C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1,C22930993_decoy,TRY1,Decoy,0,-8.76031,-7.74,-2.01,-6.730145134484481
CCc1ccc(N2C(=O)Nc3ccc(Br)cc3[C@]2(O)C(=O)NCC[NH+](C)C)cc1,C03670437_decoy,TRY1,Decoy,0,-8.7833,-4.95,-0.63,-5.643332237318113
C[NH2+][C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2ccc(N[C@@H]3CCCCNC3=O)c(=O)cc21,C08681867_decoy,TRY1,Decoy,0,-8.72688,-6.05,-2.54,-5.726186631192285
C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1C[NH+]1CCCCCC1)c1ccc(Br)cc1,C12362417_decoy,TRY1,Decoy,0,-10.1163,-8.73,-2.96,-8.889246726988382
O=C(N[C@H](C(=O)N/N=C/C1=c2ccccc2=[NH+]C1)c1n[nH]c(=O)c2ccccc12)c1ccccc1,C38599990_decoy,TRY1,Decoy,0,-8.48282,-9.26,-2.83,-7.428377123699414
Cc1ccc(Nc2nc(N)nc(C[NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)cc1Cl,C22783695_decoy,TRY1,Decoy,0,-8.45467,-6.19,-1.46,-5.467187469433281
C/C(=N/NC(=O)[C@@H]1C(=O)N(CCC(C)C)c2ccccc2[C@H]1O)[C@H]1C(=O)[NH+]=c2ccccc2=C1O,C38574044_decoy,TRY1,Decoy,0,-9.2784,-9.07,-0.38,-12.033955593628834
O=C(NCCNc1ccccc1)[C@@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39655218_decoy,TRY1,Decoy,0,-8.26751,-6.34,-5.19,-5.55720376074136
O=C(NCCNc1ccccc1)[C@H]1CN(C(=O)c2c(Cl)cccc2Cl)CC12CC[NH2+]CC2,C39655219_decoy,TRY1,Decoy,0,-9.08807,-6.89,-3.05,-6.199232554967885
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)[C@@H](C(F)(F)F)O1,C39674076_decoy,TRY1,Decoy,0,-8.16071,-8.7,-2.06,-7.150842590910127
Cc1ccccc1CC(=O)N1C[C@H](C(=O)NCCc2c(C)[nH]c3ccccc23)C2(CC[NH2+]CC2)C1,C39674112_decoy,TRY1,Decoy,0,-8.53553,-10.24,-1.78,-10.207508280972478
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)c4ccccc4C(F)(F)F)CC34CC[NH2+]CC4)c[nH]c12,C39684080_decoy,TRY1,Decoy,0,-9.33744,-7.11,-2.44,-6.686559065760472
COc1c(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)csc1Cl,C39684185_decoy,TRY1,Decoy,0,-8.29855,-6.9,-2.52,-5.980952395695065
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685744_decoy,TRY1,Decoy,0,-9.15122,-5.34,-4.42,-6.629061362785594
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685746_decoy,TRY1,Decoy,0,-9.93281,-6.67,-2.7,-6.99313691167038
CCOc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@H](C(=O)NC(C)(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39685795_decoy,TRY1,Decoy,0,-7.16281,-5.81,-3.6,-5.471907195428619
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685797_decoy,TRY1,Decoy,0,-10.2988,-6.88,-2.28,-6.866598897155511
CCOc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)c2nc3ccc(C)cc3[nH]2)C2(CC[NH2+]CC2)C1,C39695774_decoy,TRY1,Decoy,0,-9.15682,-8.35,-3.3,-7.428019056332476
Nc1c(NCc2ccc3c(c2)OCO3)ncnc1N1CC[NH+](Cc2ccc3c(c2)OCO3)CC1,C40686288_decoy,TRY1,Decoy,0,-8.27121,-6.85,-1.48,-5.474025718029361
