SMILES,Molecule Name,Target Name,Type,label,LF_score,GN_score,DD_score, RMSD_Energy
CCCCCN(C)CNCC(=O)[C@H](CC(=O)O)NC(=O)C(CC)n1cc(C(C)(C)C)nc(NCc2nonc2C)c1=O,CHEMBL180669_active,CASP3,Active,1,-9.58089,-8.44,-1.81,-8.810108914503434
CC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1cccc(NC(=O)[C@H](CC(=O)O)NC(C)=O)c1=O,CHEMBL178116_active,CASP3,Active,1,-11.3774,-7.07,-0.56,-15.068993309575571
COc1ccc(S(C)(=O)=O)cc1CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)C(C)C,CHEMBL425699_active,CASP3,Active,1,-12.0615,-8.17,-0.99,-12.022061690492514
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL433771_active,CASP3,Active,1,-10.6208,-8.21,-2.61,-9.725760386590633
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2cncs2)c1=O,CHEMBL180273_active,CASP3,Active,1,-11.6196,-7.96,-3.46,-12.846996353098726
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1CCc2ccccc2C1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL360788_active,CASP3,Active,1,-11.3242,-8.1,-1.3,-9.770661179052604
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CCCc1ccccc1)n1cc(C(C)(C)C)nc(NCc2nonc2C)c1=O,CHEMBL180623_active,CASP3,Active,1,-9.49201,-6.67,-2.23,-7.932801408789205
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CN[C@@H](C)c1ccccc1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL181274_active,CASP3,Active,1,-10.924,-8.71,-1.76,-9.24977253802249
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1Cc2ccccc2C1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL367356_active,CASP3,Active,1,-11.7071,-9.13,-1.66,-17.797297542937077
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCn2cncn2)c1=O,CHEMBL181948_active,CASP3,Active,1,-10.8248,-6.73,-1.43,-13.23780143082035
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1CCCCC1)n1cc(C(C)(C)C)nc(NCc2nonc2C)c1=O,CHEMBL434147_active,CASP3,Active,1,-10.8879,-8.19,-1.37,-15.428228997544206
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1C2CCC1CC2)n1ccnc(NCc2nonc2C)c1=O,CHEMBL178674_active,CASP3,Active,1,-11.2144,-7.92,-1.07,-10.352573698532115
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2nccs2)c1=O,CHEMBL181768_active,CASP3,Active,1,-10.7563,-7.82,-1.15,-15.90940190722441
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1CCCC1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL424789_active,CASP3,Active,1,-8.96444,-8.72,-1.8,-12.972791815971137
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2cccs2)c1=O,CHEMBL361613_active,CASP3,Active,1,-11.6332,-7.5,-1.33,-17.097748111012212
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2ccon2)c1=O,CHEMBL362191_active,CASP3,Active,1,-11.3198,-8.31,-2.56,-15.559175282430688
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2nc(C)no2)c1=O,CHEMBL360956_active,CASP3,Active,1,-10.7597,-8.25,-3.33,-10.953163563531453
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2cc(C)no2)c1=O,CHEMBL180763_active,CASP3,Active,1,-8.89957,-8.09,-1.67,-9.023273024579774
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCCc2nc(C)no2)c1=O,CHEMBL361983_active,CASP3,Active,1,-11.1014,-8.2,-2.42,-12.238812342523865
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)c1ncc(-c2ccccc2)o1)n1ccnc(NCc2nonc2C)c1=O,CHEMBL179066_active,CASP3,Active,1,-10.2005,-8.93,-2.75,-12.769229059293608
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCCOC)c1=O,CHEMBL359643_active,CASP3,Active,1,-10.0899,-6.89,-2.27,-10.667826072387284
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2noc(C)n2)c1=O,CHEMBL178280_active,CASP3,Active,1,-9.8413,-7.05,-1.55,-7.751098379585132
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCc2nc(C)no2)c1=O,CHEMBL360915_active,CASP3,Active,1,-11.3934,-6.93,-5.05,-8.670170637548718
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCn2cccn2)c1=O,CHEMBL447233_active,CASP3,Active,1,-8.54648,-7.03,-2.86,-6.72043530922925
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(Nc2ccc3sc(C)nc3c2)c1=O,CHEMBL181775_active,CASP3,Active,1,-9.15352,-7.75,-1.27,-7.479084257655391
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CNCN1CCOCC1)n1cc(C(C)(C)C)nc(NCc2nonc2C)c1=O,CHEMBL178775_active,CASP3,Active,1,-9.74853,-7.68,-2.83,-8.315719634011298
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCC2COc3ccccc3O2)c1=O,CHEMBL362213_active,CASP3,Active,1,-9.5442,-8.68,-1.79,-9.72158456862054
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCCCN2CCCC2=O)c1=O,CHEMBL182103_active,CASP3,Active,1,-8.59651,-7.25,-2.85,-7.867218190551256
O=C1C(=O)N(Cc2ccc(OCCF)cc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL213759_active,CASP3,Active,1,-8.03397,-5.34,-4.07,-5.428587235564628
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)n1ccnc(NCc2nnc(-c3ccccc3)o2)c1=O,CHEMBL220238_active,CASP3,Active,1,-6.28143,-8.52,-4.54,-8.144176274010945
O=C1C(=O)N(Cc2cn(CCF)nn2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccc(F)cc3F)cc21,CHEMBL456799_active,CASP3,Active,1,-7.76707,-7.46,-1.67,-6.8799166040074144
CC(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(C(=O)N[C@H]1CC(=O)OC1O)C(C)C,CHEMBL92780_active,CASP3,Active,1,-9.0577,-7.21,-2.65,-8.251585153718862
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2C,CHEMBL216819_active,CASP3,Active,1,-6.62319,-6.52,-0.39,-4.6663263720006505
O=C1C2=NCC3(CCC3)CN2c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL595807_active,CASP3,Active,1,-8.50586,-8.36,-1.93,-10.265159730908971
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2Cc1ccc(O[Si](C)(C)C(C)(C)C)cc1,CHEMBL387041_active,CASP3,Active,1,-8.60085,-7.19,-5.1,-7.388113622726383
CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C=O)CC(=O)O)C(C)C,CHEMBL417149_active,CASP3,Active,1,-8.67808,-7.89,-0.11,-17.010189556204555
CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)OCc1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL100588_active,CASP3,Active,1,-8.76171,-8.58,-0.36,-8.323284759057485
O=C1C(=O)N(Cc2ccc(F)cc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COC3CCOCC3)cc21,CHEMBL456593_active,CASP3,Active,1,-8.72961,-7.48,-1.73,-8.307016723990065
O=C1C2=NCC3(CCCC3)CN2c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL594384_active,CASP3,Active,1,-6.4515,-7.43,-3.48,-5.560877019801879
CN1C(=O)C(=O)c2cc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)ccc21,CHEMBL293034_active,CASP3,Active,1,-6.56207,-7.79,-0.61,-5.603716642868132
CC1(C)CN=C2C(=O)c3cc(S(=O)(=O)N4CCC[C@H]4COc4cccnc4)ccc3N2C1,CHEMBL606626_active,CASP3,Active,1,-8.33881,-6.17,-2.0,-6.296263767954892
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C1=NCC3(CCC3)CN12,CHEMBL603644_active,CASP3,Active,1,-7.674,-6.47,-0.88,-5.867064961809239
O=C1C(=O)N(Cc2ccc(Br)cc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3cccnc3)cc21,CHEMBL227036_active,CASP3,Active,1,-8.56862,-7.04,-2.39,-6.663854477186883
CC(C)CC(NC(=O)[C@H](CCC(=O)O)Oc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101545_active,CASP3,Active,1,-8.56365,-7.34,-1.66,-9.099013933850143
Cc1nc2ccc(S(=O)(=O)N3CCOCC3)cc2c2c1C(=O)N(c1c(C)nn(C)c1C)C2=O,CHEMBL360360_active,CASP3,Active,1,-7.455,-7.33,-2.5,-5.676937396162284
O=C1C(=O)N(Cc2ccncc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL300369_active,CASP3,Active,1,-7.38743,-6.52,-3.44,-6.164581025163229
CC1(C)CN=C2C(=O)c3cc(S(=O)(=O)N4CCC[C@H]4CN4CCOCC4)ccc3N2C1,CHEMBL593222_active,CASP3,Active,1,-8.74834,-7.1,-1.74,-6.747443566120359
CC(C)[C@H](OC(=O)Nc1cc(Cl)ccc1Cl)C(=O)NC(CC(=O)O)C(=O)CF,CHEMBL181241_active,CASP3,Active,1,-8.27889,-6.97,0.12,-7.194434312402831
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CCCc1ccccc1)n1cc(C(C)(C)C)nc(Nc2nnn[nH]2)c1=O,CHEMBL248508_active,CASP3,Active,1,-8.39145,-7.83,-2.16,-9.20998022951413
O=C1C(=O)N(CC2CCCCC2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL64895_active,CASP3,Active,1,-8.55599,-7.91,-2.35,-7.609993248978405
O=C1C(=O)N(Cc2ccc(F)cc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccncn3)cc21,CHEMBL515506_active,CASP3,Active,1,-8.54405,-7.13,-1.24,-6.280610926519871
O=C1C(=O)N(Cc2cccc(F)n2)c2ccc(S(=O)(=O)N3CC[C@H]3COc3ccccc3)cc21,CHEMBL371687_active,CASP3,Active,1,-7.19635,-7.6,-1.46,-7.001500425062627
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C1=NCC(C)(C)CN12,CHEMBL594873_active,CASP3,Active,1,-7.49061,-6.63,-1.71,-5.045813464102158
CCCCCCN(C)CC(=O)[C@H](CC(=O)O)NC(=O)C(CC)n1cc(C(C)(C)C)nc(Nc2nnn[nH]2)c1=O,CHEMBL248310_active,CASP3,Active,1,-9.43935,-7.96,-3.66,-7.857739644458701
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2Cc1ccc(C2CO2)cc1,CHEMBL523666_active,CASP3,Active,1,-8.20461,-6.7,-2.24,-8.295096955835554
CC1(C)CN=C2C(=O)c3cc(S(=O)(=O)N4CCC[C@H]4COc4ccccc4)ccc3N2C1,CHEMBL592983_active,CASP3,Active,1,-7.12416,-6.4,-3.06,-5.425036278026751
CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)COc1cccc2ccccc12,CHEMBL118738_active,CASP3,Active,1,-10.2176,-7.85,-1.36,-10.014475444210367
N#CC(C#N)=C1C(=O)N(Cc2ccccc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3cccnc3)cc21,CHEMBL226828_active,CASP3,Active,1,-9.15119,-5.18,-3.04,-6.474522900077662
CC1(C)CN=C2C(=O)c3cc(S(=O)(=O)N4CCC[C@H]4COc4ccccn4)ccc3N2C1,CHEMBL595814_active,CASP3,Active,1,-8.05176,-7.89,-1.87,-6.614221883006848
COc1ccc(CN2C(=O)C(=O)c3cc(S(=O)(=O)N4CC[C@H]4COc4ccccc4)ccc32)cc1,CHEMBL200813_active,CASP3,Active,1,-6.15805,-6.91,-1.77,-6.152584871968845
COc1ccc(-c2nc(C)no2)cc1CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1)C(C)C,CHEMBL360880_active,CASP3,Active,1,-8.39025,-7.67,-1.4,-7.856136854040042
O=C1C(=O)N(Cc2cccc(F)n2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL372994_active,CASP3,Active,1,-6.51936,-7.15,-1.9,-5.947469313663974
CC(C)C[C@H](NC(=O)C(=O)Nc1cccc2ccccc12)C(=O)N[C@H](C=O)CC(=O)O,CHEMBL90307_active,CASP3,Active,1,-7.74296,-8.16,-0.49,-11.020091015181208
O=C1C(=O)N(Cc2ccc(F)nc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL200653_active,CASP3,Active,1,-8.10762,-7.63,-1.03,-7.490306575086247
O=C1C(=O)N(Cc2ccc(F)nc2)c2ccc(S(=O)(=O)N3CC[C@H]3COc3ccccc3)cc21,CHEMBL370012_active,CASP3,Active,1,-6.54409,-7.59,-3.08,-6.644533216754819
CC(C)[C@H](OC(=O)Nc1ccc(Oc2ccccc2)cc1)C(=O)NC(CC(=O)O)C(=O)CF,CHEMBL181341_active,CASP3,Active,1,-7.9986,-7.21,-1.29,-6.645017575401256
O=C1C(=O)N(Cc2ccc(F)cc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COCc3cn(CCF)nn3)cc21,CHEMBL518382_active,CASP3,Active,1,-8.59311,-8.57,-1.89,-7.624823734034502
CC(C)CC(NC(=O)CNc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL322631_active,CASP3,Active,1,-8.27431,-7.91,-1.07,-8.135523647266414
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C1=NCC3(CCCCC3)CN12,CHEMBL604054_active,CASP3,Active,1,-7.6917,-7.38,-1.99,-8.44546112913443
CCOC(=O)N1CCN(C[C@@H]2CCCN2S(=O)(=O)c2ccc3c(c2)C(=O)C2=NCC(C)(C)CN23)CC1,CHEMBL593223_active,CASP3,Active,1,-7.25799,-7.97,-2.06,-6.329849144024041
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C1=NCC3(CCCC3)CN12,CHEMBL595778_active,CASP3,Active,1,-8.3448,-6.37,-0.17,-9.968346988663932
Cc1ccccc1N1C(=O)c2c(C)nc3ccc(S(=O)(=O)N4CCOCC4)cc3c2C1=O,CHEMBL183437_active,CASP3,Active,1,-6.99881,-7.44,-2.98,-5.5392618583846
CC(=O)N1N=C(c2cc(F)ccc2F)C[C@H]1c1cccc(O)c1,CHEMBL195232_active,CASP3,Active,1,-6.57939,-7.31,-1.83,-5.77796643814566
COC(=O)CN1C(=O)c2c(C)nc3ccc(S(=O)(=O)N4CCOCC4)cc3c2C1=O,CHEMBL183151_active,CASP3,Active,1,-7.45665,-6.25,-2.12,-5.561018314156747
Cc1nc2ccc(C#N)cc2c2c1C(=O)N(c1c(C)nn(C)c1C)C2=O,CHEMBL359879_active,CASP3,Active,1,-7.73968,-6.71,-1.19,-5.018257776040423
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2C[C@H]1CO1,CHEMBL513297_active,CASP3,Active,1,-6.79279,-6.27,-1.55,-6.026609419578485
CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1CCC[C@H]2SC[C@@H](C(=O)N[C@H]3CC(=O)OC3O)N2C1=O,CHEMBL329917_active,CASP3,Active,1,-9.46593,-8.28,-0.98,-12.330771075650503
O=C[C@H](CC(=O)O)NC(=O)c1cnc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)nc1,CHEMBL144423_active,CASP3,Active,1,-9.71467,-7.25,-2.06,-10.463134452678837
O=C(O)C[C@H](NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)s1)C(=O)CSCc1cccnc1,CHEMBL357676_active,CASP3,Active,1,-9.78785,-7.06,-1.87,-6.500189383590024
CC(C)[C@H](OC(=O)Nc1ccccc1)C(=O)NC(CC(=O)O)C(=O)COC(=O)c1c(Cl)cccc1Cl,CHEMBL181976_active,CASP3,Active,1,-9.75267,-8.28,-1.16,-9.664517081615562
O=C1Nc2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccncc3)cc2C1=O,CHEMBL197237_active,CASP3,Active,1,-6.36101,-5.91,-2.02,-5.167271829895386
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc2nc(C)c3c(c2c1)C(=O)N(c1c(C)nn(C)c1C)C3=O,CHEMBL362007_active,CASP3,Active,1,-8.82609,-6.03,-1.47,-6.103806025898472
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2CCCCCCCCCC1CO1,CHEMBL521984_active,CASP3,Active,1,-8.62262,-6.48,-2.36,-6.629383389479279
CN1C(=O)C(=O)c2cc(S(=O)(=O)N3CCC[C@H]3COc3cccnc3)ccc21,CHEMBL371879_active,CASP3,Active,1,-6.98251,-7.16,-0.64,-5.96144202142226
O=C1C2=NCC3(CCCCC3)CN2c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL595802_active,CASP3,Active,1,-7.6265,-8.15,-4.13,-4.868070013499836
O=C(CCC(=O)N1CCCCC1)Nc1ccc2c(c1)C(=O)C(=O)NC2=O,CHEMBL438969_active,CASP3,Active,1,-7.29734,-6.65,-1.6,-5.805140470034042
CC(=O)OCCN1C(=O)c2c(-c3ccccc3)nc3ccc(S(=O)(=O)N4CCOCC4)cc3c2C1=O,CHEMBL193674_active,CASP3,Active,1,-6.41832,-8.31,-2.03,-5.761893203632681
N#CC(C#N)=C1C(=O)N(Cc2ccccc2)c2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc21,CHEMBL226779_active,CASP3,Active,1,-8.63929,-6.66,-2.69,-6.532560411751101
O=C1C(=O)N(Cc2ccnc(F)c2)c2ccc(S(=O)(=O)N3CC[C@H]3COc3ccccc3)cc21,CHEMBL196855_active,CASP3,Active,1,-7.71671,-7.64,-1.92,-6.4237703264831705
O=C(O)C[C@H](NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)s1)C(=O)CSCc1ccncc1,CHEMBL357214_active,CASP3,Active,1,-10.7081,-7.28,-2.54,-9.501862797894283
CC(C)[C@H](NC(=O)OCC1CCCC1)C(=O)NC(CC(=O)O)C(=O)CF,CHEMBL363509_active,CASP3,Active,1,-7.56537,-6.6,-1.31,-6.965063406301129
O=C1Nc2ccc(S(=O)(=O)N3CCCC3CNc3ccccc3)cc2C1=O,CHEMBL59721_active,CASP3,Active,1,-7.94117,-6.53,-0.76,-6.2068511525052665
CC(=O)OCCN1C(=O)c2c(-c3cccnc3)nc3ccc(S(=O)(=O)N4CCOCC4)cc3c2C1=O,CHEMBL191944_active,CASP3,Active,1,-8.42061,-8.12,-1.19,-6.904614083832948
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1C(=O)NC(C(=O)O)C(=O)CF,CHEMBL237310_active,CASP3,Active,1,-7.46322,-7.3,-3.46,-6.753478627124278
CC(=O)OCCN1C(=O)c2c(-c3ccco3)nc3ccc(S(=O)(=O)N4CCOCC4)cc3c2C1=O,CHEMBL370952_active,CASP3,Active,1,-8.10804,-7.91,-0.79,-6.591653278326274
CC(=O)OC(C(=O)Nc1cccc2c1C(=O)C(=O)NC2=O)c1ccccc1,CHEMBL439872_active,CASP3,Active,1,-7.57402,-6.42,-3.21,-5.580455042768923
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2Cc1ccc(OCC2CO2)cc1,CHEMBL494220_active,CASP3,Active,1,-7.67202,-8.03,-2.47,-7.825769275204154
C=CCNC(=O)CCC(=O)Nc1ccc2c(c1)C(=O)C(=O)NC2=O,CHEMBL203900_active,CASP3,Active,1,-8.48782,-6.81,-1.0,-6.499210096024114
O=C1Nc2ccc(S(=O)(=O)N3CCCC3CSc3ccccc3)cc2C1=O,CHEMBL63493_active,CASP3,Active,1,-8.33743,-6.51,-1.46,-6.895578147209965
O=C[C@H](CC(=O)O)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)nc1,CHEMBL358725_active,CASP3,Active,1,-7.63579,-8.06,-1.85,-10.180715050488905
O=C(O)CC(NC(=O)[C@@H](OC(=O)Nc1ccccc1)C1CCCCC1)C(=O)CF,CHEMBL361757_active,CASP3,Active,1,-8.87626,-6.81,-0.36,-7.526636765190901
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CCCc1ccccc1)n1cc(C(C)(C)C)nc(NCCc2cccs2)c1=O,CHEMBL392245_active,CASP3,Active,1,-8.54607,-7.6,-4.31,-9.48706547294342
O=C1NC(=O)c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1=O,CHEMBL203971_active,CASP3,Active,1,-7.06212,-7.14,-1.09,-6.861183379765942
O=C1NC(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2C1=O,CHEMBL377940_active,CASP3,Active,1,-7.79926,-6.73,-1.45,-6.175853625505147
CCOc1cccc(NC(=O)CCC(=O)Nc2ccc3c(c2)C(=O)C(=O)NC3=O)c1,CHEMBL204529_active,CASP3,Active,1,-9.46805,-6.57,-0.89,-6.755033888218591
Cc1nc2ccc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)cc2c2c1C(=O)N(c1c(C)nn(C)c1C)C2=O,CHEMBL182541_active,CASP3,Active,1,-8.00023,-6.43,-5.05,-6.873449313052303
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2CCCCOS(=O)(=O)c1ccc(C)cc1,CHEMBL492518_active,CASP3,Active,1,-6.70852,-7.44,-2.11,-5.540824447981944
CC(C)C[C@H](NC(=O)CCOc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL102901_active,CASP3,Active,1,-9.01737,-8.06,-0.89,-8.10240893169852
CC1(C)CN=C2C(=O)c3cc(S(=O)(=O)N4CCC[C@H]4CNC4CCCCC4)ccc3N2C1,CHEMBL595576_active,CASP3,Active,1,-9.13211,-7.97,-2.04,-7.455187675795213
COc1ccc(OC)c(CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)CSCC2CCCCC2)C(C)C)c1,CHEMBL353919_active,CASP3,Active,1,-10.7063,-7.84,-1.38,-15.500529992664086
O=C(CCC(=O)Nc1ccc2c(c1)C(=O)C(=O)NC2=O)NCc1ccccc1,CHEMBL380344_active,CASP3,Active,1,-8.30471,-7.09,-1.38,-7.683213315990693
O=C[C@H](CC(=O)O)NC(=O)c1cnc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)s1,CHEMBL146130_active,CASP3,Active,1,-8.6959,-6.1,-0.88,-5.693482831158133
CC(C)[C@H](OC(=O)Nc1ccccc1)C(=O)NC(CC(=O)O)C(=O)COc1cc(C(F)(F)F)nn1-c1ccccc1,CHEMBL178819_active,CASP3,Active,1,-8.71978,-8.28,-1.51,-10.583228216539586
CC[C@H](C)[C@@H](C(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)N[C@H](C=O)C(=O)O)C3)N(C)C(C)=O,CHEMBL304368_active,CASP3,Active,1,-8.61124,-8.57,-0.79,-16.148952210871784
CC(C)[C@H](NC(=O)c1cc2cc(F)ccc2[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1,CHEMBL168816_active,CASP3,Active,1,-9.49758,-7.73,-1.25,-10.043445153938828
CN(Cc1ccc(O)c(C(=O)O)c1)Cc1ccc(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc2ccccc2Cl)s1,CHEMBL357191_active,CASP3,Active,1,-10.606,-8.46,-3.52,-8.262619319737412
CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)COc1ccc2ccccc2c1,CHEMBL116661_active,CASP3,Active,1,-10.9957,-7.45,-1.85,-10.22576082392956
CN1C(=O)C(=O)c2cc(S(=O)(=O)N3CC[C@H]3COc3ccccc3)ccc21,CHEMBL371709_active,CASP3,Active,1,-6.62452,-6.11,-0.66,-3.906752049021768
CC(C)C[C@H](NC(=O)COc1ccccc1-c1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL99681_active,CASP3,Active,1,-8.12778,-7.99,-1.6,-7.211393722200401
O=C(O)CC(NC(=O)[C@@H](NC(=O)OCc1ccccc1)C1CCCCC1)C(=O)CF,CHEMBL23493_active,CASP3,Active,1,-8.14829,-6.6,-0.97,-7.515193827554281
O=C(O)CC(NC(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1)C(=O)CF,CHEMBL23816_active,CASP3,Active,1,-6.51775,-7.42,-0.32,-7.085132210967208
CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)COc1ccc(-c2ccccc2)cc1,CHEMBL331689_active,CASP3,Active,1,-9.74717,-7.46,-2.63,-7.6177112234784605
O=C(O)CN(C(=O)CF)C(=O)[C@H]1CCN1C(=O)OCc1ccccc1,CHEMBL237308_active,CASP3,Active,1,-4.65838,-4.77,-0.05,-4.573089050988727
O=C(O)CC(NC(=O)c1sccc1NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL237088_active,CASP3,Active,1,-9.63977,-6.36,-0.83,-7.583461154073278
CCC(C(=O)N[C@@H](CC(=O)O)C(=O)CCCc1ccccc1)n1cc(C(C)(C)C)nc(NC(CC(C)C)C(=O)O)c1=O,CHEMBL396625_active,CASP3,Active,1,-9.38934,-6.72,-4.0,-9.808225430765214
O=C1C(=O)N(Cc2ccccc2)c2ccc(S(=O)(=O)N3CCC3)cc21,CHEMBL476022_active,CASP3,Active,1,-5.53572,-7.46,-0.94,-7.639132228819449
CN1C(=O)C(=C(C#N)C#N)c2cc(S(=O)(=O)N3CCC[C@H]3COc3ccccc3)ccc21,CHEMBL390932_active,CASP3,Active,1,-7.85165,-8.66,-3.32,-7.122638469273045
O=C[C@H](CC(=O)O)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)s1,CHEMBL147642_active,CASP3,Active,1,-8.81365,-7.54,-1.34,-7.88193932531665
CC(C)CN(CC(C)C)C(=O)c1cncc(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc2ccc(F)cc2)c1,CHEMBL308465_active,CASP3,Active,1,-10.7892,-7.37,-2.11,-9.27540791452531
O=C(O)C[C@H](NC(=O)c1cncc(S(=O)(=O)NC2CC2)c1)C(=O)COC(=O)c1cccc2ccccc12,CHEMBL68251_active,CASP3,Active,1,-9.5104,-8.65,-1.19,-9.350803187058029
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101835_active,CASP3,Active,1,-7.41554,-7.3,-0.79,-6.935071952839158
CC(C)C[C@H](NC(=O)COc1cccc2cccnc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101341_active,CASP3,Active,1,-8.87523,-7.65,-1.21,-8.577815710156573
CC1(C)CN=C2C(=O)c3cc(NS(=O)(=O)c4ccccc4F)ccc3N2C1,CHEMBL609885_active,CASP3,Active,1,-8.46867,-7.9,-1.2,-7.172548558269302
O=C(O)CC(NC(=O)[C@H](Cc1cccs1)NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL282508_active,CASP3,Active,1,-8.38059,-7.07,-1.38,-6.885491304144512
COC[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2CCC1CO1,CHEMBL493374_active,CASP3,Active,1,-7.25099,-6.22,-2.13,-7.816168991006608
O=C[C@H](CC(=O)O)NC(=O)c1cc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)on1,CHEMBL357833_active,CASP3,Active,1,-7.78714,-7.8,-1.49,-7.617527403317413
CC(C)[C@H](NC(=O)C1(O)CC1)C(=O)N[C@@H](CC(=O)O)C(=O)CSCc1ccccc1,CHEMBL359479_active,CASP3,Active,1,-9.10201,-6.83,-2.42,-9.078638343206016
CC(C)C[C@H](NC(=O)COc1ccc2c(c1)CCCC2)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL321546_active,CASP3,Active,1,-9.03022,-7.86,-0.03,-7.2868958549525376
O=C1Nc2ccc(S(=O)(=O)N3CCC3)cc2C1=O,CHEMBL64789_active,CASP3,Active,1,-6.23339,-5.67,-0.9,-5.0469157647443
O=C1NC(=O)c2cccc(NC(=O)C3CC3)c2C1=O,CHEMBL380416_active,CASP3,Active,1,-7.08179,-6.13,-0.71,-5.501996936363387
CC(C)C[C@H](NC(=O)CSc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL318312_active,CASP3,Active,1,-7.606,-7.22,-1.12,-6.784567755338594
CC(C)C[C@H](NC(=O)COc1ccccc1C1CCCC1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL321074_active,CASP3,Active,1,-9.37969,-7.4,-0.8,-8.013846940651224
O=C[C@H](CC(=O)O)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)cc1,CHEMBL422849_active,CASP3,Active,1,-8.4518,-7.3,-0.92,-7.059820029656624
O=C(O)CC(NC(=O)c1ccccc1NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL391494_active,CASP3,Active,1,-6.24424,-7.61,-1.1,-6.823627863265972
O=C(O)CC(NC(=O)[C@H]1CCC[C@H]1NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL429632_active,CASP3,Active,1,-7.92174,-5.38,-1.27,-7.221062162684308
C=CCc1cccc(/C=N/NC(=O)CN2CCN(Cc3ccccc3)CC2)c1O,CHEMBL591429_active,CASP3,Active,1,-8.8066,-6.47,-3.98,-6.16508220144388
CC(C)C[C@H](NC(=O)COc1ccccc1OCc1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101141_active,CASP3,Active,1,-6.7528,-7.65,-1.09,-5.985544765752314
CC(C)CC(NC(=O)CNc1cccc(Oc2ccccc2)c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101182_active,CASP3,Active,1,-9.51943,-7.71,-0.47,-7.5129695094868065
CC(C)C[C@H](NC(=O)COc1ccnc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL100927_active,CASP3,Active,1,-8.80037,-8.22,-1.23,-8.867056148352367
O=C(O)C[C@H](NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)s1)C(=O)CCCc1ccccc1,CHEMBL148295_active,CASP3,Active,1,-10.4609,-8.92,-1.56,-10.887555592474488
FC(F)(F)c1ccc(-c2noc(-c3sccc3Cl)n2)cn1,CHEMBL191484_active,CASP3,Active,1,-6.9207,-5.52,-0.65,-3.900577178528408
O=C1C(=O)N(Cc2ccccc2)c2ccc([N+](=O)[O-])cc21,CHEMBL60306_active,CASP3,Active,1,-4.97582,-5.46,-1.12,-4.900597141142164
O=C(O)CC(NC(=O)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL391709_active,CASP3,Active,1,-7.57101,-6.54,-0.98,-6.8876058270376985
O=C1NC(=O)c2cc(NC(=O)c3ccccc3)ccc2C1=O,CHEMBL206606_active,CASP3,Active,1,-7.26291,-6.55,-2.69,-4.455005803589795
CC(C)C[C@H](NC(=O)CSc1ccc2ccccc2c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL329940_active,CASP3,Active,1,-8.21833,-7.54,-1.23,-8.087050314246087
CN(C1CC1)S(=O)(=O)c1cncc(C(=O)N[C@@H](CC(=O)O)C(=O)CSCc2ccc(F)cc2)c1,CHEMBL303405_active,CASP3,Active,1,-10.495,-7.58,-1.32,-9.683817176976854
O=C1NC(=O)c2ccc(NC(=O)C3CCCCC3)cc2C1=O,CHEMBL205563_active,CASP3,Active,1,-8.75253,-5.9,-2.41,-5.688558854634279
FC(F)(F)c1cccc(-c2noc(-c3sccc3Cl)n2)c1,CHEMBL365384_active,CASP3,Active,1,-7.68731,-6.9,-0.58,-5.647512900164091
CC(C)C[C@H](NC(=O)COc1cccc(-c2ccccc2)c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL99680_active,CASP3,Active,1,-7.51232,-7.92,-0.69,-7.359376242261595
CC(C)C[C@H](NC(=O)COc1ccc(C2CCCC2)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL99999_active,CASP3,Active,1,-9.62335,-7.11,-1.43,-8.06263919326357
CC(C)CC(NC(=O)CNCC(Cc1ccccc1)c1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101622_active,CASP3,Active,1,-9.17105,-8.82,-1.34,-10.6120577560361
N#CC(C#N)=C1C(=O)N(Cc2ccccc2)c2ccc(S(=O)(=O)N3CCC3)cc21,CHEMBL516251_active,CASP3,Active,1,-8.13367,-6.29,-1.99,-5.841799638869055
CC(C)C[C@H](NC(=O)COc1cccc2c1CCCC2)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL318035_active,CASP3,Active,1,-8.70077,-7.26,-1.25,-7.232013407178282
O=C1C(=O)N(Cc2ccccc2)C(=O)c2ccccc21,CHEMBL382859_active,CASP3,Active,1,-5.31219,-6.88,-1.56,-5.474221846367465
O=C(O)C[C@H](NC(=O)c1cncc(S(=O)(=O)NCc2ccccc2)c1)C(=O)CSCc1ccc(F)cc1,CHEMBL420366_active,CASP3,Active,1,-10.431,-7.53,-2.23,-8.938044696603255
CC(C)C[C@H](NC(=O)COc1ccc(Cc2ccccc2)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL322183_active,CASP3,Active,1,-8.19652,-6.76,-1.57,-7.089550129142018
O=C(O)C[C@H](NC(=O)c1cncc(S(=O)(=O)NC2CC2)c1)C(=O)Oc1ccccc1,CHEMBL302972_active,CASP3,Active,1,-8.88742,-8.01,-1.16,-7.721185542125556
Clc1ccc(-c2noc(-c3sccc3Cl)n2)nc1,CHEMBL361702_active,CASP3,Active,1,-7.01865,-4.94,-0.86,-3.7055198455847824
O=C(O)CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF,CHEMBL22597_active,CASP3,Active,1,-8.0673,-6.96,-0.79,-7.026048335091168
O=C[C@H](CC(=O)O)NC(=O)c1ccc(CNS(=O)(=O)c2cccc(-c3noc(O)n3)c2)nc1,CHEMBL149663_active,CASP3,Active,1,-8.13531,-8.67,-1.88,-7.793763906256929
CC(C)C(NC(=O)COc1ccc2ccccc2c1C(=O)O)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL327298_active,CASP3,Active,1,-9.802,-7.86,-1.84,-8.333135049812583
CC(C)C[C@H](NC(=O)COc1cccc2cnccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101684_active,CASP3,Active,1,-9.06999,-8.28,-0.7,-8.793904709588807
O=C(O)C[C@H](NC(=O)c1ccc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)nc1)C(=O)c1nc2ccccc2o1,CHEMBL147622_active,CASP3,Active,1,-7.43869,-9.12,-2.42,-6.628307002389271
O=C(O)CN(C(=O)CF)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1,CHEMBL393200_active,CASP3,Active,1,-6.02951,-6.97,-1.23,-6.579782362977599
CC(C)C[C@H](NC(=O)CCSc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL316465_active,CASP3,Active,1,-8.77221,-8.75,-1.21,-14.812516834982356
CC(C)C[C@H](NC(=O)COc1cccc2ncccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL318295_active,CASP3,Active,1,-9.01251,-7.75,-0.47,-8.337161696334018
CC(C)C[C@H](NC(=O)CCOc1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101714_active,CASP3,Active,1,-6.59698,-7.6,-0.52,-7.271254559460753
O=C[C@H](CC(=O)O)NC(=O)c1ccc(CNS(=O)(=O)c2cccc(-c3nn[nH]n3)c2)nc1,CHEMBL149551_active,CASP3,Active,1,-9.11322,-8.13,-1.88,-8.175879071581294
COC(=O)CN1C(=O)c2c(C)nc3ccc(Br)cc3c2C1=O,CHEMBL180385_active,CASP3,Active,1,-6.83188,-6.23,-1.42,-4.355945669851785
Cc1ccc(OCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CC(=O)OC2O)c(C23CC4CC(CC(C4)C2)C3)c1,CHEMBL319554_active,CASP3,Active,1,-9.37919,-9.04,-1.6,-8.992210706931365
O=C[C@H](CC(=O)O)NC(=O)c1cnc(CNS(=O)(=O)c2ccc(O)c(C(=O)O)c2)cn1,CHEMBL148337_active,CASP3,Active,1,-8.23865,-6.56,-1.23,-6.8518478614627005
FC(F)(F)c1ccc(-c2noc(-c3occc3Cl)n2)cc1,CHEMBL190297_active,CASP3,Active,1,-5.78338,-5.4,-0.65,-5.845864140490174
CC(C)C[C@H](NC(=O)COc1ccccc1Cc1ccccc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL102005_active,CASP3,Active,1,-8.38628,-7.12,-2.38,-7.664768076418588
O=C(O)C[C@H](NC(=O)c1cncc(S(=O)(=O)NC2CC2)c1)C(=O)CNCc1c(F)cccc1F,CHEMBL68379_active,CASP3,Active,1,-9.52433,-7.57,-0.99,-8.824971192519849
CC(C)C[C@H](NC(=O)COc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL418983_active,CASP3,Active,1,-8.16168,-8.13,-1.01,-6.202817954434913
N#CC(C#N)=C1C(=O)N(Cc2ccc(Cl)c(Cl)c2)c2ccc(S(=O)(=O)N3CCCCC3)cc21,CHEMBL492059_active,CASP3,Active,1,-10.1484,-7.03,-1.37,-7.287416501341718
O=C1C(=O)N(CCc2ccccc2)C(=O)c2ccccc21,CHEMBL382860_active,CASP3,Active,1,-5.1841,-6.92,-2.35,-4.926002978875439
CC(C)C[C@H](NC(=O)COc1ccc(Oc2ccccc2)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL102154_active,CASP3,Active,1,-7.96611,-6.78,-1.44,-9.217866098432422
CC(C)C[C@H](NC(=O)COc1ccc(OCc2ccccc2)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL100788_active,CASP3,Active,1,-9.17164,-7.57,-1.29,-7.40350256299111
Clc1ccc(-c2noc(-c3occc3Cl)n2)nc1,CHEMBL365420_active,CASP3,Active,1,-7.15497,-5.22,-3.28,-4.555561792252784
CN1C(=O)C(=O)c2cc(C#N)ccc21,CHEMBL64584_active,CASP3,Active,1,-5.19816,-5.02,-0.49,-2.9878180233472555
N#CC(C#N)=C1C(=O)N(Cc2ccccc2)c2ccc(S(=O)(=O)N3CCCC3)cc21,CHEMBL477047_active,CASP3,Active,1,-8.46593,-7.06,-1.37,-6.691920242918092
O=C(Nc1cccc2c1C(=O)C(=O)NC2=O)OCc1ccccc1,CHEMBL205083_active,CASP3,Active,1,-7.05902,-7.54,-1.16,-6.906469829137315
CC(C)C[C@H](NC(=O)COc1ccc(-c2ccccc2)cc1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101442_active,CASP3,Active,1,-6.34589,-8.32,-1.54,-10.360851695418145
CC(C)C[C@H](NC(=O)CCSc1ccc2ccccc2c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101728_active,CASP3,Active,1,-7.70351,-8.5,-1.07,-12.714776708607426
CC(C)C[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL101108_active,CASP3,Active,1,-8.61255,-8.18,0.01,-8.025939028644373
CC(C)C[C@H](NC(=O)Cc1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL318791_active,CASP3,Active,1,-8.7423,-8.22,-1.26,-8.676554841202154
CC(C)C[C@H](NC(=O)CCOc1ccc2ccccc2c1)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL100802_active,CASP3,Active,1,-6.32664,-8.4,-0.57,-7.3835319599589315
CC(C)C[C@H](NC(=O)CC(=O)c1cccc2ccccc12)C(=O)N[C@H]1CC(=O)OC1O,CHEMBL318887_active,CASP3,Active,1,-7.72325,-7.79,-1.43,-7.412492994272268
CCCNS(=O)(=O)c1cc(C(=O)N2CC[NH+](C)CC2)ccc1N1CCCC1,C10009916_decoy,CASP3,Decoy,0,-7.2237,-7.16,-1.61,-6.617738914871655
Cc1cc(C(=O)NCc2nnc3n2CC[NH+](C[C@H]2CC=CCC2)CC3)c(C)o1,C11872294_decoy,CASP3,Decoy,0,-6.51973,-6.99,-4.61,-4.61493304319967
CCc1ccc(C[NH+]2CCc3nnc([C@@H](C)NC(=O)C4CC4)n3CC2)o1,C12098797_decoy,CASP3,Decoy,0,-7.78018,-6.4,-1.9,-6.311894182911141
Fc1ccc(-c2cnnc(NC[C@H](c3cccnc3)[NH+]3CCOCC3)n2)cc1,C12304600_decoy,CASP3,Decoy,0,-7.46068,-6.5,-0.54,-6.464310622496935
COc1cc2c(cc1OC)C[NH+](CC(=O)N[C@]1(C)CCS(=O)(=O)C1)CC2,C12734317_decoy,CASP3,Decoy,0,-5.49629,-5.42,-0.79,-4.376733496352246
CC[NH+]1CCC[C@H]1CNC(=O)Cn1ncc2c3ccccc3n(C)c2c1=O,C04915847_decoy,CASP3,Decoy,0,-6.76012,-6.83,-0.83,-6.361657671424608
CN(C)S(=O)(=O)NC[C@@H]1CCC[NH+](Cc2nc3ccccc3n2C)C1,C12305224_decoy,CASP3,Decoy,0,-6.91209,-6.71,-1.11,-6.552698529044833
CC(=O)N1CCN(c2ncccc2C[NH2+]Cc2cnn(-c3ccccc3F)c2)CC1,C20915836_decoy,CASP3,Decoy,0,-7.3594,-6.67,-1.82,-5.998881107901881
Cc1ccccc1[C@@H](C(=O)N1CCC(n2cc(CO)nn2)CC1)[NH+](C)C,C23505401_decoy,CASP3,Decoy,0,-7.56376,-4.81,-1.12,-6.485541810620345
CS(=O)(=O)Nc1ccc(/C=C/C(=O)N2CCN(c3cc[nH+]cc3)CC2)cc1,C23629296_decoy,CASP3,Decoy,0,-7.99385,-6.09,-1.77,-7.84579897240136
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CC[NH+](CC(=O)N3CCCCC3)CC2)c1C,C27377529_decoy,CASP3,Decoy,0,-7.91015,-6.57,-0.7,-5.445202131353435
CCn1cc(C(=O)NC[C@H](c2cccn2C)[NH+](C)C)c(=O)c2ccc(C)nc21,C38674739_decoy,CASP3,Decoy,0,-5.99522,-6.68,-1.82,-5.254098998317738
CCn1cc(C(=O)NC[C@@H](c2cccn2C)[NH+]2CCCC2)c(=O)c2ccc(C)nc21,C38675237_decoy,CASP3,Decoy,0,-7.63583,-6.31,-2.24,-7.368766991603481
C[NH+](C)C(C)(C)CNC(=O)c1cc(C2CC2)n([C@H]2CCS(=O)(=O)C2)n1,C40654629_decoy,CASP3,Decoy,0,-8.33107,-6.06,-4.23,-6.30636565209009
C[NH+](C)CCNC(=O)[C@@H]1CN(S(C)(=O)=O)c2cc(Cl)ccc2O1,C44910146_decoy,CASP3,Decoy,0,-7.52542,-5.86,-0.86,-5.942665646930327
Cc1ccc(C(=O)N2CCN(C(=O)N[C@@H](C)Cn3cc[nH+]c3)CC2)cc1,C47028427_decoy,CASP3,Decoy,0,-5.40681,-6.34,-0.98,-4.756406010814175
Cc1nn(C)cc1-c1ccnc(NC2CC[NH+](Cc3ccncc3)CC2)n1,C48187659_decoy,CASP3,Decoy,0,-6.64242,-6.1,-1.49,-4.49333849528346
Cc1cc(C)n2c(n1)nc(=S)n2C[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C50900553_decoy,CASP3,Decoy,0,-7.45542,-5.3,-0.77,-5.828007442060911
C=CCn1c(C)nn(C[NH+]2CCC(NC(=O)c3scnc3C)CC2)c1=S,C50924593_decoy,CASP3,Decoy,0,-7.75499,-5.08,-1.86,-4.987638084031571
CCCCNC(=O)[C@@H]1CCC[NH+]([C@@H](C)C(=O)N2CCN(C(C)=O)CC2)C1,C51058954_decoy,CASP3,Decoy,0,-6.43678,-5.74,-2.45,-6.074839479460548
C[C@H](c1ccc2c(c1)OCCO2)N(C)Cc1nnc(CC2CC[NH2+]CC2)n1C,C55072711_decoy,CASP3,Decoy,0,-7.89865,-7.56,-2.0,-6.661799704417828
C[C@H]1CCCN(C(=O)C2CC[NH+](CC(=O)N(C)CC(=O)NC3CC3)CC2)C1,C48046447_decoy,CASP3,Decoy,0,-7.14802,-6.81,-1.27,-6.367139888788228
C[C@H]1CCCCN1C(=O)CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O,C63775658_decoy,CASP3,Decoy,0,-6.57638,-7.55,-1.17,-5.994801444303603
CC1=NC(c2ccccn2)=NC(=O)[C@H]1CC(=O)Nc1ccc2c(c1)=C[C@@H](C)[NH+]=2,C64110785_decoy,CASP3,Decoy,0,-7.73347,-6.52,-1.56,-6.0773867771727215
Cc1ccc2c(c1)=C[C@H]([C@@H]1NC(CCN(C)C(=O)[C@@H]3CCCO3)=NO1)[NH+]=2,C64678548_decoy,CASP3,Decoy,0,-6.50386,-7.29,-1.02,-5.096204344627819
CC1(C)CC(=O)c2cnc3c(C(=O)NCC[NH+]4CCCC4)cnn3c2C1,C64987473_decoy,CASP3,Decoy,0,-6.948,-6.61,-0.09,-4.697825445402306
CCCCNC(=O)[C@@H]1CCC[NH+](CC(=O)N2CCC3(CC2)OCCO3)C1,C65253144_decoy,CASP3,Decoy,0,-7.8926,-7.49,-1.04,-6.997949710019178
CC(=O)N1CCC(n2c(C)nc(C(=O)NCC[NH+]3CCCCC3)c2C)CC1,C65257371_decoy,CASP3,Decoy,0,-6.7376,-7.19,-1.62,-5.45539104762589
CC(C)S(=O)(=O)NC[C@H]1CCC[NH+](CC(=O)N2CCO[C@H](C)C2)C1,C51101266_decoy,CASP3,Decoy,0,-7.31096,-4.79,-0.44,-5.930031973772948
Cn1ncc(N2CCC[C@H](C(=O)NCCC[NH+]3CCCCC3)C2)cc1=O,C65313903_decoy,CASP3,Decoy,0,-6.83156,-6.33,-0.45,-6.518865301814848
CS(=O)(=O)N1CCO[C@@H](C[NH2+]CCC(=O)N2CCCc3ccccc32)C1,C65527276_decoy,CASP3,Decoy,0,-6.33468,-7.15,-1.9,-5.194254319412348
C[C@H]1C[C@H](C)CN(S(=O)(=O)N2CCC(C(=O)NCC[NH+](C)C)CC2)C1,C65974663_decoy,CASP3,Decoy,0,-7.05636,-5.7,-2.08,-5.374043304466477
Cn1cc([C@@H]2C[C@H]2C(=O)NCc2ccc(N3CC[NH+](C)CC3)nc2)cn1,C66043191_decoy,CASP3,Decoy,0,-8.1621,-5.56,-0.46,-5.313846781747371
CSc1cc2c(cc1NC(=O)C(=O)N1CC[C@@H]([NH+]3CCCC3)C1)OCCO2,C66222607_decoy,CASP3,Decoy,0,-8.84631,-6.48,-1.56,-5.7333108210823625
CC[NH+]1CCN(C(=O)CC2CCN(C(=O)c3ccc(NC4CC4)nc3)CC2)CC1,C66445289_decoy,CASP3,Decoy,0,-7.48998,-6.29,-2.22,-5.1540211059936425
CC[NH+](C)Cc1cccc(CNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c1,C66447493_decoy,CASP3,Decoy,0,-8.10921,-6.19,-1.29,-5.203842665267705
C[C@@H]1CN(C2CC[NH+](CC(=O)NC3CCC4(CC3)OCCO4)CC2)CCO1,C66561919_decoy,CASP3,Decoy,0,-8.69292,-6.4,-3.19,-6.088245886642399
Cc1occc1C(=O)NC1CC[NH+](Cn2c(=O)oc3ccccc32)CC1,C66795783_decoy,CASP3,Decoy,0,-6.25475,-6.1,-0.71,-4.991292596194495
Cn1c(C[NH+]2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)nnc1C1CC1,C66831210_decoy,CASP3,Decoy,0,-7.27817,-6.15,-1.96,-5.069381126666124
C[C@@H](NC(=O)C1CCOCC1)C(=O)N(C)C1CC[NH+](C2CCOCC2)CC1,C66832859_decoy,CASP3,Decoy,0,-8.11551,-6.16,-1.9,-6.6173716741971
CC(=O)N[C@@](C)(C(=O)N1CCC(CC(=O)N2CC[NH+](C)CC2)CC1)C1CC1,C66858384_decoy,CASP3,Decoy,0,-7.8878,-6.6,-0.67,-7.123814938175598
Cc1occc1C(=O)NC1CCN(Cc2cc(=O)n3c(C)csc3[nH+]2)CC1,C66891617_decoy,CASP3,Decoy,0,-7.30986,-5.81,-2.86,-5.109676978269813
CC(C)[C@@H](CNC(=O)c1nc(S(C)(=O)=O)n2ccccc12)[NH+](C)C,C66898957_decoy,CASP3,Decoy,0,-7.10572,-6.67,0.11,-5.851577576880526
CC[NH+](CC)C1CCN(C(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)CC1,C67072566_decoy,CASP3,Decoy,0,-8.49895,-5.63,-2.29,-7.169337735726876
O=C(C[NH+]1CCC[C@H]1C(=O)N1CCSCC1)NC1CCC2(CC1)OCCO2,C67117620_decoy,CASP3,Decoy,0,-8.95368,-6.31,-2.31,-6.652041988037636
Cc1cccc(Cn2nccc2NC(=O)C[NH+](C)[C@H]2CCS(=O)(=O)C2)c1,C67174315_decoy,CASP3,Decoy,0,-8.44927,-6.15,-1.3,-6.926379713429106
C[C@H]1CN(c2ccc(CNCc3cn(C)nc3-c3ccncc3)c[nH+]2)CCO1,C67188823_decoy,CASP3,Decoy,0,-7.10861,-6.04,-2.63,-6.072197669618951
CC(C)C[NH+]1CCC(NC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)CC1,C67265308_decoy,CASP3,Decoy,0,-8.32302,-6.97,-0.76,-8.795044665246904
CNS(=O)(=O)c1cc(C(=O)N2C[C@@H]([NH+](C)C)Cc3ccccc32)n(C)c1,C67340370_decoy,CASP3,Decoy,0,-7.03422,-5.54,-2.47,-5.819137908389715
Cc1cc([C@H]2CCC[NH+]2Cc2cc3cc4c(cc3[nH]c2=O)OCO4)on1,C67515264_decoy,CASP3,Decoy,0,-7.77003,-6.98,0.11,-5.430683516912905
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,C04237015_decoy,CASP3,Decoy,0,-10.0808,-6.41,-1.69,-7.018434064532277
O=c1[nH]c(=O)n([C@@H]2C[C@H](O)[C@H](CO)O2)cc1C(OCC(F)(F)F)OCC(F)(F)F,C05812164_decoy,CASP3,Decoy,0,-6.35621,-7.65,-1.77,-7.774987150979853
CO[C@@H](Oc1ccc(C(=O)Cc2ccc3c(c2)OCCO3)c(O)c1)[C@@H](O)[C@H](O)[C@@H](C)O,C08870897_decoy,CASP3,Decoy,0,-8.83561,-6.99,-1.31,-7.058341079777732
CC(C)OC[C@@H](O)Cn1c(N/N=C/c2ccc(N(C)C)cc2)nc2c1c(=O)[nH]c(=O)n2C,C08970512_decoy,CASP3,Decoy,0,-7.57288,-7.33,-2.33,-8.15353012211631
CN(C)c1ccc([C@H](CNC(=O)C(=O)NNC(=O)c2ccco2)S(=O)(=O)c2cccs2)cc1,C09079750_decoy,CASP3,Decoy,0,-8.75721,-7.84,-1.71,-8.269673863438776
CCOC(=O)c1c(NC(=O)COC(=O)CC[C@H]2NC(=O)NC2=O)sc2c1CCCC2,C09492109_decoy,CASP3,Decoy,0,-9.02466,-6.45,-2.62,-7.276478051082415
CC[C@@H]([NH2+]C[C@@H](O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1)C(=O)[O-],C11667603_decoy,CASP3,Decoy,0,-6.72887,-5.57,-2.7,-6.910232192261727
C=C(C)Cn1c2c(c(=O)[nH]c1=S)[C@](NP(=O)(OCC)OCC)(C(F)(F)F)C(=O)N2,C12411275_decoy,CASP3,Decoy,0,-6.27196,-5.06,-1.71,-6.060376275455564
COc1cc2c(c(OC)c1OC)-c1ccc(N(CCO)CCO)c(=O)cc1[C@@H](NC(C)=O)CC2,C01595482_decoy,CASP3,Decoy,0,-9.51012,-5.09,-1.96,-6.897895674515977
CCCCN(C(=O)C[C@H](NC(C)=O)c1ccc(C)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14788164_decoy,CASP3,Decoy,0,-8.21451,-5.03,-1.51,-6.37767813547249
CCCCN(C(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14788172_decoy,CASP3,Decoy,0,-7.56154,-6.16,-3.56,-5.707364543134282
COc1cc(/C=N/Nc2nncn2/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O,C16195064_decoy,CASP3,Decoy,0,-7.37444,-6.89,-2.7,-5.510120987181329
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)OCC(=O)Nc1sccc1C(N)=O,C16580872_decoy,CASP3,Decoy,0,-7.65774,-7.11,-1.33,-6.71850663478206
COc1cc2ncn(CC(=O)NCC(=O)NCCc3c[nH]c4ccc(F)cc34)c(=O)c2cc1OC,C20734994_decoy,CASP3,Decoy,0,-7.01523,-7.47,-1.76,-6.769222909803801
CCOc1cc(/C=N/Nc2nnc(SCC(=O)Nc3nccs3)n2N)ccc1O,C21326609_decoy,CASP3,Decoy,0,-9.46112,-7.7,-1.11,-6.932891956590073
Cc1ccc(C(=O)CCC(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)s1,C21423069_decoy,CASP3,Decoy,0,-10.0825,-7.01,-0.81,-6.690026811973464
CC1(C)[C@H](COC(=O)CCSSCCNC(=O)CCCC[C@H]2SC[C@@H]3NC(=O)N[C@@H]32)CC=[N+]1[O-],C22051727_decoy,CASP3,Decoy,0,-8.87366,-6.93,-2.99,-6.671153477419082
NC(=O)CCc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1Cc1ccco1,C22408057_decoy,CASP3,Decoy,0,-10.3638,-8.19,-2.21,-9.13440604971097
C=CCn1c(Cc2csc(NC(=O)C[C@H](NC(C)=O)c3ccc(C)cc3)n2)n[nH]c1=S,C23041924_decoy,CASP3,Decoy,0,-7.77794,-7.72,-0.89,-6.393525686812586
NC(=O)CCc1nnc(SCC(=O)NCc2ccc(Cl)cc2)n1C[C@H]1CCCO1,C23367924_decoy,CASP3,Decoy,0,-9.98786,-7.25,-1.13,-10.083448104893709
C[C@@]1(NC(=O)CSc2nnc(CCC(N)=O)n2C[C@H]2CCCO2)CCS(=O)(=O)C1,C23369127_decoy,CASP3,Decoy,0,-9.93582,-6.56,-1.99,-8.208856150811595
CCCCn1c(N)c(N(CC(C)C)C(=O)CCC(=O)Nc2nc(C)c(C)s2)c(=O)[nH]c1=O,C24758907_decoy,CASP3,Decoy,0,-8.25459,-5.75,-3.62,-6.8308552703806384
CCOC(=O)c1c(C)oc(NC(=O)CSc2nnc(-c3sc(C)nc3C)o2)c1C(N)=O,C25588263_decoy,CASP3,Decoy,0,-10.3163,-7.94,-0.22,-7.578097561713016
CCOC(=O)c1c(C)oc2nc(COC(=O)c3ccccc3SCC(N)=O)nc(N)c12,C29902978_decoy,CASP3,Decoy,0,-8.95548,-5.3,-2.59,-5.794474230055844
CCCCn1c(N)c(N(CCOC)C(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c(=O)[nH]c1=O,C32957700_decoy,CASP3,Decoy,0,-8.05666,-6.99,-0.85,-7.815310663786412
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2ccc(OCC(N)=O)cc2)s1,C35566615_decoy,CASP3,Decoy,0,-9.59995,-6.48,-2.92,-7.248565572926647
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2sc(C)nc2C)[C@H]1c1ccc(OCC(N)=O)cc1,C35568318_decoy,CASP3,Decoy,0,-10.1904,-7.11,-3.59,-9.855058535927151
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccccc2O)N(Cc2ccco2)C(=O)CO)cc1,C36503768_decoy,CASP3,Decoy,0,-7.69744,-7.68,-1.81,-8.798503735419988
COc1cc([C@@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(C(=O)CO)C(C)(C)C)ccc1O,C36590764_decoy,CASP3,Decoy,0,-7.32289,-6.35,-2.23,-6.412369558317483
COc1cc([C@@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(Cc2ccc(C)o2)C(=O)CO)ccc1O,C36600581_decoy,CASP3,Decoy,0,-9.66951,-8.35,-2.32,-9.043107396243936
NC(=O)CCc1nnc(SCC(=O)N[C@@H]2CCOc3ccccc32)n1Cc1ccco1,C36802732_decoy,CASP3,Decoy,0,-9.53919,-7.15,-3.31,-9.101984644872568
CCn1cc(C(=O)N[C@@H](CCSC)C(=O)NCCO)c(=O)c2cc3c(cc21)OCO3,C09435616_decoy,CASP3,Decoy,0,-8.41679,-6.24,-1.23,-6.544213083588071
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC[C@H]2CN(CC(C)C)CCO2)cc1,C25080705_decoy,CASP3,Decoy,0,-9.01413,-7.37,-1.44,-7.229927407105137
COc1cc(OC)cc(C(=O)N2C[C@@H](C(=O)NCCCCCC(=O)[O-])C3(CC[NH2+]CC3)C2)c1,C39659990_decoy,CASP3,Decoy,0,-8.3589,-5.96,-1.27,-7.187608491770977
CN(C)c1cccc(C(=O)N2C[C@H](C(=O)NCCCCCC(=O)[O-])C3(CC[NH2+]CC3)C2)c1,C39660099_decoy,CASP3,Decoy,0,-7.19285,-5.63,-0.83,-5.529823339389247
COc1cc(C(=O)N2C[C@@H](C(=O)NCCCC(=O)[O-])C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39663464_decoy,CASP3,Decoy,0,-8.0548,-5.92,-2.78,-7.303492503915082
O=S1(=O)C=C[C@@H](NC(=S)NCCCCCCNC(=S)N[C@@H]2C=CS(=O)(=O)C2)C1,C40167893_decoy,CASP3,Decoy,0,-8.44537,-6.89,-2.87,-9.95935292519218