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cc(C)oc4C(F)(F)F)CC34CC[NH2+]CC4)c2c1,C44707850_decoy,TRY1,Decoy,0,-8.13054,-6.57,-3.05,-5.797853618350083
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccccc34)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C44713591_decoy,TRY1,Decoy,0,-7.65168,-8.89,-2.19,-6.848017081910504
CC(=O)Oc1ccccc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2c(C)n[nH]c2C)C2(CC[NH2+]CC2)C1,C44713652_decoy,TRY1,Decoy,0,-8.3433,-5.98,-1.86,-5.944946185488121
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c(OC)c1,C44713725_decoy,TRY1,Decoy,0,-8.46529,-5.36,-1.95,-5.395383594973332
COc1ccc(OC)c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)c1,C44714132_decoy,TRY1,Decoy,0,-7.75506,-5.36,-1.9,-5.176860732669357
Cc1ccc(CC(=O)N2C[C@@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)cc1,C44714667_decoy,TRY1,Decoy,0,-9.37805,-7.5,-1.91,-6.427932727641667
Nc1ncnc2nc(-c3ccc(N4CCOCC4)nc3)cc(NCCC3=c4ccccc4=[NH+]C3)c12,C52607905_decoy,TRY1,Decoy,0,-8.6239,-8.28,-1.59,-7.936762396239369
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)cc1OC,C39695721_decoy,TRY1,Decoy,0,-8.8359,-8.7,-1.11,-7.4139339183700494
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)[C@@H](C)Oc4ccccc4)CC34CC[NH2+]CC4)[nH]c2c1,C39695761_decoy,TRY1,Decoy,0,-9.91143,-9.58,-2.28,-9.735258172311331
NS(=O)(=O)[C@H]1CC(C(=O)NC[C@@H](C2=c3ccccc3=[NH+]C2)c2ccccc2Cl)=CS1,C63150025_decoy,TRY1,Decoy,0,-8.93457,-5.78,-1.42,-5.523133818401368
COc1ccc2c(c1)=C1CC[NH2+][C@H](c3c([O-])[nH]c(=O)n([C@@H](C)CCc4ccccc4)c3=O)[C@H]1[NH+]=2,C63384116_decoy,TRY1,Decoy,0,-8.14719,-7.79,-2.94,-5.76382292114495
O=C(NCCC1=c2ccccc2=[NH+]C1)C1=C2N[C@@H](NC(=O)c3ccc4c(c3)OCO4)S[C@@H]2CC1,C64375513_decoy,TRY1,Decoy,0,-9.4638,-7.57,-1.94,-6.11517994521394
Cc1ccc(-c2ccc(Nc3ccc(S(N)(=O)=O)cc3)[nH+]n2)cc1S(=O)(=O)N1CCOCC1,C35512735_decoy,TRY1,Decoy,0,-10.4435,-6.02,-3.87,-6.08631666771052
COCCCN1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2CCC(N)=O)C(=O)Nc2ccc(C)cc21,C05346367_decoy,TRY1,Decoy,0,-8.06671,-7.43,-0.75,-7.88278617472785
O=[N+]([O-])c1ccc([C@@H](O)[C@H](CO)[NH2+]C[C@H](O)COCc2ccc3c(c2)OCO3)cc1,C07238873_decoy,TRY1,Decoy,0,-7.96041,-7.09,-1.88,-6.23869153271456
Cc1ccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1,C08472765_decoy,TRY1,Decoy,0,-9.35834,-7.66,-2.1,-6.68461984673584
O=C(NCC[NH+]1CCOCC1)[C@H]1C[C@@H](O)[C@H](O)[C@@H]2N=C(Nc3ccc4c(c3)OCO4)S[C@@H]21,C08636347_decoy,TRY1,Decoy,0,-9.77529,-6.56,-0.68,-6.709666565403335
COCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccc(C)cc43)[C@H]2C1=O,C08971925_decoy,TRY1,Decoy,0,-8.02385,-6.57,-2.72,-6.336849765376297