CCCOCCN1C(=O)[C@H]2[C@@H](c3ccc(/C=C/c4ccccc4)cc3)[NH2+][C@@](CO)(C(=O)[O-])[C@@H]2C1=O,C44173132_decoy,CASP3,Decoy,0,-6.3827,-7.85,-1.63,-8.304286936124925
Cc1cc(C)c(NC(=O)CNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c(C)c1,C57974723_decoy,CASP3,Decoy,0,-7.46046,-7.96,-1.73,-6.566975582596281
CC(=O)Nc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)cc1,C59820930_decoy,CASP3,Decoy,0,-7.65584,-6.11,-1.68,-6.794343186101217
CC(C)c1nnc(CNC(=O)CSc2n[nH]c(N/N=C/c3ccccc3Cl)n2)o1,C59879087_decoy,CASP3,Decoy,0,-8.15054,-7.8,-2.75,-7.401155843596932
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(S[C@@H](C)C(=O)NNC(=O)C(C)C)n[nH]1,C59881805_decoy,CASP3,Decoy,0,-8.13193,-6.18,-1.68,-5.825295727344626
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(S[C@H](C)C(=O)NNC(=O)C(C)C)n[nH]1,C59881808_decoy,CASP3,Decoy,0,-9.47473,-6.2,-1.87,-8.404850651881985
CSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2c(C)nn(CCO)c2C)n1,C59887971_decoy,CASP3,Decoy,0,-10.0351,-7.1,-1.28,-7.383253293682315
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2sc3c(c2C#N)CCCC3)n1N,C59914570_decoy,CASP3,Decoy,0,-9.85586,-8.03,-3.16,-7.940681541487309
C[NH+]1CCN(Cc2ccc(-c3nc(CC(=O)N[C@H](CCC(N)=O)C(=O)[O-])cs3)cc2)CC1,C62048217_decoy,CASP3,Decoy,0,-10.1378,-6.9,-1.91,-7.8313860874093315
COCCNC(=O)CN(C)C(=O)c1ccc(N2CC[NH2+]CC2)c([N-]S(=O)(=O)c2cccs2)c1,C33033315_decoy,CASP3,Decoy,0,-7.64211,-7.01,-3.81,-7.890919085289651
CC1=C[C@H](NC(=O)CS[C@H]2Nc3cc(C(=O)NC[C@@H]4CCCO4)ccc3C(=O)N2Cc2ccco2)N=N1,C63709315_decoy,CASP3,Decoy,0,-8.76494,-7.92,-1.69,-8.786731206596196
CC1=C[C@@H](NC(=O)CS[C@H]2Nc3cc(C(=O)NC[C@@H]4CCCO4)ccc3C(=O)N2Cc2ccco2)N=N1,C63709316_decoy,CASP3,Decoy,0,-9.49839,-7.07,-1.64,-6.6892503464568565
CC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)OCC(=O)C1=C([O-])N(C)C(=O)N(CC(C)C)[C@H]1N,C63900996_decoy,CASP3,Decoy,0,-9.65151,-7.74,-2.44,-8.309989761133007
O=C([O-])Cc1sc(Cc2nnc3n2CCCCC3)nc1-c1ccc(Cl)cc1,C08718154_decoy,CASP3,Decoy,0,-9.48942,-6.4,-0.41,-6.869284072284624
CC1=NN(c2ccc(Cl)c(C(=O)[O-])c2)C(=O)/C1=C\c1ccc(N(C)C)cc1,C12412844_decoy,CASP3,Decoy,0,-6.96419,-6.32,-1.97,-5.217325287469732
O=C([O-])Cc1ccc(S(=O)(=O)Oc2ccc(Cl)c3cccnc23)s1,C13308052_decoy,CASP3,Decoy,0,-7.81969,-7.49,-0.57,-7.052407709170432
Cc1nc(SCC(=O)N2CCC[C@@H](C(=O)[O-])C2)c2c3c(sc2n1)CCCC3,C13416323_decoy,CASP3,Decoy,0,-7.87317,-7.37,-0.65,-7.99731514527352
Cc1cccc(N2C(=O)S/C(=C/c3ccc(O[C@@H](C)C(=O)[O-])cc3)C2=O)c1,C16906950_decoy,CASP3,Decoy,0,-7.98039,-6.31,-1.77,-8.048630765811629
C[C@@H](Oc1cccc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)c1)C(=O)[O-],C16909303_decoy,CASP3,Decoy,0,-8.08431,-7.17,-2.15,-6.017306195221599
O=C(C1=C([O-])C(=O)N(c2nncs2)[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1,C05818994_decoy,CASP3,Decoy,0,-8.50117,-8.26,-0.15,-11.866782728419798
Cc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(C)s3)[C@H]2c2ccc(C)cc2)cc1,C05883963_decoy,CASP3,Decoy,0,-7.23061,-6.66,-0.99,-5.564942843276208
C[C@@H]1CN(C(=O)c2ccccc2[N-]S(=O)(=O)/C=C/c2ccccc2)C[C@H](C)O1,C25526250_decoy,CASP3,Decoy,0,-6.21276,-7.14,-3.9,-6.691755342227387
Cc1cc(S(=O)(=O)[N-]c2ccccc2-n2cncn2)ccc1Br,C28020511_decoy,CASP3,Decoy,0,-5.76048,-6.8,-1.98,-5.543321999907136
CCc1cc2c(S[C@H](C)C(=O)N3CCC[C@H](C(=O)[O-])C3)nc(C)nc2s1,C31852846_decoy,CASP3,Decoy,0,-6.95187,-6.47,-2.52,-6.157342305666427
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1ccc(Br)cc1F,C32971297_decoy,CASP3,Decoy,0,-8.01037,-6.08,-1.14,-6.522539133017735
CS(=O)(=O)c1nc2ccc([N-]S(=O)(=O)CCc3ccccc3)cc2s1,C33299012_decoy,CASP3,Decoy,0,-8.05979,-6.16,-2.09,-5.6300721967572525
Cc1ccc(C)c(C(=O)C2=C([O-])C(=O)N(c3nnc(C)s3)[C@H]2c2cccs2)c1,C33662077_decoy,CASP3,Decoy,0,-7.79549,-6.39,-1.97,-5.964028825037546
Cc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2Cc2ccco2)o1,C08320292_decoy,CASP3,Decoy,0,-6.38452,-7.22,-1.71,-8.188839773603641
O=C(C1=C([O-])C(=O)N(C[C@@H]2CCCO2)[C@@H]1c1ccc(Cl)cc1)c1ccco1,C00795015_decoy,CASP3,Decoy,0,-7.86496,-5.99,-0.67,-5.848863660478669
CCCSC1=NC(=O)[C@H]2C(=N1)N=C(C)/C(=C(/[O-])OC)[C@H]2c1cccc(C)c1,C39379350_decoy,CASP3,Decoy,0,-7.62326,-5.71,-0.72,-6.027812674819205
CCc1cccc2c(/C=C3\N=C([S-])N(C)C3=O)cn(CC(=O)N(CC)CC)c12,C39556353_decoy,CASP3,Decoy,0,-8.64193,-5.94,-3.73,-7.903865623448458
CC1=C2C(=O)N=C([C@@H](C)Sc3nc(C)cc(C)c3C(=O)[O-])N=C2S[C@@H]1C,C39630282_decoy,CASP3,Decoy,0,-7.95658,-7.48,-3.4,-6.032132968803444
CN(Cc1ccc(N(C)C)cc1)C(=O)Cn1c([S-])nnc1-c1cccs1,C12565024_decoy,CASP3,Decoy,0,-8.77231,-6.46,-2.09,-6.951851511023067
COC(=O)[C@H](c1ccccc1)N1C(=O)/C(=C/c2ccc(C(=O)[O-])cc2)SC1=S,C40936481_decoy,CASP3,Decoy,0,-7.48888,-6.14,-1.38,-6.880871955837569
O=S(=O)([N-]c1ccccc1-n1ccnn1)c1sccc1Br,C48446664_decoy,CASP3,Decoy,0,-5.94806,-4.73,-0.18,-4.369854423172448
CC(C)c1c(/C([O-])=N/S(=O)(=O)c2cccs2)cnn1-c1ccc(F)cc1,C48449912_decoy,CASP3,Decoy,0,-7.28551,-5.69,-3.16,-6.231256909800696
Cc1nc(COc2ccccc2/C=C/C([O-])=C(\C#N)C(=O)N2CCCC2)cs1,C48992902_decoy,CASP3,Decoy,0,-7.44032,-6.91,-2.81,-7.255735223501218
COc1c(Cl)cc(C(=O)/C(C#N)=C(\[O-])N2C[C@H](C)O[C@@H](C)C2)cc1Cl,C49265180_decoy,CASP3,Decoy,0,-7.85021,-7.37,-2.29,-6.833370016352417
CS(=O)(=O)[N-]c1cccc2c1CCCN2CC(=O)N(C1CCCC1)C1CC1,C52993172_decoy,CASP3,Decoy,0,-8.31853,-6.16,-1.45,-10.018012812371412
C[C@H](c1cccs1)N(C)S(=O)(=O)c1cc(C(=O)[O-])oc1Br,C55329644_decoy,CASP3,Decoy,0,-7.33088,-6.78,-1.57,-7.711873887196861
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1[N-]S(=O)(=O)c1cccs1,C55630416_decoy,CASP3,Decoy,0,-9.34521,-6.78,-3.06,-6.66956554827223
COc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1ccc(C)cc1Cl,C55666002_decoy,CASP3,Decoy,0,-5.74199,-5.86,-1.69,-4.090840383445062
O=C1[C@H](/C([O-])=N/O[C@@H]2CCCCO2)CCN1c1cccc(Br)c1,C58419252_decoy,CASP3,Decoy,0,-7.66025,-6.84,-0.34,-4.850655920549571
Cc1ccc(C)c(S(=O)(=O)/N=C(\[O-])c2cc(C)n(-c3cccnc3)c2C)c1,C59250653_decoy,CASP3,Decoy,0,-7.47062,-8.25,-3.37,-8.28191995929375
CCN(CC)c1ccc(/C=C2\C(=O)N(c3ccc(Cl)cc3)C(=S)N=C2[O-])o1,C33332296_decoy,CASP3,Decoy,0,-8.78319,-6.53,-3.1,-7.75360890074902
C=CCSC1=NC(=O)[C@H]2C(=N1)N=C1CC(C)(C)CC([O-])=C1[C@H]2c1ccc(C)o1,C39765329_decoy,CASP3,Decoy,0,-8.22454,-6.9,-0.76,-6.917151038006291
C=CCSC1=NC(=O)[C@@H]2C(=N1)N=C1CC(C)(C)CC([O-])=C1[C@H]2c1ccc(C)o1,C39765331_decoy,CASP3,Decoy,0,-6.91339,-6.15,-0.49,-5.484886081118224
C=CCSC1=NC(=O)[C@H]2C(=N1)N=C1CC(C)(C)CC([O-])=C1[C@@H]2c1ccncc1,C39765344_decoy,CASP3,Decoy,0,-7.2003,-5.51,-1.21,-5.500021302586144
CC(C)CCSC1=NC(=O)[C@@H]2C(=N1)N=C1CCCC([O-])=C1[C@H]2c1cccnc1,C39775038_decoy,CASP3,Decoy,0,-8.22968,-6.94,-0.69,-7.774417387176078
Cn1cc(/C=C(C#N)/C([O-])=N/c2c(Cl)cccc2Cl)c(-c2ccncc2)n1,C63276309_decoy,CASP3,Decoy,0,-7.50882,-6.96,-2.5,-6.15008331758502
Cc1ccccc1-n1nc(/C([O-])=N/S(=O)(=O)Cc2ccccc2)c2c1CCC2,C65485001_decoy,CASP3,Decoy,0,-6.86674,-6.97,-1.33,-6.565234793886676
O=S(=O)([N-]c1nc(-c2ccncc2)cs1)c1ccccc1OC(F)F,C66247575_decoy,CASP3,Decoy,0,-6.20112,-6.22,-1.17,-5.918181253534148
C[C@@H]1CN(Cc2csc([N-]S(=O)(=O)/C=C/c3ccccc3)n2)C[C@@H](C)O1,C66250702_decoy,CASP3,Decoy,0,-6.66321,-6.26,-1.1,-6.270607372302697
CCn1cc(S(=O)(=O)[N-]c2ncc(Cc3ccccc3Cl)s2)cn1,C66250725_decoy,CASP3,Decoy,0,-8.13637,-6.91,-3.28,-8.595418722571745
Cc1nc([N-]S(=O)(=O)c2ccc(F)c3ncccc23)sc1SCC#N,C66253695_decoy,CASP3,Decoy,0,-8.55162,-5.56,-0.45,-5.499652416680306
COc1cc(C)c(S(=O)(=O)[N-]c2nc(C)c(SCC#N)s2)cc1C,C66253720_decoy,CASP3,Decoy,0,-7.15269,-5.24,-3.34,-5.319039033670523
Cc1cc(C)cc(N2CC[C@@H](/C([O-])=N/S(=O)(=O)/C=C\c3ccccc3)C2=O)c1,C66504065_decoy,CASP3,Decoy,0,-7.94409,-6.39,-1.42,-5.738990419338157
Cc1ccc(N2CC[C@H](/C([O-])=N/S(=O)(=O)/C=C/c3ccccc3)C2=O)cc1,C66504073_decoy,CASP3,Decoy,0,-7.21263,-7.55,-1.11,-6.384286886283852
CS(=O)(=O)[N-]c1ccc(OC(=O)Cc2coc3cc4c(cc23)CCC4)cc1,C66517274_decoy,CASP3,Decoy,0,-8.45423,-7.0,-1.16,-7.9040418247042865
O=S(=O)([N-]c1cc(Br)ccc1-n1cncn1)C1CCCCC1,C66584343_decoy,CASP3,Decoy,0,-7.07082,-5.85,-3.7,-5.683790802879569
N#Cc1cc(S(=O)(=O)/N=C(\[O-])c2csc(-c3cccs3)n2)ccc1F,C66736362_decoy,CASP3,Decoy,0,-8.00174,-5.81,-2.78,-4.563739091359212
Cc1nccn1Cc1ccc([N-]S(=O)(=O)c2ccc(C#N)c(Cl)c2)cc1,C66737905_decoy,CASP3,Decoy,0,-7.55994,-5.7,-1.25,-5.067285604092723
O=S(=O)([N-]c1ccc(-c2nnc3n2CCCC3)cc1)c1cc(F)cc(F)c1,C66814384_decoy,CASP3,Decoy,0,-6.99308,-8.35,-1.66,-8.292433905509425
O=C([O-])CC1(CC(=O)N[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3n2nnnc2-c2ccccc2)CCCC1,C04259902_decoy,CASP3,Decoy,0,-6.26179,-7.05,-0.94,-5.873454509472975
Cc1cc(S(=O)(=O)Nc2nc(N)nc(N(C)C)n2)c(SCC(=O)[O-])cc1Cl,C01637841_decoy,CASP3,Decoy,0,-8.51637,-7.73,-2.66,-9.146651408729571
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)Cn3cc([N+](=O)[O-])c(C)n3)[C@H]2SC1,C08815654_decoy,CASP3,Decoy,0,-7.4413,-5.89,-1.52,-7.700777237659787
COc1cc(/C=C2\NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)ccc1O[C@H](C)C(=O)[O-],C02817411_decoy,CASP3,Decoy,0,-4.69687,-6.23,-1.17,-4.515758028017236
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)[C@H](C)n4cc(Cl)c(C)n4)[C@H]3SC2)s1,C09974934_decoy,CASP3,Decoy,0,-9.80653,-7.74,-1.59,-6.803591744415501
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)[C@H](C)n4cc(Cl)c(C)n4)[C@@H]3SC2)s1,C12406506_decoy,CASP3,Decoy,0,-8.15614,-7.45,-1.68,-5.853901536332592
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@@H](NC(=O)[C@H](C)n4cc(Cl)c(C)n4)[C@@H]3SC2)s1,C12406513_decoy,CASP3,Decoy,0,-8.85925,-7.54,-1.51,-13.180901158672375
Cc1cc(NC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C[C@@H](C)O)no1,C13051578_decoy,CASP3,Decoy,0,-8.50303,-7.18,-1.57,-7.032688008456633
C[C@H](O)Cn1c(SCC(=O)NC(=O)NC2CC2)nc2cc(C(=O)[O-])ccc2c1=O,C13052118_decoy,CASP3,Decoy,0,-7.97979,-7.04,-1.01,-7.019491463340003
COc1ccccc1N(CCC(N)=O)C(=O)Cn1cnc2oc(C)c(C(=O)[O-])c2c1=O,C13057744_decoy,CASP3,Decoy,0,-8.56825,-7.44,-1.78,-7.848006943710281
COc1ccc(CNC(=O)CSc2nnc([C@H]3CCS(=O)(=O)C3)n2C)cc1C(=O)[O-],C13238911_decoy,CASP3,Decoy,0,-8.39591,-6.76,-1.18,-6.7083657883265415
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1ccc(-n2cnnn2)cc1,C13262110_decoy,CASP3,Decoy,0,-7.44619,-7.0,-1.7,-6.356536666339506
Cc1nc2nc(S[C@H](C)C(=O)NC(=O)NC(C)(C)C)nn2c(C)c1CCC(=O)[O-],C13270851_decoy,CASP3,Decoy,0,-6.97681,-7.59,-1.48,-7.0548748463407325
Cc1ccc(C)c(-n2nnnc2Sc2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])c1,C13275423_decoy,CASP3,Decoy,0,-6.63021,-6.57,-2.19,-8.337500606356189
Cc1ccc(-n2nnnc2Sc2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])cc1C,C13276235_decoy,CASP3,Decoy,0,-4.59951,-7.59,-1.81,-6.420724094508627
O=C([O-])CNC(=O)c1ccc(NCCc2cc(Cl)c3c(c2)OCCO3)c([N+](=O)[O-])c1,C13279082_decoy,CASP3,Decoy,0,-7.79316,-7.82,-2.87,-9.302928667092363
COc1cc(/C(C)=N/NC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)ccc1OCC(=O)[O-],C13356743_decoy,CASP3,Decoy,0,-9.46196,-7.56,-2.47,-9.728980863963448
CNC(=O)[C@@H]1CN(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])c2ccccc2O1,C13443065_decoy,CASP3,Decoy,0,-7.38829,-6.71,-1.58,-6.56921991627709
O=C([O-])Cn1c(SCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)nnc1-c1cccs1,C13443415_decoy,CASP3,Decoy,0,-8.01066,-8.21,-1.68,-7.451552680962162
COc1cc(/C=C2/NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)ccc1O[C@@H](C)C(=O)[O-],C13546673_decoy,CASP3,Decoy,0,-7.83245,-7.9,-1.08,-11.062709271632766
COc1cc(C(=O)[O-])c(CNC(=O)CSc2nnnn2C)c(OC)c1OC,C02194502_decoy,CASP3,Decoy,0,-5.5693,-6.78,-1.64,-6.674117998146402
CCCC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H]2CO[P@@](=O)([O-])O[C@@H]2[C@@H]1OC(=O)CCC,C13704184_decoy,CASP3,Decoy,0,-7.49599,-6.48,-0.59,-6.084686873932543
COc1nn([C@@H](C)C(=O)N[C@H]2C(=O)N3C(C(=O)[O-])=C(COC(C)=O)CS[C@@H]23)cc1[N+](=O)[O-],C13847952_decoy,CASP3,Decoy,0,-6.79835,-5.4,-2.06,-5.829251478668321
CCn1cc(C(=O)N[C@H]2C(=O)N3C(C(=O)[O-])=C(COC(C)=O)CS[C@@H]23)c(C)n1,C13959418_decoy,CASP3,Decoy,0,-7.51039,-6.32,-1.47,-5.864428953800613
Cn1c(SCC(=O)Nc2cc(C(=O)[O-])cc([N+](=O)[O-])c2)nnc1-c1ccncc1,C14944643_decoy,CASP3,Decoy,0,-7.45344,-7.78,-1.02,-7.169270390204031
Nc1nnc(CC(=O)ON/N=C\c2cc([N+](=O)[O-])cc(Br)c2[O-])s1,C16383243_decoy,CASP3,Decoy,0,-6.6876,-7.28,-1.62,-6.706219002918385
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)Cn3cc(Cl)c(C)n3)[C@H]2SC1,C17096176_decoy,CASP3,Decoy,0,-8.77525,-6.94,-0.78,-6.107341761106771
Cc1ccc([C@H](CNC(=O)/C([O-])=N/c2ncc([N+](=O)[O-])s2)N2CCOCC2)cc1,C23974595_decoy,CASP3,Decoy,0,-8.81589,-6.63,-1.95,-6.209994217906959
CCS(=O)(=O)N1C[C@@H](C(=O)Nc2ccc(S(=O)(=O)[N-]c3nccc(C)n3)cc2)Oc2ccccc21,C30867000_decoy,CASP3,Decoy,0,-7.56617,-8.51,-2.42,-6.569383488890584
CCc1cccc(CC)c1N1C(=O)[C@H]2[C@@H](c3ccc4c(c3)OCCO4)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C34380026_decoy,CASP3,Decoy,0,-6.74402,-6.12,-1.65,-5.824453337369584
O=C([O-])/C=C/C(=O)Nc1ccc2[nH]cc([C@@H](C(=O)[O-])[NH+]3CCN(Cc4cccnc4)CC3)c2c1,C36357504_decoy,CASP3,Decoy,0,-7.90734,-7.13,-1.49,-8.205160744352883
O=C([O-])/C=C/C(=O)Nc1ccc2[nH]cc([C@H](C(=O)[O-])[NH+]3CCN(Cc4cccnc4)CC3)c2c1,C36357505_decoy,CASP3,Decoy,0,-8.18026,-7.9,-2.57,-7.097242112995287
O=S(=O)(NC[C@H]1NN[C@@H](S(=O)(=O)Cc2cccc(Cl)c2)O1)c1ccc2nc([O-])oc2c1,C38794144_decoy,CASP3,Decoy,0,-8.69687,-6.95,-2.11,-6.324447643726952
C=CCn1c([S-])nnc1CC1=N[C@@H](NC(=O)C2CCN(c3ccc4nnnn4n3)CC2)SC1,C38798904_decoy,CASP3,Decoy,0,-11.9173,-7.23,-0.98,-9.325671180572906
O=C([O-])c1ccc2c(=O)[nH]c(CSc3nnc(CN4N=N[C@@H](c5ccsc5)N4)o3)nc2c1,C39653348_decoy,CASP3,Decoy,0,-8.5501,-8.23,-3.07,-6.626917476262466
C[C@@H]1Oc2nc(CSc3nnc(-c4ccncc4)n3Cc3ccccc3)[nH]c(=O)c2[C@@H]1C(=O)[O-],C39691999_decoy,CASP3,Decoy,0,-7.01559,-7.0,-1.73,-6.303121661564984
COc1cc([C@@H]2C=C(c3ccc(O[C@@H](C)C(=O)[O-])cc3)Nc3nnnn32)cc([N+](=O)[O-])c1O,C13077770_decoy,CASP3,Decoy,0,-7.49597,-8.65,-2.23,-7.020282685467736
NC(=O)C[C@@H](C(=O)[O-])N1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S,C39861971_decoy,CASP3,Decoy,0,-8.04659,-6.45,-1.11,-6.0711780998911
CCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccc(S(=O)(=O)[N-]c3cc(C)nc(C)n3)cc2)n1,C39909391_decoy,CASP3,Decoy,0,-8.3481,-7.43,-2.36,-6.554864676570667
O=C(Cc1ccc([N+](=O)[O-])cc1)NNc1ncnc(N2CCC(C(=O)[O-])CC2)c1[N+](=O)[O-],C40659271_decoy,CASP3,Decoy,0,-6.80755,-6.33,-1.28,-5.962919079377616
COc1ccccc1[C@@H]1N[C@](Cc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])[C@@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C43219082_decoy,CASP3,Decoy,0,-5.81969,-7.49,-2.87,-5.316813750484953
COc1ccc([C@H]2[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@@H]23)c(OC)c1C,C33925313_decoy,CASP3,Decoy,0,-6.56449,-6.63,-0.94,-6.518987424167446
C[C@H](O)Cn1c(SCC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)nc2cc(C(=O)[O-])ccc2c1=O,C13052526_decoy,CASP3,Decoy,0,-8.45444,-7.17,-0.47,-7.068064652295265
COc1cc([N-]S(=O)(=O)c2ccc(N/C=C3\C(=O)N(C)C(=O)C(C#N)=C3C)cc2)nc(OC)n1,C16693916_decoy,CASP3,Decoy,0,-8.86713,-7.23,-1.32,-8.202320184321637
C[C@H](OC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCNC1=O,C58006894_decoy,CASP3,Decoy,0,-7.28391,-7.51,-1.85,-7.0147116655894886
COC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@H]1c1cccc(OC)c1OC,C59293902_decoy,CASP3,Decoy,0,-7.28258,-5.38,-1.39,-6.049462641629755
COc1ncnc(N/C([O-])=N/S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)n1,C59366554_decoy,CASP3,Decoy,0,-6.1619,-5.96,-1.76,-5.010500267583663
COc1ncnc(N/C([O-])=N/S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1,C59366579_decoy,CASP3,Decoy,0,-6.53906,-6.05,-1.46,-6.91533584776522
CCOC(=O)C1=C([O-])C(=O)N(c2ccc(S(N)(=O)=O)cc2)[C@@H]1c1ccc([N+](=O)[O-])cc1,C13120480_decoy,CASP3,Decoy,0,-7.20209,-5.28,-3.51,-6.053802591638566
O=C(CSc1nc([O-])c2cnn(CCO)c2n1)NCc1ccc2c(c1)OCO2,C15881238_decoy,CASP3,Decoy,0,-8.24978,-6.67,-0.58,-6.413111545280555
Cc1ccc(C(=O)Nc2sc3c(c2C(=O)N2CC[NH+](C)CC2)CC[C@@H](C)C3)cc1,C02811347_decoy,CASP3,Decoy,0,-8.01982,-6.77,-2.15,-5.9345178313846425
C[C@@H](C(=O)N1CCc2[nH]c3ccccc3c2C1)[NH+]1CCN(c2ccccc2)CC1,C04901831_decoy,CASP3,Decoy,0,-6.56037,-6.92,-2.22,-5.429838406255871
COc1cc2ccc(C[C@@H]3[NH2+]CCc4cc5c(cc43)OCO5)cc2cc1OC,C05120933_decoy,CASP3,Decoy,0,-8.47824,-7.54,-0.86,-6.222675250209007
CC(C)c1nc2sc3c(N4CC[NH2+]CC4)ncnc3c2c2c1CCC2,C02418375_decoy,CASP3,Decoy,0,-7.02516,-5.67,-0.98,-4.057087395109702
[H]/N=C1\[C@H](C#N)[C@H](c2ccc(Cl)cc2)[C@H]2C[NH+](C(C)C)CC=C2C1(C#N)C#N,C05462588_decoy,CASP3,Decoy,0,-6.8639,-6.06,-0.06,-6.168873038286171
Cc1c(C(=O)N2CC[NH+](Cc3ccc(Cl)s3)CC2)[nH]c2c1C(=O)CC(C)(C)C2,C09914310_decoy,CASP3,Decoy,0,-9.43049,-6.93,-2.08,-5.858111548060906
Cc1c(C[NH+]2CCOc3ccc([C@@H](O)C4CCCCC4)cc3C2)cnn1C,C12078857_decoy,CASP3,Decoy,0,-6.4862,-6.18,-1.87,-4.406555803610043
Cc1nc2c(c(=O)[nH]1)C[NH+](Cc1ccc3c4ccccc4n(C)c3c1)CC2,C12117857_decoy,CASP3,Decoy,0,-6.75291,-8.27,-0.97,-4.884189625274094
O=C(Cc1cn2ccsc2n1)N[C@H]1CCC[NH+](C2CCCCCC2)C1,C12199774_decoy,CASP3,Decoy,0,-9.42878,-5.77,0.22,-6.364385306948587
Cc1ccc(-n2ncc3c2CCC[C@H]3[NH2+]Cc2cccc3c2OCO3)cc1C,C12209057_decoy,CASP3,Decoy,0,-7.27905,-7.15,-2.68,-6.0248422579997305
Cc1cc2c(cc1C[NH2+][C@@H]1CC(C)(C)Cc3nc(C(C)(C)C)ncc31)OCO2,C12302771_decoy,CASP3,Decoy,0,-8.0889,-6.35,-1.99,-5.190761991370485
c1ccc2c(c1)CC[C@@H]([NH+]1CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C1)C2,C12300687_decoy,CASP3,Decoy,0,-8.78615,-7.3,-2.19,-6.316240124785041
[H]/N=C1/[C@@H](C#N)[C@H](c2ccccc2Cl)[C@@H]2C[NH+](CCC)CC=C2C1(C#N)C#N,C13479720_decoy,CASP3,Decoy,0,-6.23135,-5.68,-1.21,-4.419575213767641
Cn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H]([NH2+]CC1CCCCC1)C2,C14732299_decoy,CASP3,Decoy,0,-9.50168,-5.27,-2.39,-6.360010692927627
[H]/N=C1\[C@H](C#N)C2=CC[NH+](C(C)C)C[C@@H]2[C@@H](c2ccc(C)cc2)C1(C#N)C#N,C04102686_decoy,CASP3,Decoy,0,-5.89397,-5.91,-3.61,-3.3631261155494974
CC[NH+](C)[C@@H]1c2ccccc2C2(CCN(C(=O)/C=C/c3ccco3)CC2)[C@H]1O,C19143901_decoy,CASP3,Decoy,0,-8.56524,-5.48,-1.91,-6.549585861347059
CCCC[C@]12CN3C[C@](C)(C[NH+](C1)[C@]31C(=O)Nc3ccc(Br)cc31)C2=O,C19321251_decoy,CASP3,Decoy,0,-7.99353,-6.55,-5.4,-6.0487821431224855
O[C@@H](c1ccccc1)c1cn(C2CC[NH+](C3Cc4ccccc4C3)CC2)nn1,C20861592_decoy,CASP3,Decoy,0,-7.4846,-8.15,-0.77,-5.676828351077353
Cc1oc2c(C[NH+]3CCCOC3)c(O)ccc2c(=O)c1-c1ccc(Cl)cc1,C32501398_decoy,CASP3,Decoy,0,-7.54592,-6.67,-1.63,-5.861472587293943
CCOC1=C[C@H]2C[C@@H]3CO[P@](=O)(Cc4ccccc4)N[NH+]3C[C@@H]2C=C1F,C39466894_decoy,CASP3,Decoy,0,-6.55058,-6.21,-2.06,-4.803916607086195
Cc1nc(C)c2c(C)c(C(=O)NC[C@@H](C)[NH+]3CCCC[C@@H]3C)sc2n1,C43085611_decoy,CASP3,Decoy,0,-7.48261,-6.79,-2.55,-5.009029050508705
Cc1oc(-c2ccoc2)nc1C[NH+]1CC[C@](O)(c2ccccc2)[C@@H]2CCCC[C@@H]21,C43609939_decoy,CASP3,Decoy,0,-8.54955,-6.7,-4.06,-5.579113280923533
O=C1N(C2CCCC2)C[C@H]2C[C@@H](c3c[nH]nc3-c3ccc(Cl)cc3)[NH+]3CCC[C@]123,C43620192_decoy,CASP3,Decoy,0,-7.0103,-6.37,-1.3,-5.2484302084603085
Oc1ccc(Br)cc1/C=[NH+]/[C@H]1CCCN(c2ncccn2)C1,C44012268_decoy,CASP3,Decoy,0,-6.9812,-5.42,-0.92,-4.984155303048338
C[NH+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(I)c1,C49099881_decoy,CASP3,Decoy,0,-6.22835,-5.14,-1.14,-4.756617486543963
Cc1ccc(-c2nc(C(=O)NC3CCN(c4cccc[nH+]4)CC3)cs2)cc1,C46617348_decoy,CASP3,Decoy,0,-8.06179,-5.92,-1.58,-5.2636494615187095
Cc1ccccc1[C@@H]1C[C@H](c2ccccc2OC(F)F)N=C2[NH+]=CNN21,C13123609_decoy,CASP3,Decoy,0,-6.13415,-6.03,-3.88,-5.45694201960283
O=C(C1=CC2=[NH+][C@H](c3ccc(Cl)cc3)C[C@H](C(F)(F)F)N2N1)N1CCCC1,C12468178_decoy,CASP3,Decoy,0,-5.47405,-5.53,-2.23,-3.907016742064304
Cc1ccc(N2C(=O)C[C@H]([NH+]3CCC(c4c[nH]c5ccccc45)CC3)C2=O)cc1,C32771752_decoy,CASP3,Decoy,0,-7.56136,-8.4,-0.92,-6.576715567600586
COc1ccc([C@@H]2NCCC3=c4ccccc4=[NH+][C@@H]32)cc1CN1CCOCC1,C63291165_decoy,CASP3,Decoy,0,-7.51566,-6.71,-1.65,-7.080859017609456
Brc1ccccc1[C@H]1Nn2c(nnc2[C@@H]2C=c3ccccc3=[NH+]2)S1,C63293847_decoy,CASP3,Decoy,0,-6.80036,-6.68,-1.6,-4.552398537796775
Clc1ccccc1-c1nnc2n1N[C@H]([C@@H]1C=c3ccccc3=[NH+]1)S2,C63295781_decoy,CASP3,Decoy,0,-6.02083,-6.43,-4.42,-3.7254188410976834
O=C(CC1CCN(C(=O)[C@H]2C=c3ccccc3=[NH+]2)CC1)NC1CCCC1,C63737767_decoy,CASP3,Decoy,0,-7.50912,-7.34,-0.67,-10.467334420898752
Cc1ccc2c(c1)=C(CCNC(=O)[C@@H]1Cc3cc(Cl)ccc3OC1=O)[C@H](C)[NH+]=2,C63804454_decoy,CASP3,Decoy,0,-6.49435,-6.35,-0.7,-4.455148815963092
CC(=O)NCCC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2[C@@H]1c1cccc(C)c1,C64031697_decoy,CASP3,Decoy,0,-7.05294,-6.93,-1.56,-7.2169024829709425
O=C(NCc1ccc2c(c1)OCO2)[C@H]1[NH+]=c2ccc(Br)cc2=C1Cl,C64109023_decoy,CASP3,Decoy,0,-8.38464,-7.81,-1.06,-7.266805064490323
O=C(CC1=c2ccccc2=[NH+]C1)Nc1c(-c2ccccc2)nc2sccn12,C64343453_decoy,CASP3,Decoy,0,-8.83561,-5.54,-2.42,-6.511820019348455
CC(C)(C)Nc1c(C2CCN(C(=O)c3ccsc3)CC2)[nH+]c2ccccn12,C64757432_decoy,CASP3,Decoy,0,-6.57231,-6.8,-2.24,-4.429549599276888
Cc1ncsc1C[NH+]1CCC(c2n[nH]c(-c3ccc(F)cc3)n2)CC1,C65287352_decoy,CASP3,Decoy,0,-6.04202,-5.69,-2.67,-4.102928192232355
c1ccc([C@H]2NC[NH+](C[C@H]3N=NC4=C3CCCCC4)[C@H]2[C@@H]2CCOC2)cc1,C65373697_decoy,CASP3,Decoy,0,-7.54118,-6.8,-2.88,-5.935673737198116
c1ccc([C@@H]2NC[NH+](C[C@H]3N=NC4=C3CCCCC4)[C@@H]2[C@@H]2CCOC2)cc1,C65373701_decoy,CASP3,Decoy,0,-7.46569,-7.4,0.09,-6.859076335785057
Cc1cc(-c2c(-c3ccccc3)ncn2C[C@@H]2C=c3ccccc3=[NH+]2)[nH]n1,C65394084_decoy,CASP3,Decoy,0,-6.34978,-7.88,-1.5,-5.923154102516893
Cc1cccn2c(=O)cc(C[NH+]3CCC(c4cc5ccccc5[nH]4)CC3)nc12,C65967031_decoy,CASP3,Decoy,0,-5.85927,-8.72,-1.45,-6.049282226351678
O=C(Nc1ccccc1N1CCc2sccc2C1)N1CC[C@@H]([NH+]2CCCC2)C1,C66159903_decoy,CASP3,Decoy,0,-7.26597,-6.42,-5.44,-5.626180741172325
Cc1cc(C)c(CNC(=O)N(C)C2CC[NH+](C3CCOCC3)CC2)c(C)c1,C66191320_decoy,CASP3,Decoy,0,-7.74141,-6.02,-2.99,-6.030105349405095
Cc1ncsc1CN(C)C(=O)NC1CC[NH+](C2CCC(C)CC2)CC1,C66599233_decoy,CASP3,Decoy,0,-7.53837,-4.94,-2.18,-5.355504340691178
C=C(C)C[NH+]1CCC(NC(=O)C(=O)N2CCCc3cc(F)cc(C)c32)CC1,C66999867_decoy,CASP3,Decoy,0,-5.1371,-6.61,-3.18,-4.711043496682607
CC(=O)Nc1ccc(/C=C/C(=O)N2C[C@@H]([NH+](C)C)Cc3ccccc32)cc1,C67203820_decoy,CASP3,Decoy,0,-7.17605,-6.88,-1.4,-5.449547510203715
Cc1cccc(-c2ccc(C(=O)N3C[C@H]([NH+](C)C)Cc4ccccc43)c(=O)[nH]2)c1,C67208109_decoy,CASP3,Decoy,0,-7.25289,-7.37,-1.56,-4.983364119291577
CC[NH+]1CCC(NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)CC1,C67590064_decoy,CASP3,Decoy,0,-7.86094,-5.15,-1.13,-5.392973615785116
C[NH+](C)Cc1ccccc1-c1ccc2n(c1=O)C[C@H]1C[C@@H]2C[NH+](Cc2ccc(CO)o2)C1,C04237329_decoy,CASP3,Decoy,0,-8.6925,-6.64,-3.03,-6.282994275466415
C[NH+]1CCN(c2ncnc3c2sc2[nH+]c(N4CCOCC4)c4c(c23)CCC4)CC1,C04313140_decoy,CASP3,Decoy,0,-7.85184,-6.93,-2.13,-5.922018616579999
COc1ccc(-c2n[nH]cc2C[NH+]2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)cc1,C04302774_decoy,CASP3,Decoy,0,-7.20421,-6.01,-1.19,-5.2663626306738704
O=c1cccc2n1C[C@H]1C[C@@H]2C[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNS(=O)(=O)c2cccs2)C1,C08635609_decoy,CASP3,Decoy,0,-8.83044,-8.25,-2.1,-6.703858046015238
COc1cc2c(cc1OC)[C@@H](c1cccs1)[NH+](CN1C(=O)NC3(CC[NH+](C)CC3)C1=O)CC2,C08851296_decoy,CASP3,Decoy,0,-9.527,-6.6,-4.54,-6.799562794042937
CN(C)/C=N/c1[nH+]c(N2CCN(c3[nH+]cc(C(F)(F)F)cc3Cl)CC2)c(C#N)cc1C#N,C08925779_decoy,CASP3,Decoy,0,-7.63351,-6.31,-0.93,-5.727852334826183
c1nc(NCC[NH+]2CCOCC2)c2sc3[nH+]c(N4CCOCC4)c4c(c3c2n1)CCCC4,C10013958_decoy,CASP3,Decoy,0,-8.57238,-6.98,-1.66,-7.218741792339948
C[C@@H]1C[NH+](Cc2ccc3c(c2)C[NH+](Cc2cccn2-c2cccnc2)CCO3)C[C@H](C)O1,C12023098_decoy,CASP3,Decoy,0,-7.45097,-5.83,-2.83,-4.808638029943541
Cc1nc2sccn2c1C[NH+]1CCOc2ccc(C[NH+]3C[C@@H](C)O[C@@H](C)C3)cc2C1,C11790027_decoy,CASP3,Decoy,0,-7.77069,-6.73,-2.04,-5.47673519002106
Cn1nc(C(=O)NCC[NH+]2CCCCC2)c2c1CC[C@H]([NH+]1CCCCCCC1)C2,C14733717_decoy,CASP3,Decoy,0,-7.45028,-6.25,-1.37,-5.1971232352774885
O=C(c1cnn(-c2ccc(Cl)cc2)c1C1CC[NH2+]CC1)N1CC[NH+](C2CCCCC2)CC1,C15722072_decoy,CASP3,Decoy,0,-8.89172,-7.96,-4.0,-7.8100371126721315
[NH2+]=c1c2c(ncn1CC[NH+]1CCOCC1)Oc1c(ccc3ccccc13)[C@@H]2c1ccccc1,C09210153_decoy,CASP3,Decoy,0,-8.34794,-7.54,-1.78,-6.276516805803435
Cc1ccccc1-c1ncc(C[NH+]2C[C@H]3CCC[C@@H](C2)C3(O)c2[nH+]ccn2C)cn1,C19237539_decoy,CASP3,Decoy,0,-6.8937,-6.87,-1.36,-5.5257285892392565
CC1CCC(CNC(=O)C[NH+](C)[C@@H]2CCS(=O)(=O)C2)([NH+]2CCCCC2)CC1,C19655252_decoy,CASP3,Decoy,0,-7.98094,-4.96,-2.16,-6.073398193388972
O[C@H]1C[NH+](Cc2cnn(-c3ccccc3F)c2)C[C@@H]1N1CCN(c2cccc[nH+]2)CC1,C20993287_decoy,CASP3,Decoy,0,-5.74981,-6.14,-2.29,-4.86064764907824
CC[NH+]1CCN(c2nnc(-n3cccc3CN3CCN(c4cccc[nH+]4)CC3)s2)CC1,C21880885_decoy,CASP3,Decoy,0,-8.60754,-7.33,-1.83,-8.394431133602628
Cc1c(C(=O)NCCC[NH+]2CCC(C)CC2)sc2ncnc(N3CC[NH+](C)CC3)c12,C33048227_decoy,CASP3,Decoy,0,-9.95205,-7.19,-1.82,-7.49732596524813
Cc1c(C(=O)NCC[NH+]2CCC(C)CC2)sc2ncnc(N3CC[NH+](C)CC3)c12,C33048303_decoy,CASP3,Decoy,0,-9.38233,-5.7,-1.21,-6.952685806008087
Cn1cccc1C[NH+]1CCc2nc(N3CC[NH+](C)CC3)nc(N3CCOCC3)c2C1,C34755470_decoy,CASP3,Decoy,0,-8.73202,-6.11,-2.53,-6.797374197784437
Cc1cccc([NH+]2CCN(CCNC(=O)[C@H]3CCCN(c4cc[nH+]cc4)C3)CC2)c1C,C33128892_decoy,CASP3,Decoy,0,-8.03642,-7.59,-2.74,-7.7914535052878895
Cc1nc(N2CC[NH+](C)CC2)c2c([nH+]1)CCN(C(=O)C13CC4CC(CC(C4)C1)C3)C2,C35470250_decoy,CASP3,Decoy,0,-8.24249,-7.35,-4.54,-7.115362776203563
COC(=O)[C@@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)[C@H](C)[NH+]1CCSCC1,C38605014_decoy,CASP3,Decoy,0,-8.03857,-5.41,-1.68,-7.260517253474131
COC(=O)[C@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)[C@H](C)[NH+]1CCC(C)CC1,C38605644_decoy,CASP3,Decoy,0,-8.46341,-6.44,-0.85,-7.143519011915565
COC(=O)[C@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)[C@H](C)[NH+]1CCC[C@@H](C)C1,C38605664_decoy,CASP3,Decoy,0,-7.73993,-6.17,-1.19,-7.464202840175543
CCNC(=O)c1nn(CC2CC2)c2c1C[NH+](C[C@H]1C=c3ccccc3=[NH+]C1=O)CC2,C39352659_decoy,CASP3,Decoy,0,-7.73307,-7.28,-3.14,-5.363292837261957
C1=N[C@H]2CC[NH+](CC3=CN=[NH+][C@@H]3c3ccc4c(c3)OCO4)[C@@H](c3ccccn3)C2=N1,C39444914_decoy,CASP3,Decoy,0,-8.04653,-6.83,-0.96,-6.428690632447768
COc1ccc2c(c1)=C[C@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)[NH+]1CCC(C)CC1)C(=O)[NH+]=2,C39699342_decoy,CASP3,Decoy,0,-7.56351,-7.79,-1.76,-6.289973977761328
COCCn1nnnc1[C@@H]([C@@H]1C=c2cc3c(cc2=[NH+]C1=O)OCO3)[NH+]1CCC[C@H](C)C1,C39699356_decoy,CASP3,Decoy,0,-7.33012,-5.5,-1.79,-5.600371124965426
CCc1ccc2c(c1)=C[C@@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)N1CC[NH+](C)CC1)C(=O)[NH+]=2,C39710438_decoy,CASP3,Decoy,0,-6.68568,-6.61,-2.03,-5.872255622803916
O=C1[NH+]=c2ccccc2=[NH+][C@H](C(F)(F)F)/C1=N\N[C@@H]1C=C(c2ccccc2)N=N1,C39738293_decoy,CASP3,Decoy,0,-5.62866,-6.17,-2.13,-3.4409996372844254
CN1C[C@H](/C=C/[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)C(c2ccc3c(c2)OCCCO3)=N1,C39992080_decoy,CASP3,Decoy,0,-7.65481,-7.61,-1.99,-5.881918316911507
COc1ccc([C@H]2c3ccc4ccccc4c3Oc3nc[n+](CCC[NH+](C)C)c(N)c32)cc1,C49748036_decoy,CASP3,Decoy,0,-6.98728,-6.54,-1.67,-6.046556960825583
COc1cccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(CCC[NH+](C)C)CC(=O)N32)c1,C63137947_decoy,CASP3,Decoy,0,-6.5708,-6.49,-2.21,-6.161528497140995
O=C1[C@@H]2CC3=c4ccccc4=[NH+][C@H]3[C@H](c3ccccc3)N2C(=O)CN1CCCn1cc[nH+]c1,C63139041_decoy,CASP3,Decoy,0,-7.04884,-6.22,-4.07,-5.611232494372937
O=C1[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@@H](c3cccc([N+](=O)[O-])c3)N2C(=O)CN1CCCn1cc[nH+]c1,C63139153_decoy,CASP3,Decoy,0,-7.67499,-7.51,-1.18,-8.698314437061436
CN1C(=O)[C@H]2[C@H](N=C(Br)N2CCSC2[NH+]=c3ccccc3=[NH+]2)N(C)C1=O,C63249856_decoy,CASP3,Decoy,0,-6.59333,-6.81,-1.9,-5.305780204163724
CN1CCN(S(=O)(=O)c2ccc(SC3[NH+]=c4ccccc4=[NH+]3)c3nsnc23)CC1,C63312612_decoy,CASP3,Decoy,0,-8.11375,-5.95,-2.42,-5.195913946238775
Cc1ccc2c(c1)=[NH+][C@@H](CCNC(=O)C1CCN([C@@H]3N=N[C@H](N4CCCCC4=O)S3)CC1)[NH+]=2,C63666891_decoy,CASP3,Decoy,0,-9.18821,-8.44,-0.72,-7.917182637126737
Cc1ccc2c(c1)=[NH+][C@H](CCNC(=O)C1CCN([C@@H]3N=N[C@H](N4CCCCC4=O)S3)CC1)[NH+]=2,C63666894_decoy,CASP3,Decoy,0,-8.20512,-6.74,-0.51,-5.576527345402655
CC[NH+]1CCN(CN2N[C@H](C3=c4ccccc4=[NH+]C3)N(C[C@H]3CCCO3)C2=S)CC1,C63775697_decoy,CASP3,Decoy,0,-7.88093,-5.59,-2.15,-7.345400794439353
CCc1oc(C(=O)NC[C@@H]2C=c3ccc(F)cc3=[NH+]C2=O)cc1C[NH+]1CCCC1,C63868085_decoy,CASP3,Decoy,0,-7.99914,-8.14,-1.77,-5.995652861382573
COCCN1C(=O)N(C2Cc3ccccc3C2)C(=O)C12CC[NH+](C[C@H]1C=c3ccccc3=[NH+]1)CC2,C63985510_decoy,CASP3,Decoy,0,-9.13802,-7.39,-2.72,-6.509147518125153
CCOc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCn2cc[nH+]c2C)cc1,C64006734_decoy,CASP3,Decoy,0,-7.19293,-6.49,-2.03,-6.492657918551329
O=C(NC[C@H]1CCC[NH+](Cc2ccc3nsnc3c2)C1)[C@H]1C=c2ccccc2=[NH+]1,C64031670_decoy,CASP3,Decoy,0,-7.49589,-6.84,-1.03,-6.785486637457892
CC(=O)Nc1ccc(C[NH+]2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2cnn(C(C)C)c2)s1,C64061411_decoy,CASP3,Decoy,0,-7.98885,-7.98,-1.95,-7.360470889144327
COC(=O)[C@H]1CC(=O)N(C)C12CC[NH+]([C@H](C)CCC1=c3ccccc3=[NH+]C1)CC2,C64061614_decoy,CASP3,Decoy,0,-8.46662,-5.62,-1.2,-6.114572846047513
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@H]1[C@H]2CCCC2=NN1[C@@H]1CCS(=O)(=O)C1,C64409189_decoy,CASP3,Decoy,0,-8.96869,-6.48,-1.97,-6.645378023748908
CC(C)[C@@H]1N=[NH+][C@@H](c2ccc[nH+]c2N2CCN(C(=O)[C@@H]3C=C(c4ccccc4)N=N3)CC2)O1,C65118027_decoy,CASP3,Decoy,0,-6.95542,-7.93,-1.91,-5.633408178806953
CC[NH+]1CCN(c2cc(C)nc3nc(CN4CC[NH+](C5CCCCC5)CC4)nn23)CC1,C65311644_decoy,CASP3,Decoy,0,-8.13301,-5.83,-1.4,-5.077989072171717
COc1ccc2c(c1)=[NH+][C@H](C1=C[C@@H]3CN(C(=O)c4cnc(C)cn4)CCCN3N1)[NH+]=2,C65373503_decoy,CASP3,Decoy,0,-6.3821,-5.93,-0.99,-4.244198104439229
COc1ccc(-n2cc(-c3ccccc3)c3c(NCCCO)ncnc32)cc1,C02714680_decoy,CASP3,Decoy,0,-7.96563,-5.75,-1.11,-5.862043834682583
COC(=O)c1c(NC(=O)Cc2cccs2)sc(C(=O)NC(C)C)c1C,C02881321_decoy,CASP3,Decoy,0,-7.94033,-5.93,-1.68,-6.111439522182852
CCOC(=O)c1sc(NC(=S)NC(=O)c2cccc(Cl)c2)nc1C,C05598509_decoy,CASP3,Decoy,0,-9.04445,-6.99,-1.9,-7.485208006854255
C=CCNc1nnc(SCC(=O)Nc2nc3ccc(F)cc3s2)s1,C05784820_decoy,CASP3,Decoy,0,-10.4189,-7.08,-1.04,-7.187671271431498
CCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccc(Cl)s2)cc1,C02644946_decoy,CASP3,Decoy,0,-8.44513,-5.5,-2.02,-6.187177768329113
CCOC(=O)CNC(=O)N[C@H](C)c1c(-n2cccc2)sc2c1CCCC2,C06768651_decoy,CASP3,Decoy,0,-7.46603,-5.68,-2.16,-6.962703991189405
Cc1ccc(NC(=O)CSCC(=O)Nc2nnc(C(C)(C)C)s2)cc1,C08333963_decoy,CASP3,Decoy,0,-8.49226,-5.31,-1.18,-6.262197358701501
CCOc1c(Br)cc(C(=O)NNC(=O)CC(C)(C)C)cc1OC,C12866959_decoy,CASP3,Decoy,0,-7.30183,-6.44,-1.55,-6.159585600927306
Cc1cccc(C(=O)NCC(=O)O[C@@H](C)C(=O)c2c(C)[nH]c3ccccc23)c1,C15228765_decoy,CASP3,Decoy,0,-5.43618,-7.09,-2.0,-5.472866325095909
CCc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)nc(C)n3CC)cc1,C19169046_decoy,CASP3,Decoy,0,-6.26681,-8.14,-1.95,-5.409805017001692
CC(=O)c1sc(NC(=O)CCNC(=O)C(C)(C)C)nc1-c1ccccc1,C25245680_decoy,CASP3,Decoy,0,-7.51808,-5.67,-2.13,-6.004303267771259
Cc1ccc(-c2nc(CSc3nnc(SCC(N)=O)s3)co2)cc1,C26313093_decoy,CASP3,Decoy,0,-9.50637,-6.9,-2.03,-7.015739997516063
CCOC(=O)c1c(NC(=S)NC(=O)c2ccco2)sc2c1CCCC2,C00625290_decoy,CASP3,Decoy,0,-6.32501,-5.42,-4.76,-4.678242745184354
COC(=O)[C@](NC(=O)c1ccc(C)cc1)(Nc1cccc(C)n1)C(F)(F)F,C19944481_decoy,CASP3,Decoy,0,-6.22227,-6.16,-0.99,-6.45000983114873
CCCn1c(S[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)n[nH]c1=O,C07364846_decoy,CASP3,Decoy,0,-5.78253,-7.13,-1.04,-6.562679775976304
CC(=O)NCCCc1nc2ccccc2n1CC(=O)Nc1ccc(C)cc1C,C40299875_decoy,CASP3,Decoy,0,-7.13228,-7.33,-2.03,-7.148851154215277
CCCc1cc2c(c(=O)n1CC)[C@@H](c1ccccc1)C(C(=O)OCC)=C(N)O2,C40569743_decoy,CASP3,Decoy,0,-7.6185,-5.14,-6.39,-5.90562704584194
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)N[C@H]2CCc3ccccc32)cc1,C41197615_decoy,CASP3,Decoy,0,-6.91785,-6.73,-1.31,-6.066119364496183
CCCCc1ccc(NC(=O)C(=O)NC2CCN(C(=O)C(C)C)CC2)cc1,C41484751_decoy,CASP3,Decoy,0,-7.35381,-5.36,-1.42,-4.38793587882835
CCOCCCNC(=O)C1CCN(C(=O)Nc2cccc3c2CCCC3)CC1,C43316387_decoy,CASP3,Decoy,0,-7.54962,-7.18,-2.05,-6.813204367452943
CCOC(=O)Cc1csc(NC(=O)CC23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)n1,C45730696_decoy,CASP3,Decoy,0,-8.8548,-7.33,-1.44,-7.186703343924624
CC(C)Oc1ccccc1CNC(=O)N[C@@H](c1ccccc1)c1nccn1C,C56477952_decoy,CASP3,Decoy,0,-7.27297,-5.25,-1.59,-6.160322489492054
C[C@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc(Cn2ccccc2=O)cc1,C56681319_decoy,CASP3,Decoy,0,-7.18573,-7.13,-3.24,-6.211851866573951
COc1ccc(CN(C)C(=O)NCCCc2nc3ccccc3s2)cc1O,C57816911_decoy,CASP3,Decoy,0,-9.14294,-4.7,-1.49,-6.223688328055189
CC(C)(C)OC(=O)NCCC(=O)Nc1nc(-c2ccccc2Cl)cs1,C57883357_decoy,CASP3,Decoy,0,-7.40277,-5.6,-1.72,-5.218396770374405
CC(C)[C@H](NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O)c1cccs1,C07121946_decoy,CASP3,Decoy,0,-8.9732,-6.1,-1.41,-7.119189492947073
Cc1cccc(N/C(=N\C(=O)c2cccc(N(C)C)c2)NC[C@@H]2CCCO2)c1,C46130438_decoy,CASP3,Decoy,0,-9.15437,-7.22,-3.11,-8.254807268675965
Cc1ccc(NC(=O)CSc2nnc(NC[C@H]3CCCO3)s2)cc1F,C16330727_decoy,CASP3,Decoy,0,-7.43527,-6.01,-1.38,-5.450018766275608
CCN(CCNC(=O)Nc1cc(C(=O)N(C)C)ccc1C)c1ccccc1C,C61554232_decoy,CASP3,Decoy,0,-6.81102,-4.73,-2.75,-5.455032412282272
CC(C)Sc1ccccc1C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1,C61563095_decoy,CASP3,Decoy,0,-7.63921,-7.69,-1.06,-7.74244004856096
Cc1oc(-c2ccc(C(C)C)cc2)nc1CC(=O)NCC1(CO)CCOCC1,C62510873_decoy,CASP3,Decoy,0,-7.68433,-6.22,-0.95,-6.157186009906774
CCS(=O)(=O)c1ccccc1NC(=O)NC[C@@H](C)N(C)c1ccccc1,C62580145_decoy,CASP3,Decoy,0,-6.66516,-7.63,-2.47,-6.526262178179753
CCCS(=O)(=O)N1CCC(NC(=O)NCCc2ccccc2Cl)CC1,C63070029_decoy,CASP3,Decoy,0,-6.54073,-5.38,-4.03,-5.306040619706817
CSc1ccc(C)c(C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c1,C63102482_decoy,CASP3,Decoy,0,-8.89612,-6.5,-0.65,-6.554188754490993
CC1=NN(c2ccc(C(=O)NCCCNC(=O)c3ccccc3F)cc2)CC1,C63328284_decoy,CASP3,Decoy,0,-7.56853,-6.31,-2.89,-5.280279082074589
C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1,C63390108_decoy,CASP3,Decoy,0,-7.76495,-6.59,-1.39,-6.852433780319434
COc1ccc(S(=O)(=O)NCCc2ccc(C)cc2C)cc1NC(C)=O,C65278280_decoy,CASP3,Decoy,0,-7.10457,-7.3,-2.0,-8.00619062794027
COc1ccc(CC[C@@H](C)NC(=O)Nc2nnc(C(F)(F)F)s2)cc1,C65358853_decoy,CASP3,Decoy,0,-7.64537,-5.76,-1.9,-7.076695570285457
CCCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(C)=O)c2)c1C,C66327282_decoy,CASP3,Decoy,0,-7.32355,-5.8,-1.29,-5.721556383266482
O=C(/C=C/c1ccc(N2CCCC2=O)cc1)NNC(=O)CCC1CCCCC1,C66555808_decoy,CASP3,Decoy,0,-8.21123,-6.68,-1.79,-5.377473509550071
O=C(CCC1CCCCC1)NNC(=O)[C@H](c1ccccc1)N1CCCCC1=O,C66623468_decoy,CASP3,Decoy,0,-8.66871,-5.91,-1.7,-6.377269463961158
CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)C[C@@H](C)NC(=O)C1CCCCC1,C66644627_decoy,CASP3,Decoy,0,-7.45594,-6.6,-1.22,-9.797627226031391
CC(C)CNC(=O)[C@H]1CSCN1C(=O)C[C@@H](C)NC(=O)C1CCCCC1,C66644661_decoy,CASP3,Decoy,0,-9.53649,-5.3,-1.81,-6.635699071843422
Cn1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2F)c2ccccc21,C67132451_decoy,CASP3,Decoy,0,-7.25903,-7.36,-4.3,-6.2911734056
COc1ccc2oc(C)c(C(=O)NC[C@H](O)COc3ccc(F)cc3)c2c1,C67146171_decoy,CASP3,Decoy,0,-8.12552,-6.53,-1.02,-8.15056555559519
CCCCNC(=O)CSc1nc2cc(C)[nH]c2c(=O)n1-c1ccc(C)cc1,C67236947_decoy,CASP3,Decoy,0,-7.57786,-6.71,-3.89,-7.167243845456808
CCOc1ccc(NC(=O)NCc2c(C)nn(CC)c2C)c(C(F)(F)F)c1,C67281889_decoy,CASP3,Decoy,0,-7.65009,-6.76,-2.01,-7.03729092744474
CCOc1ccc(C#N)cc1NC(=O)C(=O)N[C@@H](c1ccc(C)cc1)C1CC1,C67327719_decoy,CASP3,Decoy,0,-7.58525,-5.9,-1.2,-6.026122439717481
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NCc1ccc([C@@H]2C[C@@H]2C)o1,C67529377_decoy,CASP3,Decoy,0,-6.84832,-5.72,-1.28,-4.8689907143754025
COc1ccc(CNC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)c(OC)c1OC,C67563530_decoy,CASP3,Decoy,0,-7.56539,-7.03,-0.84,-6.065425785561163
CC(=O)OC[C@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C03956708_decoy,CASP3,Decoy,0,-5.54213,-7.34,-3.59,-5.964099868119651
COc1ccc(-c2nnn(CC(=O)N(CC(=O)NCCC(C)C)c3ccc(C(C)C)cc3)n2)cc1OC,C06133987_decoy,CASP3,Decoy,0,-7.58424,-7.86,-2.23,-8.868427346832796
Cc1ccc(S(=O)(=O)ON(CCOc2ccccc2[N+](=O)[O-])CCOc2ccccc2[N+](=O)[O-])cc1,C05369245_decoy,CASP3,Decoy,0,-6.13174,-7.51,-3.37,-6.363056025138926
CC[C@H](C)OC(=O)[C@H](C)OC(=O)OCCOCCOC(=O)O[C@H](C)C(=O)O[C@@H](C)CC,C04353199_decoy,CASP3,Decoy,0,-8.29915,-5.02,-2.65,-7.71335078941202
COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)CCn3nc(C)cc3C)c2C)c1,C08727009_decoy,CASP3,Decoy,0,-8.96847,-7.57,-1.84,-7.463643354896599
CCOCCn1/c(=N/C(=O)c2cc(OCC)c(OCC)c(OCC)c2)sc2cc([N+](=O)[O-])ccc21,C08998386_decoy,CASP3,Decoy,0,-7.42169,-6.34,-2.47,-6.261691998041435
CCOC(=O)c1sc(NC(=O)[C@H](C)Sc2nnc(NC(=O)CC)s2)c(C(=O)OCC)c1C,C09347487_decoy,CASP3,Decoy,0,-8.93533,-6.29,-2.3,-7.428245855954681
CCn1c(SCC(=O)OCC(=O)NCc2ccc(C(=O)OC)cc2)nnc1-c1ccco1,C09398562_decoy,CASP3,Decoy,0,-6.38942,-4.75,-2.36,-5.166004675248682
CCCOC(=O)c1c(NC(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)sc(C(=O)OC)c1C,C09673317_decoy,CASP3,Decoy,0,-7.7883,-5.39,-1.39,-6.234298649776932
Cc1ccc(C(=O)Oc2ccc(C(=O)COC(=O)CNC(=O)CNC(=O)c3ccco3)cc2)cc1,C10041519_decoy,CASP3,Decoy,0,-7.68709,-7.91,-3.45,-8.102017921961929
CCOc1ccc(C(=O)NCCOc2ccc3nnc(-c4ccc(OC)c(OC)c4)n3n2)cc1OCC,C13527677_decoy,CASP3,Decoy,0,-8.3648,-5.84,-2.86,-7.154716261075247
CCCCOC(=O)C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1,C14639823_decoy,CASP3,Decoy,0,-7.96993,-6.39,-0.85,-6.877859314751908
CCOC(=S)S[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1NC(C)=O,C15922344_decoy,CASP3,Decoy,0,-7.3062,-5.56,-3.46,-6.715056090458675
COC(=O)[C@]1(Oc2cc(OC)ccc2[N+](=O)[O-])OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16321762_decoy,CASP3,Decoy,0,-4.73007,-6.46,-1.91,-6.048841623730627
CCCc1ccc(OCc2cc(C=NNC(=O)c3ccc(Cn4cc([N+](=O)[O-])cn4)o3)ccc2OC)cc1,C19840243_decoy,CASP3,Decoy,0,-6.94932,-7.26,-2.86,-5.94455761675003
CC(=O)OC[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@]1(O)OC(C)=O,C19911816_decoy,CASP3,Decoy,0,-4.94765,-6.23,-1.2,-5.346956574837584
CC(=O)OC[C@H]1O[C@H](OCCBr)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22053201_decoy,CASP3,Decoy,0,-6.69998,-5.22,-4.95,-6.066864181808166
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2c(C(=O)OC)sc(N)c2C(=O)OC)c1C,C22561105_decoy,CASP3,Decoy,0,-8.3773,-5.54,-1.59,-8.210666310831007
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1,C27024246_decoy,CASP3,Decoy,0,-7.95559,-6.65,-1.44,-7.248118758660497
COC1CCC(/C=N/[C@@H]2[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]2SC(C)=O)CC1,C19881078_decoy,CASP3,Decoy,0,-7.9095,-6.62,-2.74,-6.947497327540201
CCCc1ccc(OCc2cc(/C=N\NC(=O)c3ccc(Cn4cc([N+](=O)[O-])cn4)o3)ccc2OC)cc1,C32705917_decoy,CASP3,Decoy,0,-8.13355,-7.26,-3.2,-7.822683385057612
COc1ccc(CCN(Cc2ccco2)C(=O)CN(C(=O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1OC,C34852229_decoy,CASP3,Decoy,0,-8.34054,-7.73,-1.58,-8.526903928287052
CCOc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(=O)c1cc(OC)c(OC)c(OC)c1,C33959206_decoy,CASP3,Decoy,0,-7.70348,-7.92,-4.0,-6.914106212680583
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O,C14416829_decoy,CASP3,Decoy,0,-7.52291,-6.34,-1.5,-9.316073395720563
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)c1cn(C(C)=O)c(=O)n1C(C)=O,C35182974_decoy,CASP3,Decoy,0,-7.72232,-7.1,-3.75,-8.527037515838108
C=CCN1C(=O)[C@@H](CC(=O)OC)S/C1=N/c1ncn(CC(=O)OCC)c1C(=O)OCC,C08695036_decoy,CASP3,Decoy,0,-7.69666,-5.04,-1.44,-6.637172868670775
Cc1ccc(C(=O)N(CCCN2CCOCC2)CC(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-],C35765368_decoy,CASP3,Decoy,0,-8.04167,-7.47,-2.12,-7.263500056359434
C=COCCNC(=S)N1CCOCCOCCN(C(=S)NCCOC=C)CCOCCOCC1,C06073594_decoy,CASP3,Decoy,0,-8.66613,-4.85,-2.25,-9.49139215976342
CCOC(=O)c1sc(NC(=O)CCCn2nc([N+](=O)[O-])cc2C)c(C(=O)OCC)c1C,C08682556_decoy,CASP3,Decoy,0,-8.85133,-7.15,-2.48,-8.260276922486712
CCOC(=O)c1sc(NC(=O)CCCn2nc([N+](=O)[O-])c(Cl)c2C)c(C(=O)OCC)c1C,C08682548_decoy,CASP3,Decoy,0,-7.3519,-8.01,-2.28,-7.886257489996978
CCOC(=O)CSc1nnc(-c2nnc(SCC(=O)OCC)n2CC)n1CC,C04034520_decoy,CASP3,Decoy,0,-8.70188,-5.22,-0.9,-8.397876104969203
CC(=O)OC[C@H]1O[C@@H](Oc2ccccc2C=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C39333770_decoy,CASP3,Decoy,0,-5.87925,-5.56,-2.9,-6.1707958916332
CC(=O)OC[C@H]1O[C@@H](Oc2ccccc2C=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C39333772_decoy,CASP3,Decoy,0,-5.23756,-7.25,-3.72,-5.656953514220379
C=CCn1c(CCNC(=O)c2ccc(OC)cc2)nnc1S[C@@H](C)C(=O)Nc1nnc(CC)s1,C39744601_decoy,CASP3,Decoy,0,-9.22935,-7.08,-2.62,-8.795037046401363
C=CCn1c(CCNC(=O)c2ccc(OC)cc2)nnc1SCC(=O)c1ccc(C)c([N+](=O)[O-])c1,C39752728_decoy,CASP3,Decoy,0,-7.07338,-7.57,-3.2,-5.926219891719457
CCCn1c2ccccc2c2nnc(SC3=NC(=O)N=C3C(=O)CCCCC(=O)OCC)nc21,C09191424_decoy,CASP3,Decoy,0,-8.04441,-6.17,-1.59,-7.702985068989918
COc1ccc(CCNc2oc(Cc3ccc([N+](=O)[O-])cc3)nc2P(=O)(OC)OC)cc1OC,C39915604_decoy,CASP3,Decoy,0,-5.91528,-7.29,-2.33,-5.789340710921417
C=CCn1c(SCC(=O)Nc2sc(C(=O)OCC)c(C)c2C(=O)OC)nnc1-c1cccnc1,C39973253_decoy,CASP3,Decoy,0,-9.91306,-7.73,-2.44,-10.850945486979024