COCCCN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@]3(C(=O)Nc4ccc(C)cc43)[C@H]2C1=O,C08971927_decoy,TRY1,Decoy,0,-8.52387,-6.23,-1.28,-6.704590225811236
Cc1ccc(Nc2nc(N)nc(C[NH2+][C@@H](CO)[C@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C09442179_decoy,TRY1,Decoy,0,-7.01428,-6.21,-3.56,-5.649701605500352
CC[NH+](CC(=O)Nc1ccc(NC(C)=O)cc1)CC(=O)Nc1oc(C)c2c(C)n[nH]c(=O)c12,C11289437_decoy,TRY1,Decoy,0,-8.39054,-5.32,-2.9,-5.88731767927609
COc1ccccc1CN1C(=O)[C@@H]2[C@H](CCC(N)=O)[NH2+][C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C12877663_decoy,TRY1,Decoy,0,-6.76482,-5.27,-1.47,-4.821889691632412
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)Cl)[NH+](C)C1,C13298316_decoy,TRY1,Decoy,0,-7.53502,-6.22,-1.89,-5.470841232294495
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)cc(Cl)c1OCC(N)=O,C16688338_decoy,TRY1,Decoy,0,-7.50076,-6.07,-3.22,-5.488741884597856
CC(C)NC(=O)CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=S)NCCN3CCOCC3)C[NH+]12,C15707440_decoy,TRY1,Decoy,0,-8.35221,-6.47,-2.01,-5.949995286872684
COc1ccc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)cc1O,C20833886_decoy,TRY1,Decoy,0,-9.08579,-6.83,-3.66,-6.06807646610531
Cc1ccccc1Nc1nc(N)nc(C[NH+]2CCN(Cc3nc4sc(C)c(C)c4c(=O)[nH]3)CC2)n1,C22927375_decoy,TRY1,Decoy,0,-7.5222,-7.98,-1.83,-5.85447979582473
Cc1nc(N2CCN(CCO)CC2)cc(Nc2ncc(C(=O)Nc3c(C)cccc3O)s2)[nH+]1,C35643757_decoy,TRY1,Decoy,0,-11.2183,-7.01,-2.32,-7.083713025729012
COC(=O)c1cc(Br)cc(Br)c1NC(=O)CNC(=O)C[NH3+],C37769952_decoy,TRY1,Decoy,0,-7.25893,-6.84,-3.07,-10.143775473245462
O=C(NCCc1ccc(O)c(O)c1)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39661718_decoy,TRY1,Decoy,0,-8.9127,-9.01,-2.49,-7.382223222337189
O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39661719_decoy,TRY1,Decoy,0,-8.41368,-9.46,-1.23,-7.492351687988455
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)NCCc3ccc(O)c(O)c3)C3(CC[NH2+]CC3)C2)no1,C39661849_decoy,TRY1,Decoy,0,-8.63808,-6.16,-2.63,-5.872975461503298
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCCc2ccc(O)c(O)c2)C2(CC[NH2+]CC2)C1,C39661854_decoy,TRY1,Decoy,0,-9.11755,-8.56,-1.12,-7.934081292110265
CS(=O)(=O)Nc1ccc(CC2=NO[C@@H](C3=CC4=C(CC[NH3+])C=N[C@@H]4C=C3)N2)cc1,C39947079_decoy,TRY1,Decoy,0,-9.74537,-6.89,-1.61,-8.311142768731264
CS(=O)(=O)Nc1ccc(CC2=NO[C@@H](C3=CC4=C(CC[NH3+])C=N[C@H]4C=C3)N2)cc1,C39947081_decoy,TRY1,Decoy,0,-10.596,-5.61,-0.84,-5.918990319689804
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C36369753_decoy,TRY1,Decoy,0,-9.19868,-6.42,-0.58,-7.7045035333273155
Nc1c(NNC(=O)COc2ccc(Cl)cc2Cl)ncnc1Nc1cc[nH+]cc1,C40687642_decoy,TRY1,Decoy,0,-8.08139,-8.09,-1.24,-6.59612942762565