COCCN(CCOC)c1ncnc(N(Cc2ccccc2)c2ccccn2)c1[N+](=O)[O-],C40618357_decoy,CASP3,Decoy,0,-7.07649,-5.19,-2.86,-7.561698152297666
CCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C\c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc2OC)cc1OC,C40852709_decoy,CASP3,Decoy,0,-7.6739,-7.46,-1.01,-6.820738402935256
C=CCn1c(CCc2cnn(C)c2C)nnc1SCc1nc(NC)ncc1C(=O)OCC,C41345325_decoy,CASP3,Decoy,0,-9.24984,-6.65,-3.81,-7.569827792303351
CCOC(=O)c1cnc(N(C)C)nc1CSc1nnc(CCc2cn(CC)nc2C)n1C(C)C,C41347003_decoy,CASP3,Decoy,0,-8.94766,-7.04,-2.68,-7.676997366611743
C=CCn1c(COc2ccc(OC)cc2)nnc1SCc1nc(N)ncc1C(=O)OCC,C41661830_decoy,CASP3,Decoy,0,-8.64224,-6.59,-1.46,-6.456318790523824
CC(=O)OC[C@@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44170273_decoy,CASP3,Decoy,0,-5.49695,-7.41,-3.94,-6.848864789591906
CCOC(=S)S[C@@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C44170945_decoy,CASP3,Decoy,0,-6.61775,-5.53,-2.09,-6.312031981010756
CCOC(=O)Cn1nnnc1[C@H](C(C)C)N(Cc1ccc2c(c1)OCO2)Cc1cc2cc(CC)ccc2[nH]c1=O,C01333884_decoy,CASP3,Decoy,0,-8.72926,-7.62,-3.73,-8.21563365179149
CCC[C@@H](c1nnnn1CC(=O)OCC)N(Cc1cc2c(C)cc(C)cc2[nH]c1=O)C[C@@H]1CCCO1,C13499590_decoy,CASP3,Decoy,0,-10.4417,-7.65,-4.39,-9.029819322480236
CCC[C@@H](c1nnnn1CC(=O)OCC)N(Cc1ccco1)Cc1cc2cc(C)ccc2[nH]c1=O,C13500923_decoy,CASP3,Decoy,0,-7.71488,-7.64,-1.84,-7.151764149924192
CCOc1cc(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(=O)c1cc(OC)c(OC)c(OC)c1,C34984013_decoy,CASP3,Decoy,0,-6.77741,-7.77,-1.73,-6.37497296274313
C=C/C=C/OCC(=O)N=c1c(C(=O)OCC)cc2c(=O)n3ccccc3nc2n1CCCOCC,C13029511_decoy,CASP3,Decoy,0,-7.74535,-5.74,-2.33,-7.171792188940452
COc1cc(C(=O)NNC(=S)Nc2cnn(Cc3ccccc3C)c2)ccc1OC(F)F,C02797918_decoy,CASP3,Decoy,0,-7.91748,-6.18,-1.9,-7.610076517218825
C=CCn1c(SCC(=O)Nc2ccc(Cl)cc2C)nnc1[C@@H](CO)NC(=O)c1ccccc1,C01050438_decoy,CASP3,Decoy,0,-8.99316,-8.0,-2.58,-7.934404319094914
CC[C@@H](C)c1ccc([C@H](NC(=O)CCNS(=O)(=O)c2ccc(NC(C)=O)cc2)C(C)C)cc1,C08879286_decoy,CASP3,Decoy,0,-7.83647,-6.05,-1.33,-6.244024721315062
CCCCn1c(N)c(N(CCC)C(=O)CCCSc2ccc(F)cc2)c(=O)[nH]c1=O,C03279276_decoy,CASP3,Decoy,0,-7.29655,-6.43,-1.85,-6.667203013287603
CCCCCCOc1ccc(C(=O)NC(=S)NNC(=O)COCC)cc1Br,C10286157_decoy,CASP3,Decoy,0,-9.85665,-5.27,-1.57,-6.643229382227691
O=C(COC(=O)CCCc1c[nH]c2ccccc12)Nc1ccccc1C(=O)NC1CCCC1,C10624539_decoy,CASP3,Decoy,0,-6.27276,-6.8,-2.81,-6.50221878255359
C=CCNc1nnc(SCC2=C(C(=O)OCC)[C@@H](c3ccc(Cl)cc3)NC(=O)N2)s1,C11285294_decoy,CASP3,Decoy,0,-8.02779,-5.5,-3.89,-6.074636520759971
CCCCCN(C(=O)CSc1ccccc1F)c1c(N)n(CCCC)c(=O)[nH]c1=O,C11435449_decoy,CASP3,Decoy,0,-6.8871,-6.0,-3.68,-6.416809553400618
COc1ccc([C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1,C11660358_decoy,CASP3,Decoy,0,-7.50557,-6.51,-1.34,-6.3594392422622725
CCOc1ccc(/C=C/C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2)cc1,C13621131_decoy,CASP3,Decoy,0,-9.36141,-6.14,-0.86,-6.033469369961564
COc1cc(C(=O)NCCSc2ncc(C(F)(F)F)cc2Cl)cc(Cl)c1OCC(N)=O,C14527936_decoy,CASP3,Decoy,0,-9.13696,-7.45,-4.55,-7.503125530468585
CCCCN(C(=O)COc1ccc(Br)cc1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14624206_decoy,CASP3,Decoy,0,-7.59676,-6.33,-1.29,-4.908840528423124
CCCNS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cc(Br)ccc2OCC)cc1,C14655486_decoy,CASP3,Decoy,0,-9.85213,-5.74,-2.43,-6.698620620002531
CCCNS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(OCC)c(Br)c2)cc1,C14770725_decoy,CASP3,Decoy,0,-8.49502,-6.94,-1.6,-10.675631075891962
NC(=O)c1ccc(SCC(=O)NCCC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1,C15962504_decoy,CASP3,Decoy,0,-5.08287,-6.87,-2.34,-6.07834184472293
CC[NH+](CC)CC[C@@H](C)c1ccc(C)c(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1,C17945534_decoy,CASP3,Decoy,0,-7.54453,-6.74,-0.98,-9.94786456975114
NC(=O)CCN(Cc1ccccc1)C(=S)NC(=O)c1ccc(OCCOc2ccccc2)cc1,C20120224_decoy,CASP3,Decoy,0,-10.3092,-8.16,-1.3,-7.150021491573727
Cc1nc(SCC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2)sc1CC(N)=O,C21581956_decoy,CASP3,Decoy,0,-9.74642,-6.21,-4.09,-7.060427224300357
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccc(C)c(C)c2)ccc1OCCC(C)C,C21968683_decoy,CASP3,Decoy,0,-7.58575,-7.22,-1.87,-6.822733243980472
CCCc1ccc([C@H](NC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)C(C)C)cc1,C22281065_decoy,CASP3,Decoy,0,-9.70112,-7.11,-4.14,-7.620384918759362
CCC(CC)[C@@H](CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1)N1CCOCC1,C22755871_decoy,CASP3,Decoy,0,-10.0462,-6.55,-2.85,-6.93123630005278
CCCn1c(CCC(=O)NCCCCCCC(C)C)nc2cc(S(N)(=O)=O)ccc21,C22993186_decoy,CASP3,Decoy,0,-10.7068,-7.03,-4.1,-8.208549516834639
COCCNc1nnc(SCC(=O)Nc2ccccc2C(=O)NC2CCCC2)s1,C23475156_decoy,CASP3,Decoy,0,-9.25185,-7.11,-1.64,-7.051243457990376
CCOc1ccccc1Nc1nnc(S[C@@H](C)C(=O)NCC(=O)Nc2c(C)cccc2C)s1,C23563347_decoy,CASP3,Decoy,0,-8.30189,-7.79,-2.29,-7.399356673519491
CSCC[C@H](NS(=O)(=O)c1cc(C)ccc1C)C(=O)NCCNC(=O)c1ccccc1,C25519927_decoy,CASP3,Decoy,0,-10.5388,-6.05,-1.37,-8.49259143314545
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,C27641572_decoy,CASP3,Decoy,0,-10.4899,-6.73,-3.81,-8.913168977957184
CCOc1cc(/C=C/C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)ccc1OC(F)F,C27853595_decoy,CASP3,Decoy,0,-9.38813,-7.07,-1.76,-10.078536076591949
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)CSc2cccc3cccc(Cl)c23)cc1,C28417080_decoy,CASP3,Decoy,0,-9.27064,-6.45,-1.97,-6.783837639595942
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cccc(C(F)(F)F)c2)cc1,C28417329_decoy,CASP3,Decoy,0,-8.38765,-6.57,-2.2,-5.997834570482174
Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C(=O)CCCCCNC(N)=O)cc1C,C32820355_decoy,CASP3,Decoy,0,-7.2705,-6.99,-2.88,-6.548407452532908
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC1CCCCC1)c1ccc(O)cc1,C36519181_decoy,CASP3,Decoy,0,-7.39604,-5.2,-1.45,-6.634867368020652
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(CCC)C(=O)C(O)(c1ccccc1)c1ccccc1,C36573209_decoy,CASP3,Decoy,0,-9.68226,-5.75,-2.43,-8.671235883276692
CCCOc1ccc([C@H]2c3c(-c4cc(Cl)ccc4O)n[nH]c3C(=O)N2CCCO)cc1OCC,C39898102_decoy,CASP3,Decoy,0,-8.48183,-6.11,-1.98,-7.427029615679752
CCCCOc1ccc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCO)cc1OCC,C38705891_decoy,CASP3,Decoy,0,-8.48355,-6.04,-3.95,-8.229812352211974
COc1cccc(CNCCc2ccc(S(N)(=O)=O)cc2)c1OCc1ccccc1C,C40722318_decoy,CASP3,Decoy,0,-7.93317,-7.54,-3.33,-7.210840131923287
CCCCOc1c(Br)cc(/C=N/NC(=O)CSc2nnc(N)s2)cc1OC,C40947150_decoy,CASP3,Decoy,0,-9.45505,-5.57,-2.32,-6.990798718301691
CCCSc1nc2n(n1)[C@H](c1ccc(OCc3ccccc3)c(OCC)c1)C(C(N)=O)=C(C)N2,C40981106_decoy,CASP3,Decoy,0,-7.89601,-6.28,-2.19,-6.503390039702766
CCCSc1nc2n(n1)[C@H](c1ccc(OCCc3ccccc3)c(OC)c1)C(C(N)=O)=C(C)N2,C40981427_decoy,CASP3,Decoy,0,-7.99867,-6.13,-1.04,-6.087128546176032
O=C([O-])[C@H](C[NH2+]CCc1ccccn1)[C@H](NCCc1ccccn1)c1ccc(Cl)cc1,C43208967_decoy,CASP3,Decoy,0,-6.63403,-6.64,-2.09,-5.913998744083857
CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(C3(O)CC3)cn2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1,C45358262_decoy,CASP3,Decoy,0,-9.56447,-6.1,-1.39,-6.961601271465954
COc1cc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)cc(Cl)c1OCC(C)C,C16974117_decoy,CASP3,Decoy,0,-8.68381,-5.74,-1.47,-6.588157001182156
O=C(CCCNC(=O)c1ccc(Cl)cc1)NC[C@H](O)COc1ccc(C(F)(F)F)cc1,C48353701_decoy,CASP3,Decoy,0,-6.87767,-7.84,-0.82,-6.074288427655332
O=C(CCCNC(=O)c1ccc(Cl)cc1)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1,C48353702_decoy,CASP3,Decoy,0,-6.16913,-6.82,-1.53,-5.670775183279433
CCCCNS(=O)(=O)c1cccc(NC(=O)c2[nH]c(C)c(C(=O)OC(C)C)c2C)c1,C15537705_decoy,CASP3,Decoy,0,-8.221,-7.56,-1.35,-10.267945824232138
CC(/C=C/c1ccccc1)=N\NC(=O)CCCSc1nnc(CCc2ccccc2)n1N,C58991438_decoy,CASP3,Decoy,0,-6.52536,-4.73,-1.93,-4.444076642588151
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3cccc(C)c3)n[nH]2)cc1,C59005453_decoy,CASP3,Decoy,0,-8.55737,-6.49,-2.43,-6.281672227273519
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccccc2Cl)n1,C59015197_decoy,CASP3,Decoy,0,-9.28492,-6.63,-2.82,-6.270261761453843
C=CCn1c(CNc2ccccc2)nnc1S[C@H](C)C(=O)N/N=C(\C)c1ccccc1O,C59829647_decoy,CASP3,Decoy,0,-9.3669,-7.85,-2.49,-7.552929805698386
C=CCNS(=O)(=O)c1ccc(NC(=S)NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc1,C66199684_decoy,CASP3,Decoy,0,-8.31327,-6.46,-2.0,-6.640718168466264
CC(C)Cc1ccc([C@@H](C)C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1,C66199917_decoy,CASP3,Decoy,0,-10.5308,-7.14,-1.8,-7.749161905649636
Cc1nnc(-c2cnn(C)c2N)n1CCNc1[nH+]cc(C(F)(F)F)cc1Cl,C05753238_decoy,CASP3,Decoy,0,-7.78104,-5.76,-1.49,-5.860208308417357
CC(=O)NCCNC(=O)[C@H]1C[NH+]2CC[C@H]1C[C@@H]2Cn1cc(C2(O)CCCCC2)nn1,C08299083_decoy,CASP3,Decoy,0,-8.87122,-7.68,-1.98,-9.273722657086344
CCC[NH+](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1nnc(-c2ccco2)o1,C09512627_decoy,CASP3,Decoy,0,-8.33928,-7.29,-3.5,-7.316060231033444
Cc1n[nH]c(SCCNC(=O)C[C@H]2C(=O)NCC[NH+]2Cc2ccc(F)cc2Cl)n1,C11934474_decoy,CASP3,Decoy,0,-8.16859,-7.29,-2.02,-7.831191808611874
CCOC(=O)c1cnn(-c2ccc(C(=O)NCCCN3CC[NH+](C)CC3)cc2)c1N,C21652049_decoy,CASP3,Decoy,0,-7.06501,-6.68,-2.06,-7.501473294494138
COC(=O)c1cnn(-c2ccc(C(=O)NCCC[NH+]3CCCC[C@H]3C)cc2)c1N,C21652390_decoy,CASP3,Decoy,0,-7.21696,-6.53,-1.45,-7.481370850986118
CCCCn1c(N)c(N(CC)C(=O)C[NH+](C)Cc2ccc(F)cc2F)c(=O)[nH]c1=O,C22964850_decoy,CASP3,Decoy,0,-6.64921,-6.15,-2.88,-6.141896060447669
O=C(CC[NH+]1CCC(NC(=O)c2ccccc2)CC1)NC(=O)NCc1ccco1,C28903834_decoy,CASP3,Decoy,0,-6.71575,-7.12,-1.67,-6.110127357515906
OCCNc1[nH+]c2ccccc2n1C[C@H](O)COCc1ccc2c(c1)OCO2,C33014965_decoy,CASP3,Decoy,0,-6.61691,-8.27,-2.22,-9.528334556894563
Cc1c(C(N)=O)sc(NC(=O)CN2CC[NH+](C)CC2)c1C(=O)OC(C)C,C23095774_decoy,CASP3,Decoy,0,-11.2917,-5.18,-1.62,-5.802032337058274
Cc1c(C(N)=O)sc(NC(=O)CN2CC[NH+]3CCC[C@@H]3C2)c1C(=O)OC(C)C,C20295038_decoy,CASP3,Decoy,0,-11.8718,-5.57,-2.1,-7.906416396487394
O=c1[nH]cc(NCC[NH+]2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c(=O)[nH]1,C20365241_decoy,CASP3,Decoy,0,-6.80841,-6.22,-1.52,-4.534345600578896
CC(C)CN(C(=O)C[NH+]1CCC(C)CC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C03583250_decoy,CASP3,Decoy,0,-6.96174,-5.18,-5.15,-4.801698671107801
N#C[C@H]1CSCN1C(=O)CN(N)C1CC[NH+](CC(=O)Nc2ccc(Cl)cn2)CC1,C38576004_decoy,CASP3,Decoy,0,-8.95329,-5.69,-1.67,-7.190421446701376
C=CCn1c(Cc2csc(NC(=O)CC3=C(C)[NH2+]N(C)[C@H]3C)n2)n[nH]c1=S,C38798821_decoy,CASP3,Decoy,0,-8.32716,-5.91,-2.57,-7.222591993736951
O=C(NCCOCCO)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2,C39601960_decoy,CASP3,Decoy,0,-7.96313,-8.29,-1.78,-8.18090157972669
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)cc1,C39693354_decoy,CASP3,Decoy,0,-7.79928,-6.14,-1.42,-6.024214372891707
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)cc1,C39693355_decoy,CASP3,Decoy,0,-8.43143,-5.28,-4.69,-6.207694317267342
CCC(CC)C(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693455_decoy,CASP3,Decoy,0,-7.825,-6.24,-3.36,-6.585258887385154
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39693541_decoy,CASP3,Decoy,0,-8.4103,-6.39,-1.68,-5.76663991320374
CC1(C)CC(Nc2ncnc(NCCCN3CCOCC3)c2[N+](=O)[O-])CC(C)(C)[NH2+]1,C40623011_decoy,CASP3,Decoy,0,-7.56759,-6.89,-1.65,-9.815015600422957
Cc1nc2nc(N)nn2c(C)c1CC(=O)NC[C@@H](C(C)C)[NH+]1CCC(C)CC1,C41401924_decoy,CASP3,Decoy,0,-7.77093,-6.68,-2.68,-6.5686920423217305
C[NH+](C)C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCC1,C43147284_decoy,CASP3,Decoy,0,-8.92727,-6.72,-1.3,-6.023788629895854
CCC(CC)[C@H](CNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[NH+]1CCCC1,C45533570_decoy,CASP3,Decoy,0,-8.20005,-6.71,-1.68,-6.317130463766008
Cc1cccn2cc(COc3ccc(C(=O)NC4CC[NH+](CC(N)=O)CC4)cc3)nc12,C45890830_decoy,CASP3,Decoy,0,-8.99448,-6.45,-2.45,-7.549753620631682
COc1ccnc(NNC(=O)NCC[NH+]2CCN(c3ccc(F)cc3)CC2)n1,C46866288_decoy,CASP3,Decoy,0,-7.18221,-6.37,-1.03,-9.02573978565082
NC(=O)C1CC[NH+](CCCNC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)CC1,C46919470_decoy,CASP3,Decoy,0,-7.56262,-6.4,-2.12,-6.148657646275136
C[C@@H]1CCCC[NH+]1CCNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-],C47144059_decoy,CASP3,Decoy,0,-5.83945,-6.51,-0.91,-5.333934438643459
CC(C)NC(=O)NC(=O)[C@H](C)[NH+]1CCC(C(=O)NCCCOC(C)C)CC1,C47769537_decoy,CASP3,Decoy,0,-7.29988,-5.79,-3.75,-6.123094078173682
C[NH+]1CCCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)cn2)CC1,C48236822_decoy,CASP3,Decoy,0,-7.16169,-6.4,-1.57,-5.431346998242324
CCC[C@H](C)NC(=O)[C@H]1CCC[NH+](CCC(=O)NC(=O)NCc2ccco2)C1,C51052394_decoy,CASP3,Decoy,0,-7.65641,-7.1,-1.48,-6.53107693974529
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NCCCn1cc[nH+]c1,C51778761_decoy,CASP3,Decoy,0,-6.4667,-6.24,-1.93,-5.481145140698859
CCNC(=O)c1ccc(NC(=O)C(=O)NCc2cc[nH+]c(N(C)C)c2)c(C)c1,C52679329_decoy,CASP3,Decoy,0,-5.76942,-5.78,-1.48,-4.574408456932837
CCCCCNC(=O)C1CC[NH+](CCC(=O)NC(=O)NCc2ccco2)CC1,C52722650_decoy,CASP3,Decoy,0,-7.84651,-6.87,-2.77,-6.880233462146461
Cc1nnc(SCC(=O)Nc2nc(C[NH+]3CCC(C)CC3)cs2)n1N,C53381301_decoy,CASP3,Decoy,0,-8.1342,-6.4,-0.85,-5.9214352734501325
CCn1cc(-c2cc(NC[C@@H](c3ccc(OC)cc3)[NH+](C)C)nc(N)n2)cn1,C19718053_decoy,CASP3,Decoy,0,-7.25368,-5.99,-2.99,-6.82820204899656
CC[NH+](CC)CCn1cc(NC(=O)CCc2c(C)nc3nc(N)nn3c2C)cn1,C63095926_decoy,CASP3,Decoy,0,-7.65818,-5.86,-1.18,-5.936476187959524
COc1ccc(N2C(=O)C[C@@H](SC(=[NH2+])N/N=C(\C)c3ccc(O)cc3)C2=O)cc1,C05029343_decoy,CASP3,Decoy,0,-7.84631,-5.89,-4.42,-6.298754125087743
COc1ccc(CNc2n[nH+]c(NCc3ccc(OC)c(OC)c3)[nH]2)cc1OC,C02884200_decoy,CASP3,Decoy,0,-8.80052,-6.59,-3.96,-7.462950135329965
CC(=O)c1ccc(NC(=O)C(=O)NCCNC(=O)[C@@H]2C=c3ccccc3=[NH+]2)cc1,C63387028_decoy,CASP3,Decoy,0,-6.05708,-7.62,-1.97,-5.416801126238948
CCc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCCn3cc[nH+]c3)CC2=O)cc1,C64885637_decoy,CASP3,Decoy,0,-7.92801,-6.54,-1.73,-7.154032809562559
Cc1nc2cc(F)cc(C(=O)NNC(=O)NCCCn3cc[nH+]c3)c2nc1C,C64885811_decoy,CASP3,Decoy,0,-6.66112,-6.2,-2.52,-5.477131034570583
CCc1c(C(=O)NNC(=O)NCCCn2cc[nH+]c2)cnn1-c1ccccc1,C64886162_decoy,CASP3,Decoy,0,-6.84087,-6.34,-1.52,-6.004013100421913
Cc1ccc(-c2cnc(CCC(=O)NNC(=O)NCCCn3cc[nH+]c3)o2)cc1,C64886428_decoy,CASP3,Decoy,0,-7.57292,-7.72,-2.19,-6.125205186928119
Cc1ccc(-n2nc(C)c(C(=O)NNC(=O)NCCCn3cc[nH+]c3)n2)c(C)c1,C64886544_decoy,CASP3,Decoy,0,-6.75844,-6.39,-2.0,-5.463214940856673
CCCCN(C(=O)C[NH+](C)CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C65962473_decoy,CASP3,Decoy,0,-6.46888,-5.87,-1.52,-5.475192643194687
CC[NH+](CC)[C@@H](CNC(=O)c1ccc(-n2ncc(C#N)c2N)cc1)c1ccco1,C66241324_decoy,CASP3,Decoy,0,-7.208,-7.83,-1.58,-9.11252801488096
CCOC(=O)C1=C(C[NH+]2CCC(NC(=O)c3ccoc3C)CC2)NC(=O)NC1,C66891213_decoy,CASP3,Decoy,0,-7.42987,-7.98,-2.35,-7.400039991836421
Cn1cc(CCCNC(=O)NCc2cccc(C(=O)NCC[NH+](C)C)c2)cn1,C67086365_decoy,CASP3,Decoy,0,-6.62773,-6.56,-1.61,-7.493577085235906
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NNC(=O)NCCCn1cc[nH+]c1,C67236034_decoy,CASP3,Decoy,0,-6.41075,-6.71,-2.44,-5.617670748397742
COc1cc([C@@H](/C(C(C)=O)=C(\C)O)c2cc3c(cc2OC(C)=O)OCO3)cc(OC)c1OC(C)=O,C05544652_decoy,CASP3,Decoy,0,-8.55595,-6.73,-3.27,-7.74659857181838
C=CCn1c(CNC(=O)c2ccco2)nnc1SCC(=O)c1cccc([N+](=O)[O-])c1,C02877152_decoy,CASP3,Decoy,0,-7.04405,-7.1,-2.12,-6.575541548249608
CC(=O)N[C@H]1[C@H](Oc2ccc(Cl)cc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C08834015_decoy,CASP3,Decoy,0,-6.14598,-5.54,-2.54,-4.491548233304558
O=C(COC(=O)[C@H]1CC(=O)N(NC(=O)c2ccccc2)C1)c1ccc(OC(=O)c2ccco2)cc1,C08927414_decoy,CASP3,Decoy,0,-8.21239,-8.37,-1.74,-6.868294285967911
CCS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCCc3ccc(OC)c(OC)c3)c2)CC1,C09041520_decoy,CASP3,Decoy,0,-7.98749,-7.36,-1.76,-7.490733173112861
CCCn1c(COC(=O)c2ccccc2NS(C)(=O)=O)nc2cc(S(=O)(=O)N(C)C)ccc21,C09114134_decoy,CASP3,Decoy,0,-8.08577,-5.67,-1.88,-5.695048092883691
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)Nc2nnc(-c3ccc(S(C)(=O)=O)cc3)o2)cc1,C09346762_decoy,CASP3,Decoy,0,-8.45943,-5.57,-3.03,-6.530910975790492
CCOC(=O)NC(=O)COC(=O)[C@H]1CCC(=O)N(c2ccc(OC)cc2)[C@H]1c1ccc(OC)cc1,C09538672_decoy,CASP3,Decoy,0,-8.84404,-6.14,-3.47,-6.00222826501201
CCOC(=O)c1c(-c2ccc(C)o2)csc1NC(=O)COC(=O)Cn1cnc2ccccc2c1=O,C09592305_decoy,CASP3,Decoy,0,-7.63754,-7.22,-1.47,-7.146450612500006
COc1cc(NC(=O)C(C)C)c(C(=O)OCC(=O)c2cc(C)n(-c3cc(C)on3)c2C)cc1OC,C09922895_decoy,CASP3,Decoy,0,-8.51368,-6.07,-1.61,-6.838108883736778
CC(=O)N[C@@H]1[C@@H](Oc2ccc(Cl)cc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C09974855_decoy,CASP3,Decoy,0,-5.99393,-6.44,-2.61,-5.614843039199993
CC(=O)N[C@H]1[C@H](Oc2ccc(C)cc2)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C12406447_decoy,CASP3,Decoy,0,-6.18397,-6.55,-2.27,-6.697549766847324
COc1cccc([C@H](C(=O)NCc2ccco2)N(C(=O)Cn2nnc3ccccc32)C(C)C)c1OC,C01376262_decoy,CASP3,Decoy,0,-8.16862,-7.03,-2.36,-6.997756321463641
COc1ccc([C@H](C(=O)NCc2ccco2)N(C(=O)Cn2nnc3ccccc32)C2CC2)cc1OC,C01376280_decoy,CASP3,Decoy,0,-8.53524,-7.68,-2.96,-7.906534915407011
CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)[C@H](C)OC(=O)c1ccc(-n2cncn2)nc1,C14250979_decoy,CASP3,Decoy,0,-8.16158,-7.53,-2.76,-7.291204400101781
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)c([N+](=O)[O-])c1,C14280000_decoy,CASP3,Decoy,0,-6.82983,-6.24,-2.12,-6.050825629100795
COc1ccc(C(=O)Oc2coc(CSc3nnc(NC(=O)C4CC4)s3)cc2=O)cc1OC,C16047817_decoy,CASP3,Decoy,0,-9.2637,-7.14,-1.42,-8.056985954562546
COc1cc(Br)c(CCNC(=O)c2cc(OC)c(OC)c(OC)c2[N+](=O)[O-])cc1OC,C16172749_decoy,CASP3,Decoy,0,-7.70014,-6.16,-2.0,-6.545065414153529
COc1ccc(CCNC(=O)/C(C#N)=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC,C16436304_decoy,CASP3,Decoy,0,-7.71349,-6.02,-1.86,-6.015505087892999
CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)c2[nH]c(C)c(C(C)=O)c2C)cc1OC,C19159984_decoy,CASP3,Decoy,0,-7.10657,-6.8,-1.57,-6.88420355829142
CCOC(=O)c1cc2n(n1)C[C@](C)(C(=O)NCCOC)N(c1ccc(OCC)cc1)C2=O,C21879432_decoy,CASP3,Decoy,0,-7.95775,-5.68,-1.33,-7.372329466416155
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)[C@H]1CC(=O)N(c3cccc(C)c3C)C1)n2CCC,C22403906_decoy,CASP3,Decoy,0,-8.50998,-6.72,-3.05,-7.478541024718483
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)[C@@H]1CC(=O)N(c3cccc(C)c3C)C1)n2CCC,C22403907_decoy,CASP3,Decoy,0,-8.43954,-6.92,-1.49,-8.680873295293113
CCc1nc(COC(=O)CNS(=O)(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cs1,C25445727_decoy,CASP3,Decoy,0,-6.64597,-6.11,-1.25,-5.46617537840761
CC(=O)N[C@H]1[C@H](OC2CCCCC2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C15659187_decoy,CASP3,Decoy,0,-6.73099,-5.39,-3.22,-4.9142649462253365
CCN1CCN(C(=O)Cc2csc(NC(=O)CN(CCOC)C(=O)c3ccco3)n2)CC1,C33604656_decoy,CASP3,Decoy,0,-8.39824,-7.2,-1.77,-7.322228765595007
CC(=O)N[C@@H]1[C@@H](Oc2c(C)cccc2C)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C33766917_decoy,CASP3,Decoy,0,-5.95271,-5.35,-3.54,-5.09888592934203
CCCNC(=O)N(CCOC)CC(=O)N1CCCN(c2ccc(-c3ccc(OC)cc3)nn2)CC1,C36071601_decoy,CASP3,Decoy,0,-8.22724,-6.58,-1.76,-7.891608338627587
COc1cc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCCn2cc[nH+]c2)cc(OC)c1OC,C09065813_decoy,CASP3,Decoy,0,-8.0584,-5.73,-1.8,-6.778638543226283
COc1cc(OC)cc(-c2nc3nc(C)c(CCC(=O)NCC(OC)OC)c(C)n3n2)c1,C13660128_decoy,CASP3,Decoy,0,-7.95095,-5.7,-1.93,-6.2689374472337
CCOc1cc(-c2nnc(NC(=O)c3ccn(C(C)C)n3)o2)cc(OCC)c1OCC,C38507534_decoy,CASP3,Decoy,0,-7.77118,-6.53,-0.93,-6.564948043418799
CCOc1ccc(C2=C[C@H](C(=O)N/N=C/c3cc(OC)c(OC(C)=O)c(OC)c3)N=N2)cc1,C39944279_decoy,CASP3,Decoy,0,-7.38554,-6.32,-0.92,-7.771598229445207
C=CCOC(=O)C1=C(C)Nc2nc(SCC)nn2[C@H]1c1ccc(OCC(=O)N2CCOCC2)cc1,C41003399_decoy,CASP3,Decoy,0,-8.47324,-6.03,-3.69,-7.051321608245397
CCNc1ncc(C(=O)OCC)c(CSc2nnc(-c3cn(CC)nc3C)n2C)n1,C41390306_decoy,CASP3,Decoy,0,-8.66344,-5.81,-1.83,-6.734184822783911
COc1cc(CCNC(=O)C2CCN(C(=O)OCC(F)(F)F)CC2)c([N+](=O)[O-])cc1OC,C45548647_decoy,CASP3,Decoy,0,-6.73066,-6.48,-3.11,-5.199539640444925
CCOC(=O)c1cc(CC)sc1NC(=O)COC(=O)c1cnc2ncnn2c1CC,C46766027_decoy,CASP3,Decoy,0,-8.45985,-6.14,-1.73,-6.773693653559528
COc1ccccc1OCC(=O)N1CCN(c2nnc(SCC(=O)NCc3ccco3)s2)CC1,C49367721_decoy,CASP3,Decoy,0,-8.50725,-7.71,-3.82,-6.823907166390988
COc1ccc2[nH]c(=O)c(CN(Cc3ccccc3OC)Cc3nnnn3Cc3ccco3)cc2c1,C01373083_decoy,CASP3,Decoy,0,-7.41928,-8.13,-2.04,-8.047405623448602
CCCCN(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1NC)[C@@H]1CCS(=O)(=O)C1,C16282575_decoy,CASP3,Decoy,0,-6.97841,-5.72,-0.4,-6.034114555967788
CCOC(=O)c1cc(CC)sc1NC(=O)COC(=O)c1ccccc1-n1cnnn1,C09839150_decoy,CASP3,Decoy,0,-8.07402,-7.45,-2.48,-10.495900801468927
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)[C@@H]1CC(=O)N(C3CC3)C1)n2CCC,C57578677_decoy,CASP3,Decoy,0,-7.81595,-6.21,-0.2,-8.000597534890106
CCOC(=O)Cn1nnnc1CN(Cc1cc2cccc(C)c2[nH]c1=O)C[C@H]1CCCO1,C57607293_decoy,CASP3,Decoy,0,-7.85437,-7.92,-1.42,-7.446994862782222
COc1ccc(CN(Cc2cc3ccc(OC)cc3[nH]c2=O)Cc2nnnn2C[C@H]2CCCO2)cc1,C57607779_decoy,CASP3,Decoy,0,-8.30248,-7.49,-3.27,-7.734967394721797
COc1ccc2[nH]c(=O)c(CN(Cc3ccco3)[C@H](c3nnnn3C[C@@H]3CCCO3)C(C)C)cc2c1,C13498649_decoy,CASP3,Decoy,0,-9.60729,-6.74,-1.81,-7.8224094088983644
CCOC(=O)c1sc(NC(=O)CSc2ncnc3c2cnn3C)c(C(=O)OCC)c1C,C11677871_decoy,CASP3,Decoy,0,-9.41436,-6.05,-3.34,-8.848308757094655
CCOC(=O)c1cc(CC)sc1NC(=O)Cn1nnc(-c2ccc(OC)c(OC)c2)n1,C58994604_decoy,CASP3,Decoy,0,-8.86754,-6.93,-2.16,-6.194469383318086
CCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C1,C60268418_decoy,CASP3,Decoy,0,-9.31819,-5.89,-1.78,-7.050646326624265
COC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CC[NH+](C)C)[C@@H]2c2ccc(OC)c(OC)c2)C(C)=N1,C08892557_decoy,CASP3,Decoy,0,-8.39172,-5.43,-1.45,-6.150115972329356
COC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CCCn3cc[nH+]c3)[C@H]2c2ccccc2OC)C(C)=N1,C09282071_decoy,CASP3,Decoy,0,-8.37969,-6.4,-2.56,-7.0334598228162335
CCOC(=O)C1=C(C)C(C(=O)[C@H](C)OC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)=N[C@@H]1C,C64050503_decoy,CASP3,Decoy,0,-7.78314,-6.38,-3.48,-6.127704801467329
NC(=O)COc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2COc2ccc(F)cc2)cc1,C02383267_decoy,CASP3,Decoy,0,-7.48442,-6.0,-1.92,-5.410231056148268
COC(=O)[C@@H]1[C@@H](c2ccc(OC)c(OC)c2)[NH2+][C@@H](c2ccc(OC)c(OC)c2)[C@@H](C(=O)OC)S1(=O)=O,C04425822_decoy,CASP3,Decoy,0,-8.37151,-7.13,-4.08,-7.23595678005733
COC(=O)[C@@H]1[C@H](c2ccc(OC)c(OC)c2)[NH2+][C@H](c2ccc(OC)c(OC)c2)[C@H](C(=O)OC)S1(=O)=O,C04425818_decoy,CASP3,Decoy,0,-7.49963,-5.3,-2.13,-6.443703161655106
COC(=O)[C@@H]1[C@H](c2ccc(OC)c(OC)c2)[NH2+][C@@H](c2ccc(OC)c(OC)c2)[C@@H](C(=O)OC)S1(=O)=O,C04425825_decoy,CASP3,Decoy,0,-8.1194,-7.34,-2.04,-8.276255819260184
CC(C)CCNC(=O)[C@@H](c1ccco1)N(Cc1ccc2c(c1)OCO2)C(=O)c1snc(C(N)=O)c1N,C06134266_decoy,CASP3,Decoy,0,-10.5946,-7.11,-3.04,-9.16504794934849
COCCn1nnnc1[C@H](c1cc2cc3c(cc2[nH]c1=O)OCO3)[NH+](Cc1ccccc1)Cc1cccnc1,C06136291_decoy,CASP3,Decoy,0,-7.83403,-7.22,-1.65,-7.288579067726042
COc1ccc([C@H](C#N)c2cncc(NNC(=O)c3cc(OC)c(OC)c(OC)c3)n2)cc1OC,C02086853_decoy,CASP3,Decoy,0,-8.48816,-7.3,-1.35,-7.425380560895419
CCOC(=O)C1=C(COC(=O)CCN2C(=O)NC(C)(C)C2=O)NC(=O)N[C@H]1c1ccc(Cl)cc1,C11538297_decoy,CASP3,Decoy,0,-7.93879,-6.83,-2.42,-6.737898550008919
COC(=O)c1nnn([C@H]2C[C@@H](C(=O)NCc3ccccn3)[NH+](Cc3ccc(C(C)C)cc3)C2)c1C(=O)OC,C12051111_decoy,CASP3,Decoy,0,-8.32631,-7.73,-2.79,-9.161786663564264
COc1cc(C(=O)NCCNC(=O)c2nc(Cn3nc([N+](=O)[O-])cc3C)no2)cc(OC)c1OC,C12446637_decoy,CASP3,Decoy,0,-8.10208,-7.41,-2.27,-8.382586542802741
CCC(C)(C)n1nnnc1C[NH+](Cc1ccc2c(c1)OCO2)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C13033491_decoy,CASP3,Decoy,0,-8.42515,-7.98,-2.92,-7.474672486279822
CCCCN(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1c(N)n(CCCC)c(=O)[nH]c1=O,C13042112_decoy,CASP3,Decoy,0,-6.81893,-7.48,-3.28,-8.192526249005438
CCOC(=O)Cn1nnnc1[C@H](CC)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C1CCCC1,C13064441_decoy,CASP3,Decoy,0,-8.47118,-6.99,-1.57,-7.761645922068946
CC(C)[C@@H](c1nnnn1C[C@@H]1CCCO1)[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13498807_decoy,CASP3,Decoy,0,-8.02552,-8.15,-3.43,-7.5578272476846
CCOC(=O)Cn1nnnc1[C@H](CC)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C1CCCC1,C13501205_decoy,CASP3,Decoy,0,-8.52999,-7.91,-1.84,-7.788743756603186
COCCNC(=O)[C@@H](c1ccco1)N(C(=O)Cn1nnc2ccccc21)c1ccc(NC(C)=O)cc1,C13508567_decoy,CASP3,Decoy,0,-7.88073,-7.1,-3.28,-7.506798733770005
CCOc1ccc(-c2c(C(=O)N/N=C(\C)c3ccc(OCC(N)=O)cc3)nnn2-c2nonc2N)cc1,C13514541_decoy,CASP3,Decoy,0,-7.7534,-7.54,-2.62,-6.6341335811251625
CCCCn1c(N)c(N(CCOC)C(=O)COC(=O)c2cn3c(C)cccc3n2)c(=O)[nH]c1=O,C19050664_decoy,CASP3,Decoy,0,-7.07634,-6.62,-2.83,-5.719611682706367
COC(=O)CC1=C(C(=O)OC)[C@H](c2ccc(OC)c(Cn3cc([N+](=O)[O-])cn3)c2)C(C#N)=C(N)O1,C03653525_decoy,CASP3,Decoy,0,-7.60859,-5.6,-2.16,-5.984242606028304
COc1ccc(/C=N/Nc2nc(SCC(=O)Nc3nc(C)cs3)n[nH]2)cc1OCn1cccn1,C20424460_decoy,CASP3,Decoy,0,-9.49172,-7.85,-4.57,-6.307302455798732
CCOC(=O)C1=C(N)N(CC(N)=O)c2ccccc2[C@@]12C(=O)OC(CC(=O)OC)=C2C(=O)OC,C20609268_decoy,CASP3,Decoy,0,-9.38907,-5.94,-2.6,-8.289637776335029
COc1ccc(C(=O)CSc2nnc(N/N=C/c3cc(OC)c(OC)c(OC)c3)n2N)cc1,C20827161_decoy,CASP3,Decoy,0,-8.04968,-6.26,-2.25,-5.506493887476128
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1)c1cccnc1,C20837260_decoy,CASP3,Decoy,0,-9.34451,-6.77,-2.87,-7.521907324651345
Cc1nnc(CSc2nnc(NC(=O)CSc3n[nH]c(N/N=C/c4ccncc4)n3)s2)o1,C20837717_decoy,CASP3,Decoy,0,-8.95748,-6.81,-0.44,-6.295172295863206
CCn1cc(/C=N/Nc2nc(SCCC(=O)Nc3ccc(S(N)(=O)=O)cc3)n[nH]2)cn1,C20838071_decoy,CASP3,Decoy,0,-9.64164,-6.43,-1.62,-6.419721632281759
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)N3CCN(Cc4nnc(C(C)C)o4)CC3)n[nH]2)cc1,C20906090_decoy,CASP3,Decoy,0,-10.2821,-6.99,-2.78,-7.687414427382464
COC(=O)c1c(NC(=O)CCSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)sc2c1CCC2,C20911095_decoy,CASP3,Decoy,0,-9.94472,-6.51,-1.01,-10.525654407759871
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2nnc(SCC(C)C)s2)n1N,C20911602_decoy,CASP3,Decoy,0,-9.08083,-5.61,-2.47,-6.468295699935227
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)Nc2ccccc2[N+](=O)[O-])n1N,C20911898_decoy,CASP3,Decoy,0,-6.80297,-8.03,-1.91,-6.030966935903051
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCCC(=O)NCc2ccc3c(c2)OCO3)n1N,C20911982_decoy,CASP3,Decoy,0,-9.22392,-5.94,-2.18,-6.954837033752538
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)N3CCc4cc(OC)c(OC)cc4C3)n2N)cc1,C20913537_decoy,CASP3,Decoy,0,-8.18079,-7.14,-1.21,-6.210602060696666
CCOC(=O)c1sc(NC(=O)CCSc2nnc(N/N=C/c3cccc(O)c3)n2N)c(C#N)c1C,C20915515_decoy,CASP3,Decoy,0,-9.4637,-6.65,-3.1,-6.818000460131948
COc1cc(/C=N/Nc2nnc(SCC(=O)NCc3ccc(Cl)cc3)n2N)cc(OC)c1OC,C20919569_decoy,CASP3,Decoy,0,-7.96539,-4.87,-2.67,-5.427354673250621
CCOc1ccc2nc(NC(=O)CSc3nnc(N/N=C/c4cnn(C(C)C)c4)n3N)sc2c1,C20921681_decoy,CASP3,Decoy,0,-8.12618,-5.9,-2.26,-5.7486311830598735
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C21162072_decoy,CASP3,Decoy,0,-7.17921,-7.78,-0.98,-6.916290908154558
COc1ccc(OC[C@H](O)Cn2c(N/N=C\c3ccc([N+](=O)[O-])cc3)nc3c2c(=O)[nH]c(=O)n3C)cc1,C33399081_decoy,CASP3,Decoy,0,-7.56343,-6.42,-1.02,-7.190674367196651
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,CASP3,Decoy,0,-9.25658,-6.24,-2.37,-6.827146285512519
CCOC(=O)c1cnc(SCC(=O)OCC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)nc1N,C12524915_decoy,CASP3,Decoy,0,-8.53591,-6.57,-2.91,-5.762571099703585
COc1ccc2[nH]cc(CCN/C(=N\C(=O)CS[C@H]3N=N[C@@H](N)S3)Nc3nc(C)cc(C)n3)c2c1,C38787504_decoy,CASP3,Decoy,0,-10.0232,-8.35,-2.12,-8.54445127687038
CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1,C39586343_decoy,CASP3,Decoy,0,-7.83878,-7.31,-1.95,-8.570356921213605
CCCCN(C(=O)C[NH2+]C1(c2noc(C)n2)CCCCC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C58011426_decoy,CASP3,Decoy,0,-8.34642,-5.76,-1.18,-5.830412580883651
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,CASP3,Decoy,0,-8.20713,-8.69,-0.74,-8.01233937279755
Cc1nn(C)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2nnc(SCC(C)C)s2)n[nH]1,C59309965_decoy,CASP3,Decoy,0,-10.5477,-7.28,-2.75,-7.287632918672578
CCNc1nc(NCC)n2c(SCC(=O)NCCCn3c(C)nc4ccccc43)nnc2n1,C59421238_decoy,CASP3,Decoy,0,-8.96395,-6.19,-2.04,-9.109381135112342
CCCCNC(=O)CSc1n[nH]c(N/N=C/c2ccc(OC)c(OCn3cccn3)c2)n1,C59817885_decoy,CASP3,Decoy,0,-7.83886,-6.82,-3.41,-6.525852696650759
C=CCn1nc(C)c(/C=N/Nc2nc(SCCC(=O)NCc3ccc4c(c3)OCO4)n[nH]2)c1C,C59831463_decoy,CASP3,Decoy,0,-9.17449,-7.38,-1.93,-7.862837746795675
O=C(CSc1n[nH]c(N/N=C/c2ccc(COc3ccc(F)cc3)o2)n1)NNC(=O)C1CCC1,C59880233_decoy,CASP3,Decoy,0,-8.74556,-8.24,-1.99,-6.447339959747694
COc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)C2=c3ccccc3=[NH+]C2)cc1[N+](=O)[O-],C39943454_decoy,CASP3,Decoy,0,-6.38136,-6.42,-1.87,-5.53682305084528
COc1ccc2c(c1)=C(CC[N-]/C(=N\C(=O)CS[C@@H]1N=N[C@@H](N)S1)Nc1nc(C)cc(C)n1)C[NH+]=2,C63493744_decoy,CASP3,Decoy,0,-10.6086,-8.33,-3.36,-8.904951103634488
CN(C)c1ccc(S(=O)(=O)NCC(=O)OCC(=O)C2=c3ccccc3=[NH+]C2)cc1[N+](=O)[O-],C40014219_decoy,CASP3,Decoy,0,-6.00309,-7.51,-3.15,-5.495361077381884
CC(=O)OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](NC(=O)C(F)(F)F)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C04963046_decoy,CASP3,Decoy,0,-5.88017,-5.83,-3.5,-5.315530966812725
C[NH+](C)CCNS(=O)(=O)c1ccc(NCCc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])c1,C09127518_decoy,CASP3,Decoy,0,-8.533,-6.5,-2.2,-8.524589424439567
Cc1cccc(OC[C@H](O)Cn2c(NCCCn3ccnc3)nc3c2c(=O)n(C)c(=O)n3C)c1,C09291006_decoy,CASP3,Decoy,0,-6.89828,-6.78,-2.43,-5.916187040830682
CCCCN(C(=O)COC(=O)/C=C/c1nc2ccccc2o1)c1c(N)n(CCC)c(=O)[nH]c1=O,C09818730_decoy,CASP3,Decoy,0,-7.66363,-7.1,-2.06,-6.292667322426615
CCOC(=O)C1=C(COC(=O)CCN2C(=O)NC(C)(C)C2=O)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C11538296_decoy,CASP3,Decoy,0,-7.54094,-6.8,-1.76,-9.159888348540878
CCOC(=O)C1=C(COC(=O)CCn2nc(-c3cccs3)oc2=O)NC(=O)N[C@H]1c1ccc(C)o1,C12782248_decoy,CASP3,Decoy,0,-7.74987,-7.53,-1.67,-7.28242053612373
CCOC(=O)Cn1nnnc1C[NH+](Cc1ccc2c(c1)OCO2)Cc1cc2ccc(C)c(C)c2[nH]c1=O,C12832980_decoy,CASP3,Decoy,0,-8.45439,-7.68,-4.42,-7.331172090630484
CCOC(=O)Cn1nnnc1C[NH+](CCc1ccccc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13033839_decoy,CASP3,Decoy,0,-7.43846,-8.07,-2.79,-7.376896928961892
CCOC(=O)Cn1nnnc1[C@@H](CC)[NH+](Cc1ccc2c(c1)OCO2)Cc1cc2ccc(C)cc2[nH]c1=O,C13063897_decoy,CASP3,Decoy,0,-8.82476,-6.76,-2.51,-7.791321805902171
CCOC(=O)Cn1nnnc1[C@H](CC)[NH+](Cc1ccc2c(c1)OCO2)Cc1cc2ccc(C)cc2[nH]c1=O,C13063898_decoy,CASP3,Decoy,0,-7.62462,-7.8,-2.44,-7.731327581336327
CCOC(=O)Cn1nnnc1[C@H](C(C)C)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C1CCCC1,C13500693_decoy,CASP3,Decoy,0,-9.14877,-6.34,-1.76,-7.189037343065536
CCOC(=O)Cn1nnnc1[C@@H](CC)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C1CCCCC1,C13501216_decoy,CASP3,Decoy,0,-8.31451,-8.1,-0.8,-7.849387835187079
CCCn1c(N)c(C(=O)COC(=O)CSc2nccn2-c2ccc(OC)cc2)c(=O)[nH]c1=O,C08746548_decoy,CASP3,Decoy,0,-7.52308,-6.24,-2.02,-6.472191851879281
COC(=O)c1nnn([C@H]2C[C@@H](C(=O)NCCc3ccc(F)cc3)[NH+](Cc3ccoc3)C2)c1C(=O)OC,C14972351_decoy,CASP3,Decoy,0,-7.84309,-7.35,-1.55,-8.00454237798667
CSc1nc(O)c(/N=C(\C)C(C)=O)c(N[C@@H]2OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)n1,C16953037_decoy,CASP3,Decoy,0,-7.90755,-7.12,-1.5,-7.314888877406916
CCOC(=O)N[C@](Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)(C(=O)OCC)C(F)(F)F,C08702604_decoy,CASP3,Decoy,0,-7.48576,-6.33,-1.86,-6.8146506163733065
CCOC(=O)c1c(C)oc(NC(=O)CSc2nnnn2-c2ccccc2OCC)c1C(N)=O,C18409849_decoy,CASP3,Decoy,0,-7.76384,-7.1,-1.11,-10.025833012766173
CCC[NH+](CCC)Cc1c(C(=O)N/N=C/c2ccc(OC)c(OC)c2)nnn1-c1nonc1N,C20037887_decoy,CASP3,Decoy,0,-9.3443,-7.18,-1.4,-9.294912645749552
CCOc1ccc2[nH]c(=O)c(CN(CCO)C3(c4nnnn4CCOC)CC[NH+](CC)CC3)cc2c1,C13510451_decoy,CASP3,Decoy,0,-7.93092,-7.27,-0.46,-8.06307726921841
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1ccc([N+](=O)[O-])cc1,C20219710_decoy1,CASP3,Decoy,0,-5.84637,-6.86,,-6.033664564702649
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cn(C)nc3C)n2)s1,C20424265_decoy,CASP3,Decoy,0,-9.22961,-7.76,-2.24,-6.234463486282986
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2nnc(SCC(C)C)s2)n[nH]1,C20905080_decoy,CASP3,Decoy,0,-9.65128,-6.75,-1.95,-7.632705684942295
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)NCc3cc(OC)cc(OC)c3)n[nH]2)cc1,C20905708_decoy,CASP3,Decoy,0,-8.12758,-6.43,-3.33,-6.886180582429436
COc1cc(CNC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)cc(OC)c1,C20920506_decoy,CASP3,Decoy,0,-7.35821,-5.45,-1.09,-5.37305390550315
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)cc1,C21078018_decoy,CASP3,Decoy,0,-6.02353,-6.9,-2.23,-5.358205633157026
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)cc3)n2)cc1,C21078021_decoy,CASP3,Decoy,0,-6.73856,-8.33,-2.32,-6.725447341080511
CCOC(=O)C1=C(COC(=O)CCc2c(C)nc3cc(C)nn3c2C)NC(=O)N[C@H]1c1ccc(C)o1,C23014922_decoy,CASP3,Decoy,0,-9.17123,-7.42,-1.16,-7.210568811946457
CCOC(=O)C1=C(CN(CCOC)Cc2nnc(-c3cccs3)o2)NC(=O)N[C@H]1c1ccco1,C23990010_decoy,CASP3,Decoy,0,-8.8671,-7.77,-2.12,-8.170887804956143
CCOC(=O)c1cc(C(=O)N(CCOC)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc([N+](=O)[O-])c1,C24015375_decoy,CASP3,Decoy,0,-6.79142,-5.8,-3.23,-5.796190013990961
CCCCCN(C(=O)Cn1nnn(-c2cccs2)c1=O)c1c(N)n(CCCC)c(=O)[nH]c1=O,C24839245_decoy,CASP3,Decoy,0,-7.49935,-7.01,-3.51,-7.190456202438987
COc1ccc(/C=N/NC(=O)CC[NH+]2CCCC[C@H]2c2cccnc2)cc1Cn1cc([N+](=O)[O-])cn1,C08973864_decoy,CASP3,Decoy,0,-8.07753,-6.36,-3.52,-6.365904270660164
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,C35455007_decoy,CASP3,Decoy,0,-8.582,-6.05,-3.37,-6.523362449975136
COc1ccc2c(CCN/C(=N\C(=O)CS[C@@H]3N=NNN3C)Nc3nc(C)cc(C)n3)c[nH]c2c1,C39330588_decoy,CASP3,Decoy,0,-9.85541,-8.08,-1.78,-8.928341177513877
COc1ccc2c(CCN/C(=N\C(=O)CS[C@H]3N=NNN3C)Nc3nc(C)cc(C)n3)c[nH]c2c1,C39330591_decoy,CASP3,Decoy,0,-9.03506,-8.43,-2.6,-9.505158322393145
CCN(CC)C(=O)Oc1ccc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCC[C@H]2C)cc1,C39948765_decoy,CASP3,Decoy,0,-7.69697,-8.74,-2.26,-6.460278523630555
CCOC(=O)C1=C(COC(=O)CCc2nc(-c3cccs3)no2)NC(=O)N[C@@H]1c1ccco1,C45645493_decoy,CASP3,Decoy,0,-6.64957,-7.13,-2.67,-6.26558370748749
CC[C@H](c1nnnn1C[C@@H]1CCCO1)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C57641345_decoy,CASP3,Decoy,0,-8.82447,-6.53,-1.44,-6.969982565623786
CCOc1cc(/C=N/NC(=O)CSc2nnc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2N)ccc1O,C58992090_decoy,CASP3,Decoy,0,-8.05216,-7.0,-2.3,-6.10827108944227
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc([N+](=O)[O-])c3)n2)s1,C58993169_decoy,CASP3,Decoy,0,-9.06309,-5.68,-3.27,-6.438429662512405
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(O)c(OCC)c3)n2)s1,C59039900_decoy,CASP3,Decoy,0,-12.099,-6.5,-1.39,-8.011187535711137
CCCSc1nnc(NC(=O)CSc2nnc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2N)s1,C59046697_decoy,CASP3,Decoy,0,-9.04736,-6.91,-0.95,-6.762842350341612
COc1ccc(/C=N/Nc2nc(SCC(=O)N3CCCC[C@@H]3C)n[nH]2)cc1OCn1cccn1,C59817911_decoy,CASP3,Decoy,0,-8.78487,-8.15,-3.2,-7.155943539373605
COc1ccc(/C=N/Nc2nc(SCc3nnc(-c4ccccc4)o3)n[nH]2)cc1OCn1cccn1,C59817964_decoy,CASP3,Decoy,0,-9.32188,-5.57,-2.92,-6.566766030754519
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3sc4c(c3C(=O)OC)CCCC4)n[nH]2)cn1,C59832315_decoy,CASP3,Decoy,0,-9.64917,-6.41,-1.71,-8.072569993214817
COc1ccc(OCc2ccc(/C=N/Nc3nc(S[C@H](C)C(=O)NNC(C)=O)n[nH]3)o2)cc1,C59880207_decoy,CASP3,Decoy,0,-7.78645,-8.18,-3.46,-10.686425663781646
CSc1ccccc1NC(=O)CSc1nnc(N/N=C/c2c(C)nn(CCO)c2C)n1N,C59914601_decoy,CASP3,Decoy,0,-9.4617,-6.24,-2.85,-5.822535603661708
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1OC,C10733659_decoy,CASP3,Decoy,0,-6.35494,-8.2,-0.91,-5.874031139039176
Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)NC(=O)c2ccc(OC(F)F)cc2)cn1C,C62589967_decoy,CASP3,Decoy,0,-7.17699,-7.42,-1.55,-6.387515585729862
CCCCN1C(=O)N=C([O-])[C@H](N(CCOC)C(=O)CSc2nc(-c3ccc(OC)cc3)n[nH]2)[C@H]1[NH3+],C39791646_decoy,CASP3,Decoy,0,-8.25554,-5.95,-1.98,-6.6968389074035
CC(=O)OC[C@@H]1O[C@H](n2cnc3c(Sc4ccc(C)cc4)nc(N)nc32)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C65734262_decoy,CASP3,Decoy,0,-6.76033,-6.42,-1.45,-5.368638751719004
CC(=O)OC[C@H]1O[C@@H](n2c3c(cc(C#N)c2=S)CCCC3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C05537043_decoy,CASP3,Decoy,0,-7.46733,-6.26,-4.44,-6.479897080973667
CC(=O)OC[C@@H]1O[C@@H](SC2=NC(=O)CS2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C05540681_decoy,CASP3,Decoy,0,-6.82361,-4.98,-1.39,-6.123527913467645
CCOc1ccccc1N(C(=O)Cn1nnc(-c2ccc(C)o2)n1)[C@@H](C(=O)NC(C)(C)C)c1ccco1,C06631492_decoy,CASP3,Decoy,0,-8.5171,-7.46,-1.22,-6.770830994999824
CCOc1ccc(N2C[C@H](CNS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)OC2=O)cc1OCC,C08839062_decoy,CASP3,Decoy,0,-8.28529,-7.73,-2.17,-6.943593865620536
CCOc1cc(/C=N/Nc2nc(N3CCCC3)nc(N3CCCC3)n2)ccc1OCC(=O)OC,C09310318_decoy,CASP3,Decoy,0,-9.84806,-7.23,-1.12,-7.949924432257754
CC(=O)Oc1ccccc1[C@@]1(C)OC(c2cc(OC(C)=O)c(OC(C)=O)c(OC(C)=O)c2)=NN1C(C)=O,C09586385_decoy,CASP3,Decoy,0,-8.37568,-6.64,-2.06,-7.102712366000677
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)/C(=C/c2ccco2)n2nnnc2-c2ccccc2)c1C,C09792166_decoy,CASP3,Decoy,0,-9.0001,-8.39,-1.04,-7.790770132370977
CCOC(=O)CC(=O)Cn1c(=O)c2c(nc3n2CCN3c2ccc(C(=O)OCC)cc2)n(C)c1=O,C10249785_decoy,CASP3,Decoy,0,-8.76651,-7.16,-1.84,-9.952104080333076
CCOC(=O)CC(=O)Cn1c(=O)c2c(nc3n2C[C@H](C)CN3c2ccc(C(=O)OCC)cc2)n(C)c1=O,C10250454_decoy,CASP3,Decoy,0,-8.10619,-7.3,-1.33,-8.461783154249828
Cc1ccc(-c2nnn(CC(=O)N(Cc3ccco3)[C@@H](C(=O)NC3CCCC3)c3ccc(N(C)C)cc3)n2)o1,C00887373_decoy,CASP3,Decoy,0,-9.23672,-6.87,-1.1,-8.239154422356618
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)c1cnn(-c3ccccc3)n1)n2CCC,C12559047_decoy,CASP3,Decoy,0,-7.92473,-6.44,-1.92,-6.608377936507607
COCc1cc(C)nc(OCC(=O)N/N=C/c2ccc(-c3cc([N+](=O)[O-])ccc3OC)o2)c1C#N,C06177750_decoy,CASP3,Decoy,0,-8.8972,-7.49,-1.25,-6.85790276317959
CC(=O)OC[C@@H]1O[C@H](Sc2nc(C)cc(C)n2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C13897515_decoy,CASP3,Decoy,0,-6.77441,-7.19,-2.89,-6.444440180093743
CC(=O)OC[C@H]1O[C@H](Sc2nc(C)cc(C)n2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C13897517_decoy,CASP3,Decoy,0,-7.5221,-5.78,-0.74,-7.304232069615815
COC(=O)c1ccn(CSc2nncn2/N=C/c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)n1,C02733689_decoy,CASP3,Decoy,0,-7.82322,-6.46,-1.4,-7.783548180650628
CC(=O)OC[C@H]1O[C@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16032570_decoy,CASP3,Decoy,0,-5.18661,-6.36,-3.36,-5.714058358537868
O=C(CN(C[C@@H]1CCCO1)C(=O)c1ccc([N+](=O)[O-])cc1)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C16652466_decoy,CASP3,Decoy,0,-7.15284,-7.32,-1.72,-6.413041604384448
CC(=O)OC[C@H]1O[C@@H](n2c3c(cc(C#N)c2=S)CCC3)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16958781_decoy,CASP3,Decoy,0,-7.47596,-6.57,-4.38,-6.352349632878282
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)cc2)c1C,C17177059_decoy,CASP3,Decoy,0,-8.20311,-7.01,-2.0,-6.300266400276376
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC,C19159568_decoy,CASP3,Decoy,0,-6.13117,-5.62,-2.1,-5.954426411464032
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)c1ccc(OCC)c([N+](=O)[O-])c1)n2CC,C19389319_decoy,CASP3,Decoy,0,-7.82725,-5.35,-2.75,-6.177505398068134
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc([N+](=O)[O-])c1,C20100932_decoy,CASP3,Decoy,0,-6.50141,-5.74,-1.46,-5.541510976299072
CCOC(=O)[C@H](N1CCCC1=O)n1c(=O)c(C)cn([C@@H](C(=O)OCC)N2CCCC2=O)c1=O,C20609208_decoy,CASP3,Decoy,0,-7.58894,-6.15,-2.38,-7.99125444293975
COC(=O)[C@@H]1O[C@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22064176_decoy,CASP3,Decoy,0,-5.9515,-6.5,-1.68,-5.696317530155975
COC(=O)[C@@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22065173_decoy,CASP3,Decoy,0,-5.24088,-6.31,-3.3,-5.609164948438661
COC(=O)[C@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22065182_decoy,CASP3,Decoy,0,-5.86948,-6.67,-1.8,-6.424278514061105
CCOCc1cc(/C=N/n2c(C)nnc2SCn2nc(C)c([N+](=O)[O-])c2C)ccc1OC,C02733142_decoy,CASP3,Decoy,0,-7.01646,-6.51,-2.44,-6.071283659753549
CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccccc3[N+](=O)[O-])o2)sc(C(C)=O)c1C,C32699103_decoy,CASP3,Decoy,0,-7.66282,-6.87,-1.72,-5.854568978412707
COc1cc(-c2cc(CN(C[C@H]3CCCO3)C(=O)c3cccc([N+](=O)[O-])c3)no2)cc(OC)c1OC,C34922303_decoy,CASP3,Decoy,0,-7.68631,-6.82,-1.44,-6.871716218804396
COC(=O)[C@@H]1O[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C35645478_decoy,CASP3,Decoy,0,-6.33117,-6.56,-3.08,-5.893366016794169
CCOc1cc(C2C(C(=O)OC)=CN(Cc3ccc4c(c3)OCO4)C=C2C(=O)OC)cc([N+](=O)[O-])c1O,C16293816_decoy,CASP3,Decoy,0,-7.25237,-8.56,-3.4,-8.204018578101408