COc1cc(Br)cc(C[NH2+]CCNC(=O)c2nonc2N)c1OC(C)C,C40744459_decoy,TRY1,Decoy,0,-7.92167,-7.44,-1.24,-10.736774630721882
NC(=O)c1c(Nc2nc(NCC[NH2+]CCO)nc3c2cnn3-c2ccccc2)sc2c1CCCC2,C41026003_decoy,TRY1,Decoy,0,-11.3618,-7.34,-1.79,-7.912797991348247
O=C(NCCC[NH+]1CCCC1)c1ccc2c(c1)NC(=O)c1ccc(-c3cc[nH]c(=O)c3)cc1N2,C43009623_decoy,TRY1,Decoy,0,-8.5493,-8.43,-1.55,-8.317033097394766
CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NCCc1ccccn1,C52594645_decoy,TRY1,Decoy,0,-9.91668,-7.88,-3.67,-9.087084301795436
COc1ccc(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)cc1,C18098453_decoy,TRY1,Decoy,0,-8.83813,-7.79,-2.45,-8.213041679195562
Cc1ccc(C(=O)NCCC[NH+](CCO)CCO)cc1/N=C1/N[C@@H]2CS(=O)(=O)C[C@@H]2S1,C20354819_decoy,TRY1,Decoy,0,-9.42703,-5.89,-2.24,-6.362467222283044
Cc1cc(C)nc(/N=C(/NC(=S)NC[C@H]2CCCO2)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)n1,C14161219_decoy,TRY1,Decoy,0,-9.25712,-4.96,-2.09,-6.501182940813443
C[C@@H](NC(=O)CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)c1ccc(S(N)(=O)=O)cc1,C39933395_decoy,TRY1,Decoy,0,-9.5866,-5.94,-1.5,-5.9877928994785306
NC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1,C63258854_decoy,TRY1,Decoy,0,-8.03999,-8.64,-4.06,-7.727180910629405
CC(=O)Nc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@H]2Nc2ccc(S(N)(=O)=O)cc2)cc1,C39976443_decoy,TRY1,Decoy,0,-9.75655,-6.68,-2.96,-6.1892040325223565
COc1ccc2c(c1)=C(CCNC(=O)CC[C@@H]1NN[C@H](C(=O)Nc3ccccc3)S1)C[NH+]=2,C63686258_decoy,TRY1,Decoy,0,-9.41125,-7.92,-1.74,-6.944487983320282
COc1ccc2c(c1)=C(CCNC(=O)CC[C@H]1NN[C@@H](C(=O)Nc3ccccc3)S1)C[NH+]=2,C63686261_decoy,TRY1,Decoy,0,-8.9423,-7.29,-3.07,-6.297419442959948
O=C(C[C@H]1NO[C@@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1)Nc1ccccc1,C63782402_decoy,TRY1,Decoy,0,-9.42303,-8.11,-1.7,-7.169936579458071
O=C(C[C@@H]1NO[C@@H](C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)N1)Nc1ccccc1,C63782404_decoy,TRY1,Decoy,0,-7.55163,-8.18,-2.26,-6.945746129609596
CC1=NNNN1c1cccc(NC(=O)C(=O)NCCC2=c3cc(Cl)ccc3=[NH+]C2)c1,C63808003_decoy,TRY1,Decoy,0,-9.65808,-6.64,-2.25,-6.870819847600192
Nc1nc(N)nc(COC(=O)CCC2=c3cc(F)ccc3=[NH+][C@@H]2c2ccc(F)cc2)n1,C64150829_decoy,TRY1,Decoy,0,-8.85865,-8.74,-1.84,-8.104894805162644
NC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1,C64169694_decoy,TRY1,Decoy,0,-8.04574,-6.9,-1.18,-5.64407181374942
NC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1,C64169698_decoy,TRY1,Decoy,0,-8.31127,-6.46,-1.16,-6.087167638462854
NC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1,C64169701_decoy,TRY1,Decoy,0,-9.62155,-8.24,-3.28,-7.034127771002131
NC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1,C64169704_decoy,TRY1,Decoy,0,-7.94829,-6.96,-2.09,-6.2373235774951885