CCCCNC(=O)[C@@H](c1cccc(O)c1)N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)(C)C,C36583681_decoy,CASP3,Decoy,0,-7.24286,-5.31,-2.28,-6.152196195424516
CCOC(=O)c1c(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)sc(C(=O)N(C)C)c1C,C12862149_decoy,CASP3,Decoy,0,-7.60996,-6.7,-2.63,-6.594237536148252
CCOC(=O)C1=C(C(=O)COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C(C)=N[C@@H]1C,C39612509_decoy,CASP3,Decoy,0,-7.58947,-6.26,-1.03,-6.47093623493299
CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3ccc4c(c3)OCO4)n2C)c(C(=O)OC)c1C,C39965455_decoy,CASP3,Decoy,0,-9.94254,-7.04,-2.18,-7.531760642547075
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)cc1OC,C19357872_decoy,CASP3,Decoy,0,-7.94338,-5.91,-1.59,-5.88099261877076
COCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c(OC)c1,C40884492_decoy,CASP3,Decoy,0,-7.19509,-6.27,-2.52,-6.071172508858224
C=CCn1c(SCc2nc(N3CCOCC3)ncc2C(=O)OCC)nnc1-c1cc(C)nn1C,C41337356_decoy,CASP3,Decoy,0,-8.92218,-6.11,-1.19,-6.77136959563506
CCCn1c(SCc2nc(N3CCOCC3)ncc2C(=O)OCC)nnc1-c1cn(CC)nc1C,C41349102_decoy,CASP3,Decoy,0,-9.0924,-6.83,-3.58,-8.191761304681947
CCOC(=O)c1cnc(N(C)C)nc1CSc1nnc(-c2ccc(Cn3cccn3)o2)o1,C41386683_decoy,CASP3,Decoy,0,-7.47184,-6.7,-3.88,-5.503564814387119
CCOC(=O)c1cnc(N2CCCC2)nc1CSc1nnc(-c2ccc(Cn3cccn3)o2)o1,C41386692_decoy,CASP3,Decoy,0,-7.94347,-7.02,-2.8,-6.527337401059231
CC(=O)N[C@H]1[C@H](Oc2ccc(C=O)cc2)O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C44168728_decoy,CASP3,Decoy,0,-7.09331,-7.38,-3.24,-7.842227151673864
COC(=O)[C@H]1O[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44170047_decoy,CASP3,Decoy,0,-7.08158,-5.92,-1.54,-6.378094589488185
CCOCSc1nnc(NC(=O)CSc2nc(-c3cccc([N+](=O)[O-])c3)n[nH]2)s1,C59788295_decoy,CASP3,Decoy,0,-8.53762,-8.43,-0.92,-7.408627394862232
CCc1nnc(CN(CC)C(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2-c2ccccc2)o1,C59791598_decoy,CASP3,Decoy,0,-9.04287,-7.28,-2.95,-7.678546623295005
C=CCn1c(SCC(=O)N(CC)Cc2nnc(CC)o2)nnc1-c1ccc([N+](=O)[O-])cc1,C59792284_decoy,CASP3,Decoy,0,-8.41579,-6.03,-1.18,-6.069387029075916
CCOC(=O)C1=C(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nnnn2C)C(C)=N[C@@H]1C,C40012498_decoy,CASP3,Decoy,0,-6.22012,-7.55,-0.65,-6.757315929304585
CCOC(=O)C1=C(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nnnn2C)C(C)=N[C@H]1C,C40012499_decoy,CASP3,Decoy,0,-6.79991,-7.04,-2.51,-6.035722795723687
CCOC(=O)C1=C(C)C(C(=O)COC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)=N[C@H]1C,C40013161_decoy,CASP3,Decoy,0,-5.8056,-5.85,-2.6,-5.538101980557751
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](N=[N+]=[N-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C65748935_decoy,CASP3,Decoy,0,-4.78858,-6.45,-1.89,-5.2243265230950575
CCCCn1c(SCC(=O)c2cc(C)n(Cc3ccco3)c2C)nc2cc(C(=O)[O-])ccc2c1=O,C13044200_decoy,CASP3,Decoy,0,-8.62166,-7.39,-1.95,-7.702903606061072
C=CCc1cc(/C=C2/C(=O)N(c3cccc(C(=O)[O-])c3)C(=S)N=C2[O-])cc(OCC)c1OCC(=O)[O-],C19888670_decoy,CASP3,Decoy,0,-9.54856,-5.89,-2.06,-6.48180394652868
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OCC)s3)[C@H]2c2ccc(C)cc2)cc1,C09043473_decoy,CASP3,Decoy,0,-8.63513,-6.57,-1.3,-6.969278904030145
Cc1ccc(CO/N=C\C2=C([O-])[C@@H](/C=N/OCc3ccc(C)cc3)CN(c3ccc([N+](=O)[O-])cc3)C2)cc1,C20389040_decoy,CASP3,Decoy,0,-7.42846,-7.68,-1.43,-7.875972380992713
CCOc1cc(/C=C2/SC([N-]c3ccc(Cl)c(C(F)(F)F)c3)=NC2=O)ccc1OCCC(=O)[O-],C16920154_decoy,CASP3,Decoy,0,-8.077,-6.25,-2.58,-6.4037341133374825
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc(C(C)(C)C)cc2)cc1C,C21486959_decoy,CASP3,Decoy,0,-8.37653,-7.08,-0.99,-7.006874708277796
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc(C(C)C)cc2)cc1C,C24116542_decoy,CASP3,Decoy,0,-9.20896,-6.37,-1.67,-6.6491540573859655
COc1ccc(CSc2nc(C)c(CCSCc3ccccc3Cl)c([O-])n2)cc1[N+](=O)[O-],C16854081_decoy,CASP3,Decoy,0,-10.1764,-7.36,-4.62,-8.104755569930921
COc1cc(/C=C2/SC(=S)N=C2[O-])cc(Cl)c1OCCOCCOc1ccc(C)c(C)c1,C27531801_decoy,CASP3,Decoy,0,-8.96818,-6.02,-3.05,-5.795179802403689
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nc3ccc(OC)cc3s2)cc1,C33540877_decoy,CASP3,Decoy,0,-10.3859,-7.26,-2.35,-8.94154448281233
CCCCOc1ccc([C@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2Cc2ccccc2)cc1OC,C33701231_decoy,CASP3,Decoy,0,-8.1536,-6.94,-3.48,-7.705042210636448
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C34934890_decoy,CASP3,Decoy,0,-6.4283,-7.47,-5.25,-7.107129154100465
CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](C1)C[C@H](OC(C)=O)[C@H]1[C@H]3CC[C@H](CCCC(=O)[O-])[C@]3(C)[C@@H](OC(C)=O)C[C@@H]12,C35268907_decoy,CASP3,Decoy,0,-8.44496,-6.41,-1.51,-7.708273721533737
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2c2nccs2)cc1OCC,C35277400_decoy,CASP3,Decoy,0,-9.02608,-5.67,-4.35,-7.241041199047951
CCCCCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2Cc2ccccc2)cc1,C35420345_decoy,CASP3,Decoy,0,-7.99886,-6.06,-4.31,-6.393630137969806
CCCCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2Cc2ccccc2)cc1OCC,C35444671_decoy,CASP3,Decoy,0,-7.77741,-7.18,-2.61,-6.941442143809782
CCCCOc1ccc([C@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2Cc2ccccc2)cc1OCC,C35444673_decoy,CASP3,Decoy,0,-8.34846,-6.26,-4.42,-5.882941812534417
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@H]1c1ccc(C(C)(C)C)cc1,C35445408_decoy,CASP3,Decoy,0,-8.24443,-8.02,-4.2,-7.050725481908077
COCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@@H]1c1ccc(C(C)C)cc1,C35445513_decoy,CASP3,Decoy,0,-8.24943,-7.04,-3.52,-7.097938350172915
CCCCCOc1cccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2Cc2ccco2)c1,C35484687_decoy,CASP3,Decoy,0,-7.25048,-8.22,-1.85,-6.91557231598279
CCCCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2Cc2ccco2)cc1,C35567694_decoy,CASP3,Decoy,0,-8.46394,-5.44,-2.56,-6.886282210024988
CCCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2Cc2ccccc2)cc1OCC,C35568196_decoy,CASP3,Decoy,0,-8.96286,-6.56,-1.86,-6.746618938127143
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCC(C(=O)OCC)CC3)N2[C@H]1c1cccc(C)c1,C35697219_decoy,CASP3,Decoy,0,-9.24266,-6.9,-2.39,-7.785974185017914
CCN(C)/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCc3ccccc3)[C@H](c3ccc(OC)cc3OC)N12,C36061254_decoy,CASP3,Decoy,0,-8.67722,-6.41,-2.16,-6.845539510940037
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])N(C)CC)N2[C@@H]1c1cc(OC)ccc1OC,C36064365_decoy,CASP3,Decoy,0,-7.72595,-4.89,-2.54,-6.181889826225725
C=CCn1c(SCC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)nnc1-c1cccs1,C02366334_decoy,CASP3,Decoy,0,-9.14447,-6.99,-4.0,-6.927583880739499
CCCCCCOc1c(Cl)cc(C(=O)c2c(C)c(C#N)c(=O)n(C[C@@H]3CCCO3)c2[O-])cc1Cl,C38618875_decoy,CASP3,Decoy,0,-10.3255,-5.85,-1.9,-7.197612480135118
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](C1)C[C@@H](OC(C)=O)[C@@H]1[C@@H]2C[C@@H](OC(C)=O)[C@@]2(C)[C@@H](CCCC(=O)[O-])CC[C@@H]12,C39370880_decoy,CASP3,Decoy,0,-8.81317,-6.32,-1.67,-7.492849741108389
COc1cc(/C=C(C#N)/C([O-])=N/c2nnc(SCc3ccc(C)cc3)s2)ccc1OCCC(C)C,C39997554_decoy,CASP3,Decoy,0,-10.0341,-7.59,-1.51,-7.0105972040667766
CCCCOc1ccc(/C=C(C#N)/C([O-])=N/c2nnc(SCc3ccccc3F)s2)cc1OC,C39997640_decoy,CASP3,Decoy,0,-9.03341,-6.6,-3.06,-6.1432882808118405
CCCOc1ccc(/C=C(C#N)/C([O-])=N/c2nnc(SCc3ccccc3F)s2)cc1OCC,C39997669_decoy,CASP3,Decoy,0,-9.24122,-7.41,-1.75,-7.185326143596648
CCCOc1ccc(-c2nn(-c3ccccc3)cc2/C=C(C#N)/C([O-])=N/c2nnc(CCC)s2)cc1C,C39997852_decoy,CASP3,Decoy,0,-9.56977,-6.04,-2.51,-7.409477449600719
CCc1nnc(/N=C([O-])/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2ccc(OCCC(C)C)c(C)c2)s1,C39997945_decoy,CASP3,Decoy,0,-9.4173,-7.83,-1.33,-7.875300375230572
CCCCSc1ccc(-c2nn(-c3ccccc3)cc2/C=C(C#N)/C([O-])=N/c2nnc(CC)s2)cc1,C39997948_decoy,CASP3,Decoy,0,-7.39043,-5.58,-0.8,-6.022960500895165
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCC=C)s3)[C@H]2c2ccccc2)cc1,C40003224_decoy,CASP3,Decoy,0,-8.65497,-6.21,-1.37,-7.319347681106761
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCC=C)s3)[C@@H]2c2cccs2)cc1,C40003243_decoy,CASP3,Decoy,0,-10.758,-7.42,-1.2,-10.103181915905248
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)cc2)[C@H]1c1cc(Br)ccc1OC,C40026728_decoy,CASP3,Decoy,0,-7.37537,-4.97,-2.75,-6.587823087021004
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(OCCCCCC)cc1,C40026856_decoy,CASP3,Decoy,0,-8.29737,-5.17,-3.15,-6.5299633208040895
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CC=C)cc1OC,C40027865_decoy,CASP3,Decoy,0,-8.51688,-6.25,-1.94,-7.767723855958826
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCCC)cc1OC,C40079394_decoy,CASP3,Decoy,0,-7.74012,-5.81,-1.44,-6.367608735799788
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OC(C)C)cc2C)[C@H]1c1ccc(OCC)c(OCC)c1,C40084583_decoy,CASP3,Decoy,0,-7.92291,-7.37,-1.59,-10.059500138293489
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCCC)cc1OC,C40093598_decoy,CASP3,Decoy,0,-8.83352,-5.5,-2.67,-7.150851789595894
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCCC)cc1OC,C40100195_decoy,CASP3,Decoy,0,-7.19175,-6.6,-2.8,-7.073875558416786
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCC(C(=O)OCC)CC3)N2[C@H]1c1ccc(F)cc1,C40400677_decoy,CASP3,Decoy,0,-9.47964,-6.56,-1.26,-8.932484640403205
CC(=O)O[C@H]1CC[C@@](C)([C@H]2CC[C@]3(C)[C@H](CC[C@@H]3[C@H](C)CCCC(C)C)[C@@H]2C(=O)C(=O)[O-])C(=O)C1,C43726763_decoy,CASP3,Decoy,0,-7.48019,-6.78,-1.96,-8.180459622537741
CCCCc1ccc(-n2c(C)cc(/C=C3/C(=O)N(c4cc(OCC)ccc4OCC)C(=O)N=C3[O-])c2C)cc1,C59105132_decoy,CASP3,Decoy,0,-9.39201,-7.92,-3.47,-7.7634307637175715
CCOC(=O)COc1ccccc1/C=C1\S/C(=N\c2ccc(OCC)cc2)C(C(=O)OCC)=C1[O-],C59105427_decoy,CASP3,Decoy,0,-7.45589,-7.22,-1.95,-6.361610784631512
CCCCOc1ccc(C2=N/C(=C\c3ccc(OC(C)C)cc3)C(=O)N2c2ccc(C(=O)[O-])cc2)cc1,C59230926_decoy,CASP3,Decoy,0,-8.70351,-5.73,-3.0,-6.7640252596709685
C#CCOc1c(Cl)cc(/C=C2\S/C(=N\c3ccc(OCC)cc3)C(C(=O)OCC)=C2[O-])cc1OC,C59364794_decoy,CASP3,Decoy,0,-8.80419,-5.29,-1.55,-6.075192322582868
CCOC(=O)C1=C([O-])/C(=C/c2ccc(OCC(=O)[O-])c(Cl)c2)S/C1=N/c1ccc(OCC)cc1,C59437154_decoy,CASP3,Decoy,0,-7.66102,-6.51,-1.85,-6.468119872101036
CO[C@H]1[C@H]2OC3(CCCCC3)O[C@@H]2O[C@@H]1[C@H](O)CO,C04535727_decoy,CASP3,Decoy,0,-6.64616,-5.05,-0.25,-6.449825239351335
C[NH+]1CCN(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])CC1,C06126037_decoy,CASP3,Decoy,0,-6.82493,-4.97,-0.84,-5.024738564001583
O=C1NCCCC[C@H]1Sc1n[nH]c(=O)n1C1CC1,C11118763_decoy,CASP3,Decoy,0,-7.70727,-5.08,-0.5,-5.825767084601557
CNC(=O)O/N=C/c1n[nH]cc1Br,C01042905_decoy,CASP3,Decoy,0,-5.6331,-4.45,-0.48,-4.816846060003499
CNC(=O)c1nn(-c2ccc(C)cc2)nc1CO,C21783294_decoy,CASP3,Decoy,0,-6.20076,-5.76,-0.47,-5.793601560814648
COC(=O)c1sc2[nH]c(CO)nc(=O)c2c1C,C21951197_decoy,CASP3,Decoy,0,-7.13777,-4.72,-0.72,-4.985704840337628
Cc1nn(-c2ccccn2)c2[nH]c(=O)c(CO)cc12,C33419726_decoy,CASP3,Decoy,0,-5.81306,-5.43,0.15,-4.696505848192154
O=C1C=CC(=CNNC(=O)c2cnccn2)C=C1,C13899004_decoy,CASP3,Decoy,0,-6.73254,-5.57,-0.63,-4.562378787991051
Cc1cc(NC2CCC(O)CC2)n2ncnc2n1,C35121296_decoy,CASP3,Decoy,0,-6.7125,-5.94,-0.75,-4.80492133420212
Nc1ccc(=O)n(CCN2C(=O)CCCCC2=O)c1,C35326865_decoy,CASP3,Decoy,0,-5.41888,-5.0,-1.8,-3.526445347729715
Cc1occc1-c1cc(N)n(-c2ncccn2)n1,C35731047_decoy,CASP3,Decoy,0,-5.14921,-5.21,-1.86,-3.279612907628045
CO[C@H]1C[C@H]2C(=O)N(c3cccc(N)c3)C(=O)N2C1,C37515107_decoy,CASP3,Decoy,0,-5.72559,-5.13,-1.35,-4.21273136412986
CN(c1ccc(O)cc1)S(=O)(=O)c1cn[nH]c1,C37745081_decoy,CASP3,Decoy,0,-4.53856,-4.77,-1.41,-3.570352876414768
Cc1c(C)n(CCS(C)(=O)=O)c2ncnc(N)c12,C37751049_decoy,CASP3,Decoy,0,-6.67145,-5.35,-0.46,-5.417796927809844
COc1nc(C)nc(Cl)c1NC1=NCCN1,C01854466_decoy,CASP3,Decoy,0,-5.63654,-4.12,-0.64,-3.0847492135277106
O=C1C=CC(=CNc2nnc3n2C[C@H](O)CS3)C=C1,C01099595_decoy,CASP3,Decoy,0,-6.0115,-5.5,-0.88,-3.760394261509355
N#CC1=C(N)OC2=NC=NC(=O)[C@@H]2[C@H]1c1cccs1,C39355983_decoy,CASP3,Decoy,0,-7.73323,-5.43,-0.66,-4.759026912854257
N#CC1=C(N)OC2=NC=NC(=O)[C@H]2[C@@H]1c1cccs1,C39355986_decoy,CASP3,Decoy,0,-7.23761,-6.44,-0.63,-4.905756386969898
CC1=NNC(=O)/C1=C(/C)C/C(C)=C1\C(=O)NN=C1C,C39359433_decoy,CASP3,Decoy,0,-6.13732,-5.56,-1.57,-4.338771457278164
O=C1N[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc(O)cc1,C40167033_decoy,CASP3,Decoy,0,-5.44395,-6.16,-0.58,-3.800143593994086
N#CC1(NS(=O)(=O)c2cn[nH]c2)CCCC1,C40364369_decoy,CASP3,Decoy,0,-5.92392,-4.62,0.53,-4.643761363937914
CS(=O)(=O)c1ccccc1-n1cnc(N)n1,C40516962_decoy,CASP3,Decoy,0,-5.26224,-4.68,0.25,-3.953226809482332
Cc1c(C(=O)N(C)c2ccncc2N)cnn1C,C42140727_decoy,CASP3,Decoy,0,-5.70367,-5.19,-1.44,-4.746545869653596
O=C(Nc1nnc(C2CC2)s1)N1CCC[C@@H](O)C1,C43360358_decoy,CASP3,Decoy,0,-6.7784,-5.19,-0.45,-5.549250669989295
C[C@@H](C#N)S(=O)(=O)c1nc2cc(N)ccc2o1,C43519264_decoy,CASP3,Decoy,0,-6.81716,-5.92,-0.41,-5.1480131903550825
O=C([O-])[C@@H]1CN(C(=O)C[C@@H]2CCC[NH2+]2)CCO1,C43705649_decoy,CASP3,Decoy,0,-5.98975,-4.46,0.7,-3.659779693603196
CO[C@@H]1[C@H]2OC3(CCCCC3)O[C@@H]2O[C@@H]1[C@@H](O)CO,C44168133_decoy,CASP3,Decoy,0,-7.20807,-5.89,-0.14,-8.010052793526661
CC1(C)CC(=O)C(=CNNc2cnccn2)C(=O)C1,C45089208_decoy,CASP3,Decoy,0,-6.92522,-5.32,-0.89,-4.767897160226148
Cc1nc(CNC(=O)Nc2nnc(C)s2)cs1,C45344819_decoy,CASP3,Decoy,0,-6.81484,-5.24,-0.51,-4.28980791494446
NC(=O)CC1CCN(C(=O)c2cnns2)CC1,C48792340_decoy,CASP3,Decoy,0,-7.51921,-4.99,-0.43,-5.897607344085015
NS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]2C3)o1,C48820908_decoy,CASP3,Decoy,0,-7.8972,-5.95,0.77,-4.762634657209667
CC(C)(C)N1CCN(C(=O)Cn2cc(N)cn2)CC1,C48926133_decoy,CASP3,Decoy,0,-5.56795,-3.95,-0.45,-4.19650547453512
Cc1cc(CNc2cn[nH]c(=O)c2Cl)no1,C49056035_decoy,CASP3,Decoy,0,-8.03049,-4.49,-0.59,-4.939937063452698
C[C@@H]1CN(C(=O)CNC(=O)NC2CC2)[C@H](C)CO1,C49090249_decoy,CASP3,Decoy,0,-5.42153,-4.41,-1.31,-4.791941330830695
C[C@@H]1CO[C@@H](C)CN1C(=O)CNC(=O)NC1CC1,C49090250_decoy,CASP3,Decoy,0,-5.23076,-4.38,-1.61,-3.5104831835032004
Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)on1,C49098838_decoy,CASP3,Decoy,0,-7.58644,-4.54,0.24,-4.892728944367758
C[C@H](c1ccncc1)N(C)C(=O)Nc1cn[nH]c1,C49444973_decoy,CASP3,Decoy,0,-5.40678,-4.92,-0.39,-5.183887914973157
CNc1ccc(C(=O)Nc2nc(C)cs2)nn1,C50723020_decoy,CASP3,Decoy,0,-7.21913,-4.47,-0.51,-4.218476677191892
NC(=O)C1CCN(c2cnnc(Cl)n2)CC1,C51039308_decoy,CASP3,Decoy,0,-7.66203,-4.73,-1.24,-5.1192921788492525
Cc1nc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2O)cn1C,C52003376_decoy,CASP3,Decoy,0,-6.74308,-5.37,-1.85,-3.989495858667501
C[C@@H]1CCCC[C@H]1N1CN=C(NS(C)(=O)=O)NC1,C40387212_decoy,CASP3,Decoy,0,-8.02601,-6.84,-0.24,-9.088141293419874
CC(C)N(C(=O)c1ccc([O-])nn1)[C@@H]1CC[NH2+]C1,C58234193_decoy,CASP3,Decoy,0,-6.46875,-5.39,-0.06,-5.666468269210162
C[C@@H]1CC(=O)N(Cc2cc(N)cc3c2OCOC3)C1=O,C40739476_decoy,CASP3,Decoy,0,-6.02673,-5.09,-1.2,-4.338852347331547
Cc1nn(C(C)C)c(C)c1NC(=O)[C@@H]1CCC(=O)N1,C58994495_decoy,CASP3,Decoy,0,-6.36943,-5.27,-1.26,-4.800167320595119
C[C@@H]([NH2+][C@H]1CCOc2ccccc21)c1nnn[n-]1,C44923453_decoy,CASP3,Decoy,0,-7.30572,-9.33,0.43,-11.927260042599777
CCNC(=O)NC(=O)CN1CCOCC1(C)C,C49981243_decoy,CASP3,Decoy,0,-6.37349,-4.13,-0.97,-5.514246964459605
Cc1nn(C)cc1[C@@H]1SCC(=O)Nc2[nH]nc(C)c21,C44900975_decoy,CASP3,Decoy,0,-8.03447,-5.36,-1.42,-4.826058456222179
N#Cc1cc(N)cnc1N1CC[C@H](N2CCOCC2)C1,C62976159_decoy,CASP3,Decoy,0,-5.56332,-5.02,-0.2,-3.8702729615240985
CC1=C(CC(=O)Nc2nnc(C)s2)[C@@H](C)ON1,C63781056_decoy,CASP3,Decoy,0,-6.16235,-4.4,-0.59,-4.05190580550907
Cc1nnc(NC(=O)N2CCC([C@H](C)O)CC2)s1,C63856164_decoy,CASP3,Decoy,0,-6.43325,-5.27,-0.57,-3.6158668562438
C[C@@H](O)CNc1nc2sc3c(c2c2ncnn12)CCCC3,C05562328_decoy,CASP3,Decoy,0,-7.57954,-5.64,-0.61,-5.771335240352064
Oc1ccc(/C=N/n2c(-c3ccco3)n[nH]c2=S)cc1,C01251231_decoy,CASP3,Decoy,0,-6.17353,-5.38,-0.85,-4.9902565106436105
N#Cc1cnc2nc(SCc3ccccc3)nn2c1N,C09303247_decoy,CASP3,Decoy,0,-6.62737,-5.83,-0.65,-4.7783085737563615
COc1c(N)cc(-c2nn3cnnc3s2)cc1Cl,C20134738_decoy,CASP3,Decoy,0,-7.0369,-6.26,-1.32,-5.53747755868633
Nc1cc2ncnc(N3CCN(c4ccccc4)CC3)c2cn1,C21166523_decoy,CASP3,Decoy,0,-7.43665,-6.45,-0.36,-5.301160944193718
Cc1cc(NC(=O)c2oc3c(c2C)[C@@H](O)CC(C)(C)C3)no1,C27816813_decoy,CASP3,Decoy,0,-6.80827,-5.66,-1.43,-4.732916699851764
O[C@@]1(c2ccccc2)CCN(c2ncnc3nc[nH]c23)C1,C32560982_decoy,CASP3,Decoy,0,-7.39475,-5.82,-0.6,-5.226637508492527
Nc1ccc(Sc2nnnn2C2CC2)c2ncccc12,C35342320_decoy,CASP3,Decoy,0,-6.52067,-5.57,-1.03,-5.571000691126461
COc1nc(Sc2nnc3n2CCCCC3)ccc1N,C37077868_decoy,CASP3,Decoy,0,-7.69866,-7.03,-3.23,-7.167262227977118
O=C(N[C@H]1CCC[C@H](O)C1)c1ccc(Cl)c([N+](=O)[O-])c1,C38103259_decoy,CASP3,Decoy,0,-5.74771,-5.31,-1.73,-4.326621710399343
C/C(=N/N)c1nn(-c2ccccc2)c(-c2ccco2)c1C#N,C39123617_decoy,CASP3,Decoy,0,-5.15293,-6.12,-1.16,-3.854658408670291
COCC1=C2[C@@H](c3ccc(F)cc3)C(C#N)=C(N)O[C@H]2N=N1,C39279890_decoy,CASP3,Decoy,0,-6.8961,-6.45,-0.56,-6.093871689907775
Cc1nc(N2CCCC2)nc(N2CCC[C@H](C(N)=O)C2)c1C,C32576753_decoy,CASP3,Decoy,0,-9.66326,-6.39,-2.18,-6.497417641544839
Cc1cc([C@H]2N=C3C=NN(Cc4ccco4)[C@H]3N2)ccc1O,C39536895_decoy,CASP3,Decoy,0,-7.10822,-5.96,-2.24,-5.147233015654132
C/C(=N\NC(=O)[C@@H]1N=NC2=C1CCC2)c1ccc(O)cc1,C39576717_decoy,CASP3,Decoy,0,-6.60229,-5.8,-0.53,-4.329841198687857
CSc1nn(-c2cc(C)nc(C(C)C)n2)c(N)c1C#N,C39930826_decoy,CASP3,Decoy,0,-7.97718,-5.17,-1.49,-4.105593766500853
Cc1cc(-c2ccc3c(c2)OCCO3)c2c(N)noc2n1,C41440455_decoy,CASP3,Decoy,0,-6.51429,-6.77,-0.94,-4.704341870844157
COc1ccc(N)cc1-c1nnnn1-c1ccc(C)cc1,C42027377_decoy,CASP3,Decoy,0,-5.48532,-5.37,-0.77,-4.647144077734795
C[C@H]([C@@H]1CCCO1)n1nnnc1-c1cc(N)ccc1Cl,C42028469_decoy,CASP3,Decoy,0,-5.59472,-5.6,-0.66,-4.953411271524208
Cc1n[nH]c(C)c1C(=O)N[C@@H](C)c1ccc2c(c1)OCO2,C42288179_decoy,CASP3,Decoy,0,-6.31131,-5.95,-0.79,-5.965005054643929
C[C@H]1CCc2nc(NC(=O)N3CCNC(=O)C3)sc2C1,C43577672_decoy,CASP3,Decoy,0,-7.74063,-4.76,-1.24,-5.867743558549026
Nc1c(Br)cnn1Cc1csc([N+](=O)[O-])c1,C43666473_decoy,CASP3,Decoy,0,-7.2328,-4.43,-2.06,-4.418973200740811
Nc1ccc(-c2nnnn2C[C@@H]2CCCOC2)c(Cl)c1,C44982744_decoy,CASP3,Decoy,0,-6.82604,-5.25,-0.35,-5.712483898106792
Cc1c(N)cc(-c2nnnn2C[C@@H]2CCCOC2)cc1F,C44982784_decoy,CASP3,Decoy,0,-7.34922,-5.57,0.04,-5.164067468011025
Cc1cc(NC(=O)N[C@H]2CC(C)(C)Cc3oc(C)cc32)no1,C46960813_decoy,CASP3,Decoy,0,-5.83483,-5.83,-1.34,-4.838277703224899
COC(=O)N1CCC(NC(=O)NC2CCCCC2)CC1,C48984491_decoy,CASP3,Decoy,0,-5.7548,-5.44,-1.23,-4.727653119962914
Cc1nc(NC(=O)Nc2cnn(C(C)(C)C)c2)sc1C,C49444850_decoy,CASP3,Decoy,0,-6.79249,-4.94,-0.95,-4.842823438956795
CC(C)(C)c1cn2nc(N[C@H]3CCCNC3=O)sc2n1,C49491250_decoy,CASP3,Decoy,0,-7.02789,-6.71,-1.85,-5.230983016501659
Nc1ncnc2c1ncn2CC(=O)c1cccc(Cl)c1,C50131721_decoy,CASP3,Decoy,0,-7.71515,-5.47,-1.61,-5.874366093556558
CO[C@@H]1CCC[C@@H]1n1nnnc1-c1ccc(N)cc1Cl,C50377002_decoy,CASP3,Decoy,0,-5.01261,-5.12,-0.68,-4.789563617888864
C[C@H]1C[C@H](C)CN(C(=O)c2cc(N)c(F)cc2[N+](=O)[O-])C1,C50699603_decoy,CASP3,Decoy,0,-5.56048,-5.6,-0.19,-5.219846336674302
Nc1ccc(Cn2cc(Br)cn2)cc1[N+](=O)[O-],C50829778_decoy,CASP3,Decoy,0,-5.00902,-6.17,-1.69,-3.994901691100928
O=C(Nc1nncs1)N1CC[C@@]2(O)CCCC[C@H]2C1,C55088272_decoy,CASP3,Decoy,0,-7.64768,-5.32,-0.6,-5.9952152869657365
C[C@@H]1C[C@H](C)CN(C(=O)CSc2ncc(C#N)c(N)n2)C1,C18068177_decoy,CASP3,Decoy,0,-7.28324,-5.72,-1.04,-5.606743722921288
O=C(Nc1nc[nH]n1)c1csc(-c2ccccc2F)n1,C57307914_decoy,CASP3,Decoy,0,-6.5639,-7.71,-1.72,-8.605395768383486
Nc1nc(Cl)cc(Oc2ccc(-n3ccnc3)cc2)n1,C58225712_decoy,CASP3,Decoy,0,-6.59835,-4.87,-1.3,-4.295286647677902
N#Cc1cc(C#N)c(SCc2cn3ccccc3n2)nc1N,C60583034_decoy,CASP3,Decoy,0,-5.60736,-5.62,-1.94,-3.9433981661143247
C[C@@H]1CC[C@@H](C(N)=O)CN1c1nc(Cl)nc(Cl)n1,C61518829_decoy,CASP3,Decoy,0,-7.0352,-5.27,-0.82,-5.076552714666228
Cc1cc(-c2ccc(F)cc2)nc(-n2ncc(C#N)c2N)n1,C62203362_decoy,CASP3,Decoy,0,-6.21405,-6.0,-2.44,-4.505904848694093
Cc1ccc(-c2c(C#N)nnn2-c2ccc(C(N)=O)cc2)cc1,C62218385_decoy,CASP3,Decoy,0,-8.02146,-6.11,-1.39,-6.231382467103512
Cc1ccc2c(c1)S(=O)(=O)N=C(NCc1ccco1)N2,C62324747_decoy,CASP3,Decoy,0,-6.4593,-5.57,-0.15,-4.5770886933876085
Cc1n[nH]c(C)c1S(=O)(=O)N1CCCc2cccc(O)c21,C63064016_decoy,CASP3,Decoy,0,-6.01118,-5.73,-2.96,-5.245479467851588
O=C([O-])CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2C1,C63270741_decoy,CASP3,Decoy,0,-5.49334,-4.93,-0.44,-5.285241685590344
N#CC1=C(N)OC2=NN=C(c3ccccc3)[C@@H]2[C@@H]1c1ccco1,C04457944_decoy,CASP3,Decoy,0,-5.61246,-5.43,-0.72,-4.17910885132064
CC1(C)CNC(=O)c2[nH]c([C@H]3N=NC4=C3CCC4)nc2C1,C65396574_decoy,CASP3,Decoy,0,-6.86672,-7.37,-0.36,-5.539272956306143
Cc1c[nH]/c(=N\S(=O)(=O)c2c[nH]c3ncccc23)s1,C66247471_decoy,CASP3,Decoy,0,-5.4822,-4.76,0.08,-4.056127616278775
COC(=O)N1CCC(NC(=O)N[C@@H]2CCCC[C@H]2C)CC1,C66355071_decoy,CASP3,Decoy,0,-6.44516,-4.89,-0.95,-5.11252479324992
COC(=O)N1CCC(NC(=O)N[C@@H]2CCCC[C@@H]2C)CC1,C66355072_decoy,CASP3,Decoy,0,-6.72239,-6.19,-2.26,-7.5818689785065505
C[C@@H]1C[C@H](CC(=O)NN2CC(=O)NC2=O)CC(C)(C)C1,C67105574_decoy,CASP3,Decoy,0,-7.97365,-6.08,-2.3,-5.818774323574257
COC(=O)c1ccc([C@H]2SCC(O)=Nc3n[nH]cc32)cc1,C20725850_decoy,CASP3,Decoy,0,-7.61041,-6.31,-1.32,-6.8296069438092175
Cn1c(=O)[nH]c(=O)c2c1nc(N1CCCCC1)n2C[C@H](O)CCl,C00041574_decoy,CASP3,Decoy,0,-8.39531,-5.38,-0.36,-7.124439321020182
CCOC(=O)C(=O)N1Cc2cc3c(cc2[C@@H]2C[C@@H](O)[C@@H](O)C[C@@H]21)OCO3,C05048547_decoy,CASP3,Decoy,0,-7.44195,-7.0,-0.98,-5.932730169928699
O=C(NCCO)[C@H]1CCCN(S(=O)(=O)c2cccc3nsnc23)C1,C09047165_decoy,CASP3,Decoy,0,-8.54978,-5.95,-0.99,-6.731664904778871
O=C(NCCO)[C@@H]1CCCN(S(=O)(=O)c2cccc3nsnc23)C1,C09047168_decoy,CASP3,Decoy,0,-8.25735,-7.15,-0.41,-9.38178862809858
Cn1nccc1C(=O)N[C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21,C12054092_decoy,CASP3,Decoy,0,-8.34928,-5.39,-2.75,-6.0616864924545615
CCN(C(=O)[C@@H](C)Sc1ncc(C#N)c(N)n1)[C@@H]1CCS(=O)(=O)C1,C12554174_decoy,CASP3,Decoy,0,-8.54472,-4.84,-0.58,-6.16304867336622
Cn1c(CC(=O)NNC(=O)CN2CCSC2=O)nc2ccccc21,C12556545_decoy,CASP3,Decoy,0,-7.63601,-7.02,-0.9,-6.6007335121561885
O=C1N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCN(C(=O)c3ccco3)C[C@H]12,C04260255_decoy,CASP3,Decoy,0,-6.37145,-6.22,-3.78,-5.551693898941832
O=C1NC(=O)C2(CCN(C(=O)c3cccnc3OCC(F)(F)F)CC2)N1,C24865605_decoy,CASP3,Decoy,0,-6.43498,-5.76,-1.25,-5.628027128630295
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)c3ccco3)CC2)c(C)o1,C27617779_decoy,CASP3,Decoy,0,-7.38372,-7.44,-1.92,-2.229211777831821
C[C@@H](Sc1nnnn1C(C)(C)C)C(=O)N1CCC[C@@H](C(N)=O)C1,C28447124_decoy,CASP3,Decoy,0,-7.04256,-5.81,-1.73,-7.641073937603055
C[C@@H](Sc1nnnn1C(C)(C)C)C(=O)N1CCC[C@H](C(N)=O)C1,C28447129_decoy,CASP3,Decoy,0,-6.7488,-6.25,-0.79,-6.2422143100760215
Cc1cc(S(=O)(=O)N(C)C)cc(NCC(=O)N2CCNC2=O)c1C,C31073023_decoy,CASP3,Decoy,0,-6.90721,-6.77,-2.79,-6.059283287984342
COC(=O)c1cc(-c2csc(/N=C(\O)c3ccc[n+]([O-])c3)n2)c[nH]1,C29870587_decoy,CASP3,Decoy,0,-6.66016,-5.61,-0.69,-5.282343794887666
CCc1sc(C(=O)NNC(=O)Cn2ccc(=O)n(C)c2=O)cc1C,C32681837_decoy,CASP3,Decoy,0,-6.36501,-7.06,-2.25,-5.765730692244027
Cc1cc2nnc(S[C@@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)n2c(C)n1,C33030646_decoy,CASP3,Decoy,0,-7.47119,-6.16,-1.88,-6.095728310566836
Cn1ncc2c(N3CCN([C@H](C(N)=O)c4ccc(F)cc4)CC3)ncnc21,C12972959_decoy,CASP3,Decoy,0,-7.74742,-6.27,-0.56,-5.534808370894663
Cc1nc(CSc2nnc(Cc3c(C)[nH]c(=O)[nH]c3=O)o2)cs1,C36708466_decoy,CASP3,Decoy,0,-8.36725,-6.12,-0.5,-6.76044868769358
CC(=O)N[C@H]1[C@H](Oc2ccc(C=O)cc2)O[C@@H]2COC(C)(C)O[C@H]2[C@@H]1O,C39715746_decoy,CASP3,Decoy,0,-4.94548,-5.82,-2.23,-4.651312410265761
COc1c2c(c(S(=O)(=O)NCCO)c3c1OCO3)CCN(C)C2,C40309967_decoy,CASP3,Decoy,0,-7.26265,-5.38,-0.47,-5.8885340189567055
Cc1nnc(NC(=O)NC[C@@H]([C@H]2CCOC2)N2CCOCC2)s1,C40526520_decoy,CASP3,Decoy,0,-6.87613,-5.51,-1.26,-5.42886006988737
Cc1cc(N2C(=O)[C@@H](C)CS2(=O)=O)ccc1S(=O)(=O)N[C@@H](C)CO,C40664026_decoy,CASP3,Decoy,0,-8.29305,-6.75,-0.91,-7.052064549136019
[H]/N=C1C(=C/c2ccc(O)c(OC)c2)/C(=O)N=C2SC(N3CCCC3)=NN2/1,C41085008_decoy,CASP3,Decoy,0,-7.74139,-6.26,-0.82,-5.353718355364966
O=C(NCCNC(=O)N1CCN(C(=O)[C@H]2CCCO2)CC1)C1CC1,C43308960_decoy,CASP3,Decoy,0,-7.1041,-6.13,-0.91,-6.311407882506234
C[C@H](C(=O)NC(=O)NC[C@H]1CCCO1)N1CCN(c2nccs2)CC1,C43610712_decoy,CASP3,Decoy,0,-9.23279,-6.51,-1.29,-7.414734420683667
Cc1cc(C(=O)N2CCC(CNC(=O)C(=O)NC(C)(C)C)CC2)no1,C43942061_decoy,CASP3,Decoy,0,-6.51122,-5.4,-2.38,-4.770431303142422
C[C@H](NC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1nncn1C,C46964029_decoy,CASP3,Decoy,0,-6.19498,-5.5,-1.95,-4.7072903381004485
Cc1nc(S[C@H](C)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)oc1C,C47558446_decoy,CASP3,Decoy,0,-5.55909,-6.82,-1.06,-4.317406878767371
Cc1nnnn1/C(=C\c1ccccc1)C(=O)N1CCC(C(N)=O)CC1,C48237875_decoy,CASP3,Decoy,0,-8.22126,-6.32,-1.62,-6.727428223380166
CC(=O)NCC1CCN(C(=O)Cc2csc(N3CCNC3=O)n2)CC1,C48353186_decoy,CASP3,Decoy,0,-7.79052,-5.47,-0.77,-5.603977973483063
CSC1=NSC2=NC(=O)/C(=C\c3ccc(OCC(=O)[O-])cc3)C(=[NH2+])N12,C20114604_decoy,CASP3,Decoy,0,-7.47808,-5.21,-1.22,-7.303783486928523
O=C1C[C@@H](C(=O)NCCCn2nc3ccccn3c2=O)c2ccccc2N1,C54322575_decoy,CASP3,Decoy,0,-5.31754,-7.2,-1.07,-6.795012655831021
[H]/N=C1C(=C\c2ccc(O)c(OC)c2)/C(=O)N=C2SC(N3CCCC3)=NN2/1,C20356254_decoy,CASP3,Decoy,0,-7.0633,-6.33,-1.57,-5.205017096265633
Cc1nnc(NC(=O)CNC(=O)c2ccc(N3CCCC3=O)cc2)s1,C23625852_decoy,CASP3,Decoy,0,-7.85299,-6.39,-0.9,-6.001042668501444
Nc1nnc(SCC(=O)N2CCN(c3cnccn3)CC2)s1,C42060723_decoy,CASP3,Decoy,0,-7.54368,-5.89,-1.19,-5.661807067031609
C[C@H](Sc1nnc(-c2ccncc2)n1N)c1nnc(C2CCC2)o1,C59845395_decoy,CASP3,Decoy,0,-7.26385,-7.02,-1.18,-6.062768973147931
Cc1noc(C)c1CNC(=O)[C@@H]1NC(C2=C[C@H]3N=CC=C3C=C2)=NO1,C39956072_decoy,CASP3,Decoy,0,-7.19838,-7.63,-0.47,-6.065904159438023
O=C1C[C@@H](C(=O)N2CCC(Cc3n[nH]c(=O)n3-c3ccccc3)CC2)CN1,C65461986_decoy,CASP3,Decoy,0,-8.42431,-6.48,-0.97,-6.386531934707284
CS(=O)(=O)N1CCC[C@H](C(=O)NCc2nc(-c3cccs3)n[nH]2)C1,C66429250_decoy,CASP3,Decoy,0,-9.43109,-6.57,-0.61,-6.846672976178719
CC(C)n1c(CNC(=O)c2csc(-c3ncccn3)n2)n[nH]c1=S,C66640515_decoy,CASP3,Decoy,0,-8.65435,-6.71,-2.09,-8.095333267211952
CC(C)n1c(CNC(=O)[C@@H]2CCCN(c3ncccn3)C2)n[nH]c1=S,C66650185_decoy,CASP3,Decoy,0,-8.31277,-6.92,-2.41,-6.243164683675163
CC(C)n1c(CNC(=O)[C@H]2CCCN(c3ncccn3)C2)n[nH]c1=S,C66650186_decoy,CASP3,Decoy,0,-6.33,-6.65,-1.38,-5.5829778132642645
CC(C)n1c(CNC(=O)CN2C(=O)COc3ccccc32)n[nH]c1=S,C66650264_decoy,CASP3,Decoy,0,-6.6784,-6.89,-1.75,-5.936601401527931
Cn1c(CCNC(=O)C2=NN(c3ccccc3)C(=O)CC2)n[nH]c1=S,C67051991_decoy,CASP3,Decoy,0,-7.41857,-6.36,-1.07,-5.90617878460067
N#Cc1ccc(N2CCC(NC(=O)CNC(=O)c3ccoc3)CC2)nc1,C67179953_decoy,CASP3,Decoy,0,-7.1578,-5.53,-0.46,-4.470795360137131
CCCc1cc(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)[nH]n1,C67278557_decoy,CASP3,Decoy,0,-7.12595,-6.74,-0.29,-5.957588354039645
Cn1cc(CNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)cn1,C67394462_decoy,CASP3,Decoy,0,-7.95415,-6.17,-0.49,-6.986784205667005
Cc1nccn1-c1cc(CNC(=O)Nc2nnc(C(F)F)s2)ccn1,C67586869_decoy,CASP3,Decoy,0,-6.35359,-6.25,-2.68,-4.955991710307471
Cc1c([C@H](C)NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cnn1C,C67644507_decoy,CASP3,Decoy,0,-8.72861,-6.57,-1.11,-8.361655823815568
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NCc1nnc2n1CCC2,C67645365_decoy,CASP3,Decoy,0,-6.97836,-5.54,-2.29,-5.6287688191545495
CC(C)[C@@H]1OC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C1=O,C05956075_decoy,CASP3,Decoy,0,-6.37998,-5.52,-1.92,-4.381934915142471
O=C(/C=C/C(=O)N1CCOCC1)Nc1nccs1,C03332130_decoy,CASP3,Decoy,0,-6.86345,-4.82,-1.15,-4.177376373622712
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(O)CC1,C08114969_decoy,CASP3,Decoy,0,-4.84097,-6.57,-0.65,-5.4753804887656585
Cc1nnc(NC(=O)[C@H]2CC(=O)N(C(C)C)C2)s1,C08273208_decoy,CASP3,Decoy,0,-5.92067,-4.73,-0.61,-4.563677746545817
O=S1(=O)CC[C@@H](Sc2ncnc3nc[nH]c23)C1,C06161144_decoy,CASP3,Decoy,0,-6.3972,-4.73,-0.4,-4.406325329401011
Cn1ncc2c(N3CCC[C@@H](CO)C3)ncnc21,C12485031_decoy,CASP3,Decoy,0,-6.50041,-5.87,-0.43,-5.152421211026176
Cn1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)n1,C26405836_decoy,CASP3,Decoy,0,-6.20095,-4.86,-1.28,-4.831476031929763
Cc1cccc2c(=O)n(C[C@@H](O)c3nccn3C)cnc12,C32541384_decoy,CASP3,Decoy,0,-6.44197,-5.11,-0.79,-4.312556626044658
C[C@@H](Cl)C(=O)NC(=O)N(C)[C@@H]1CCS(=O)(=O)C1,C36870575_decoy,CASP3,Decoy,0,-7.33883,-4.1,-0.24,-5.180490813567361
C[C@@H](Cl)C(=O)NC(=O)N(C)[C@H]1CCS(=O)(=O)C1,C36870577_decoy,CASP3,Decoy,0,-7.032,-4.31,-0.68,-4.84278187417475
O=C1CCC(C(=O)N2CCO[C@H]3CCCC[C@H]32)=NN1,C37841663_decoy,CASP3,Decoy,0,-6.28969,-4.69,0.1,-4.102895613752052
Cc1nccc(CNC(=O)c2ccc(Cl)nn2)n1,C38108041_decoy,CASP3,Decoy,0,-6.70677,-4.84,-0.83,-4.971483928423095
BrC1=CN=N[C@@H]1[C@H]1Nn2cnnc2S1,C39246287_decoy,CASP3,Decoy,0,-6.17412,-4.54,-0.98,-3.823746501801044
Cc1nc(C(=O)N/N=C/[C@@H]2N=NC=C2Cl)cs1,C39339235_decoy,CASP3,Decoy,0,-6.95084,-4.94,-0.64,-5.323034631291417
Cc1nnc(NC[C@H]2COCCO2)c(C#N)c1C,C40221133_decoy,CASP3,Decoy,0,-6.72477,-5.45,-0.52,-4.89002066056258
Cn1ncc2c(N3CCCC[C@H]3CO)ncnc21,C40429135_decoy,CASP3,Decoy,0,-6.09698,-5.29,-0.13,-4.885488731888119
O=C(NC1CC1)N1CCO[C@@H]2CS(=O)(=O)C[C@H]21,C40666382_decoy,CASP3,Decoy,0,-6.20007,-5.96,-1.04,-4.663171340111855
CSc1ncnc(N[C@H]2CCS(=O)(=O)C2)c1C#N,C41527700_decoy,CASP3,Decoy,0,-6.66497,-5.71,-1.19,-4.904690939263325
Cc1cc(N[C@@H](C)C(=O)N(C)C)n2ncnc2c1,C42571996_decoy,CASP3,Decoy,0,-5.73848,-4.82,-0.77,-5.111281203933732
C[C@H]1COCCN1C(=O)N[C@H]1CCS(=O)(=O)C1,C42870711_decoy,CASP3,Decoy,0,-5.87504,-4.59,-0.63,-4.31081701460702
Cc1noc2ncc(C(=O)/N=C3/NCCS3)cc12,C43083887_decoy,CASP3,Decoy,0,-5.75521,-5.17,-0.32,-4.367780247535099
CC(=O)N1CCN(C(=O)Nc2nc(C)cs2)CC1,C43258725_decoy,CASP3,Decoy,0,-5.62038,-4.96,-0.94,-5.355071077052281
O=C(Nc1onc2c1CSC2)c1cnccn1,C44451173_decoy,CASP3,Decoy,0,-6.90003,-4.98,0.18,-4.75312221108377
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(O)CC1,C44747860_decoy,CASP3,Decoy,0,-5.24944,-4.89,-0.85,-4.158704298935027
CC(C)(C)n1cc(C(=O)N[C@@H]2CCS(=O)(=O)C2)cn1,C48276388_decoy,CASP3,Decoy,0,-7.09543,-4.6,-0.45,-4.991328922313367
C[C@H]1CCCC[C@@H]1NC(=O)Cn1cnnc1C#N,C48380900_decoy,CASP3,Decoy,0,-6.40168,-4.91,-0.78,-6.487978834675552
CN(C)S(=O)(=O)NC1CCC2(CC1)OCCO2,C48671122_decoy,CASP3,Decoy,0,-6.45031,-5.54,-0.25,-4.517404856229555
O=C(NC[C@@H]1CCS(=O)(=O)C1)c1csnn1,C48696399_decoy,CASP3,Decoy,0,-7.92291,-6.07,0.23,-9.145473132604208
O=C1CN(C(=O)C(=O)N2CCc3ccccc32)CCN1,C48723753_decoy,CASP3,Decoy,0,-6.19199,-5.47,0.02,-5.816630613831651
O=C(NC1CC1)C1CCN(C(=O)c2cnsn2)CC1,C48749086_decoy,CASP3,Decoy,0,-8.44261,-5.51,-0.39,-8.790014015607259
CCOC1CCN(C(=O)Nc2nncs2)CC1,C48768457_decoy,CASP3,Decoy,0,-6.54069,-6.67,-0.94,-10.889105416678774
CCOC1CCN(C(=O)Nc2nnc(C)s2)CC1,C48770190_decoy,CASP3,Decoy,0,-6.17342,-4.31,-0.1,-4.371988713625035
O=C(Nc1nnc(C(F)F)s1)c1cnns1,C49043404_decoy,CASP3,Decoy,0,-7.50919,-5.23,-0.56,-4.912083809180617
C[C@@]1(NC(=O)c2csnn2)CCS(=O)(=O)C1,C49221343_decoy,CASP3,Decoy,0,-7.69734,-5.96,-0.7,-9.625720767655467
COC(=O)NCC(=O)N1CCO[C@H]2CCCC[C@H]21,C49342069_decoy,CASP3,Decoy,0,-6.29823,-6.36,-0.37,-6.6744512991017295
Cc1noc(C)c1[C@H]1SCC(=O)Nc2c1cnn2C,C49547852_decoy,CASP3,Decoy,0,-5.98789,-5.31,-0.81,-4.353799247946849
CNc1snnc1CN1C(=O)CCCCC1=O,C50829480_decoy,CASP3,Decoy,0,-6.82126,-4.24,-0.46,-5.150621241374429
N#Cc1nccnc1NC[C@H]1CCS(=O)(=O)C1,C54377638_decoy,CASP3,Decoy,0,-7.03369,-5.01,-0.54,-5.257186676393249
Cc1nnc(OC2CC[NH+](C)CC2)c(C(=O)[O-])c1C,C54553670_decoy,CASP3,Decoy,0,-5.49521,-5.2,-0.7,-4.421626650318188
O=S1(=O)C[C@H](Sc2nnc3ccccn23)[C@@H](O)C1,C58443083_decoy,CASP3,Decoy,0,-7.6594,-4.97,-0.66,-5.466112364599978
O=S1(=O)C[C@@H](O)[C@@H](Sc2nnc3ccccn23)C1,C58443092_decoy,CASP3,Decoy,0,-7.35897,-4.84,0.12,-4.463001595935571
C[C@@H](C(=O)N1CCOCC1)[NH+]1CCC(C(=O)[O-])CC1,C35083817_decoy,CASP3,Decoy,0,-6.54429,-4.91,-0.04,-5.529028192643313
C[C@H](C(=O)N1CCOCC1)[NH+]1CCC(C(=O)[O-])CC1,C35083818_decoy,CASP3,Decoy,0,-5.84555,-5.02,-1.23,-6.458838976670088
O=S1(=O)CC[C@H](NCc2nnc3ccccn23)C1,C37395676_decoy,CASP3,Decoy,0,-7.34952,-7.1,-0.26,-5.464067533114565
CC(C)N1C(=O)C[C@@H]([NH+]2CCC(C)(C(=O)[O-])CC2)C1=O,C62844103_decoy,CASP3,Decoy,0,-6.52839,-6.43,-1.3,-5.837329303615311
C[NH+]1CCN(C(=O)N2CC[C@@](C)(C(=O)[O-])C2)CC1,C62922384_decoy,CASP3,Decoy,0,-4.93691,-4.5,-0.09,-4.656892517622094
CC1=C2[C@H](N=N1)NC(=O)CS[C@@H]2c1cn(C)nc1C,C63796224_decoy,CASP3,Decoy,0,-6.68753,-4.42,-0.79,-3.647143791111831
CCS(=O)(=O)N1CCCN(C(=O)NC)CC1,C64554081_decoy,CASP3,Decoy,0,-5.15961,-5.0,-1.78,-3.7985410535261592
CC1=CC(C)=NC(=O)[C@H]1CNC(=O)C1=COCCO1,C64723132_decoy,CASP3,Decoy,0,-6.69524,-6.14,0.0,-5.29776859315817
Cc1nn2c(S(=O)(=O)NC3CC3)c(C)nc2s1,C65183618_decoy,CASP3,Decoy,0,-7.9335,-5.06,-0.36,-5.717947382760594
CC(C)(C)c1csc(NC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)n1,C09154748_decoy,CASP3,Decoy,0,-9.05647,-6.42,-1.4,-7.010230049484667
COC(CNC(=O)c1ccc(N2C(=O)CCS2(=O)=O)cc1Cl)OC,C12023235_decoy,CASP3,Decoy,0,-6.44667,-7.02,-0.75,-5.984805241164668
C[C@H](CNC(=O)c1ccc(-n2cccn2)c(C#Cc2cccnc2)c1)n1cncn1,C12132155_decoy,CASP3,Decoy,0,-7.02641,-6.66,-1.57,-7.235728871723926
COc1cc(OC)c2cc(C(=O)NCCN3C(=O)CSC3=O)n(C)c2c1,C19289687_decoy,CASP3,Decoy,0,-8.7962,-5.03,-1.08,-5.498422978236023
CCCNC(=O)[C@H]1CCCN(S(=O)(=O)N2CCC3(CC2)OCCO3)C1,C20511260_decoy,CASP3,Decoy,0,-7.97021,-5.62,-1.42,-6.140850643870011
CN(C(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O)[C@@H]1CCCC[C@@H]1O,C22372554_decoy,CASP3,Decoy,0,-7.49433,-5.58,-3.41,-5.785314017026104
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1cccc(-n2cnnn2)c1,C26902046_decoy,CASP3,Decoy,0,-6.05277,-8.19,-0.91,-7.080251767614049
Cc1noc(C)c1S(=O)(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C)CC1,C36107102_decoy,CASP3,Decoy,0,-6.88742,-6.05,-2.95,-5.809024267682933
Cc1nnc(NC(=O)CSc2cc(N3C[C@H](C)O[C@@H](C)C3)ncn2)s1,C38924935_decoy,CASP3,Decoy,0,-8.28716,-6.34,-1.02,-6.355159628254213
CCOC1=C[C@@H]2C[C@H]3CO[P@](=O)(S(=O)(=O)C(C)C)NN3C[C@@H]2C=C1OC,C39469986_decoy,CASP3,Decoy,0,-6.07045,-5.27,-1.49,-4.797239471528663
CN1CC=N[C@@H]1C(=O)N1CCC[C@@H]1c1ccc(C(=O)N[C@@H]2C=CN=N2)s1,C39531629_decoy,CASP3,Decoy,0,-8.33601,-5.91,-0.76,-6.48250966701178
CCN1C(=O)[C@H]2[C@H](N=C(SCc3cc(=O)[nH]c4ccccc34)N2C)N(C)C1=O,C40011102_decoy,CASP3,Decoy,0,-6.78307,-7.62,-1.53,-5.745114480032084
CC[C@H](C)c1nc(Cn2nc(C)c(S(=O)(=O)N(C)C)c2C)cc(=O)[nH]1,C41368160_decoy,CASP3,Decoy,0,-5.39935,-6.9,-4.09,-4.436662398451002
CC(=O)Nc1nc(COC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)cs1,C45540423_decoy,CASP3,Decoy,0,-8.1171,-8.05,-2.97,-6.975238256831016
Cc1nc2c(cnn2C(C)C)cc1C(=O)NC1CCN(S(C)(=O)=O)CC1,C46632665_decoy,CASP3,Decoy,0,-8.43934,-6.63,-0.74,-7.085089002067988
CSc1nc2nc(C)c(CC(=O)N[C@H]3CCCc4c3cnn4C)c(C)n2n1,C47490916_decoy,CASP3,Decoy,0,-8.22619,-6.63,-1.34,-7.823237009458467
CC(C)(O)c1cn(C2CCN(C(=O)c3cccc(N4CCOCC4)c3)CC2)nn1,C48170823_decoy,CASP3,Decoy,0,-8.74845,-6.4,-0.05,-5.425127756005722
CNC(=O)CSc1nnc(N2CCN(C(=O)c3ccco3)CC2)s1,C49369167_decoy,CASP3,Decoy,0,-8.24456,-5.48,-5.45,-5.118446285822105
CN(Cc1cnn(C)c1)C(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(F)c2)C1=O,C53631635_decoy,CASP3,Decoy,0,-6.92265,-7.52,-1.74,-8.353069383397555
CC1(C)[C@H]2CC[C@]1(C)C(=O)N(CCC(=O)Nc1nnc([C@@H]3CCCO3)s1)C2=O,C54647877_decoy,CASP3,Decoy,0,-9.67693,-7.66,-3.43,-10.425100318604397
Cc1nc(-c2nnc(NC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)o2)cs1,C56904329_decoy,CASP3,Decoy,0,-7.22425,-6.14,-0.84,-4.963981991270073
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1N1CCN(CC(=O)NC(C)C)CC1,C56938901_decoy,CASP3,Decoy,0,-7.76837,-5.46,-1.25,-5.7784714030377184
CNS(=O)(=O)c1cc(C(=O)N2CCN(c3ncccn3)CC2)cc(C)c1C,C17299249_decoy,CASP3,Decoy,0,-7.47179,-5.54,-0.98,-5.390350079146838
Cc1cc(C(=O)NCc2cccnc2-n2cncn2)c(C)n1-c1cccnc1,C58272747_decoy,CASP3,Decoy,0,-5.95176,-6.06,-1.52,-5.337005348108209
Cc1nc2ccccc2n1CCCNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1,C58398576_decoy,CASP3,Decoy,0,-8.83219,-7.72,-2.21,-7.25885702606525
CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)CSc1nnnn1C1CC1,C60347994_decoy,CASP3,Decoy,0,-7.29315,-5.2,-1.59,-5.1558853679281205
CCOC(=O)c1c(C)[nH]c(C(=O)N2CCN(C(=O)[C@H]3CCCO3)CC2)c1C,C49942060_decoy,CASP3,Decoy,0,-6.09501,-5.18,-1.08,-5.086176817228679
C[C@H](Sc1nc(-c2cccnc2)n[nH]1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1,C60531458_decoy,CASP3,Decoy,0,-7.72387,-5.07,-0.11,-5.272657209057719
CCNC(=O)[C@@H]1CCCN(C(=O)CCc2c(C)nc3c(C#N)cnn3c2C)C1,C61533602_decoy,CASP3,Decoy,0,-7.45616,-7.91,-2.15,-6.612791162937242
CCc1nc(CN(C)C(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cs1,C63231981_decoy,CASP3,Decoy,0,-8.18238,-7.22,-1.13,-6.79747654112486
Cc1nc2ccccc2n1NC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21,C63478072_decoy,CASP3,Decoy,0,-7.1093,-6.61,-1.9,-5.71732815080145
O=C(CS[C@@H]1NN=NN1C1CCCC1)C1=CN=C(C(=O)N2CCCC2)C1,C63731302_decoy,CASP3,Decoy,0,-7.21065,-6.56,-0.06,-6.008914494219092
COC(=O)C1=C(C)C(C(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)=N[C@H]1C,C64050641_decoy,CASP3,Decoy,0,-6.55914,-7.29,-2.07,-5.58371673062226
CC1=CC(C)=NC(=O)[C@H]1CNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1,C64147572_decoy,CASP3,Decoy,0,-7.73932,-7.75,-1.12,-6.384255813592609
CCCN(CC1=NC(=O)[C@@H]2SC=CC2=N1)C(=O)c1ccc2[nH]nnc2c1,C64182428_decoy,CASP3,Decoy,0,-8.71692,-6.2,-1.49,-7.043396960121668
c1ccc(C2=NCN(Cc3cccnc3-n3cncn3)[C@H]2c2ncc[nH]2)cc1,C65370894_decoy,CASP3,Decoy,0,-8.0524,-6.07,-0.35,-6.125750948595812
COCc1cc([C@H]2N[C@@](C)(C(=O)OC)[C@H]3C(=O)N(C)C(=O)[C@@H]23)ccc1OC,C65398519_decoy,CASP3,Decoy,0,-6.36648,-5.53,-1.58,-5.558157397789214
O=C(NCc1ccccn1)c1cc2n(n1)CCN(C(=O)c1cccc3c1OCC3)C2,C65398960_decoy,CASP3,Decoy,0,-7.48057,-6.51,-0.76,-5.854279749055781
COC(=O)[C@]1(C)N[C@H](c2cc(F)ccc2-n2cccn2)[C@@H]2C(=O)N(C)C(=O)[C@@H]21,C65399145_decoy,CASP3,Decoy,0,-6.8626,-6.37,-2.42,-6.078419960515415
C=CCO[C@@H](C)C(=O)N1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1,C66026964_decoy,CASP3,Decoy,0,-6.02218,-7.14,-1.41,-5.615822125134989
Cc1cccc(N(C)C(=O)C(=O)NCCCn2nc3n(c2=O)CCCC3)c1,C66217925_decoy,CASP3,Decoy,0,-6.44822,-7.23,-1.7,-6.061216423370801
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CCn2c(C)csc2=O)n1,C66379737_decoy,CASP3,Decoy,0,-6.50145,-5.85,-1.82,-5.9200737123844265
Cc1cc(C)n2nc(CC(=O)Nc3cc(F)c(S(C)(=O)=O)c(F)c3)nc2n1,C66552338_decoy,CASP3,Decoy,0,-7.11431,-8.28,-0.94,-6.041544787194855
Cc1nc(S(=O)(=O)NCC(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)cn1C,C66709720_decoy,CASP3,Decoy,0,-6.07474,-7.56,-2.01,-6.992023518240692
Cc1ccc(S(=O)(=O)N(C(=O)Cn2cncn2)c2ccc(O)cc2)s1,C66870292_decoy,CASP3,Decoy,0,-7.03641,-5.15,-2.17,-5.459299292146963
C[C@@H](C1CC1)N(C)S(=O)(=O)N1CCC(C(=O)Nc2nncs2)CC1,C66912097_decoy,CASP3,Decoy,0,-9.08755,-6.76,-2.67,-8.946102779613739
Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)Oc1cccc(C(=O)N(C)C)c1,C67019665_decoy,CASP3,Decoy,0,-8.14152,-7.52,-0.97,-8.412489751177693
Cc1c(C(=O)N[C@H](C)c2nccs2)nnn1-c1ccc2c(c1)OCCO2,C67170504_decoy,CASP3,Decoy,0,-8.364,-5.54,-2.13,-5.766851461214482
CC(C)n1cc(C(=O)N2CCC[C@@H](c3n[nH]c(=O)n3-c3ccccc3)C2)cn1,C67562758_decoy,CASP3,Decoy,0,-6.64915,-6.04,-0.3,-5.427424478652263
O=C(Cc1csc(-c2cnccn2)n1)NS(=O)(=O)N1CCCCC1,C67628738_decoy,CASP3,Decoy,0,-8.13332,-6.15,-2.04,-6.475460626242848
COc1cc(/C=N/NC(=O)Cn2c(-c3nonc3N)nc3ccccc32)ccc1OCC(=O)[O-],C04044893_decoy,CASP3,Decoy,0,-10.0304,-8.58,-1.39,-10.12934860089801
CC(C)(CC(=O)[O-])CC(=O)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2n1nnnc1Oc1cccc(N2CCOCC2)c1,C04147915_decoy,CASP3,Decoy,0,-6.36659,-8.59,-1.17,-6.607735743693962
CC[C@@H](C)[C@H](NC(=O)CNC(=O)Cc1c(C)c2cc3c(C(C)(C)C)coc3cc2oc1=O)C(=O)[O-],C02122700_decoy,CASP3,Decoy,0,-6.23428,-7.67,-2.56,-7.8761982094319025
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Nc2cccc(-n3cnnc3SC)c2)c1OC,C12521415_decoy,CASP3,Decoy,0,-8.7084,-7.17,-1.76,-7.883185870041676
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Nc2ccc(Sc3nncn3C)cc2)c1OC,C12650080_decoy,CASP3,Decoy,0,-9.13317,-7.76,-2.8,-8.148657537509672
C[C@H](NC(=O)c1ccc(N(C)CCOc2ccc(Br)cc2)c([N+](=O)[O-])c1)C(=O)[O-],C13036913_decoy,CASP3,Decoy,0,-8.40716,-7.64,-1.77,-10.44872586725596
CCCN(C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)[C@@H]1CCS(=O)(=O)C1,C13045928_decoy,CASP3,Decoy,0,-9.14528,-5.26,-1.84,-6.773886254428862
CCCNC(=O)[C@@H]1CN(S(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)c2ccccc2O1,C13077010_decoy,CASP3,Decoy,0,-8.06272,-7.38,-1.38,-7.373526304523796
CCOc1ccc(-c2nnc(SCC(=O)N[C@@]3(C)CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13195942_decoy,CASP3,Decoy,0,-8.71652,-6.23,-0.89,-5.8237130780843005
COC(=O)c1c(NC(=O)CSc2nnc(-c3cccs3)n2CC(=O)[O-])sc2c1CCC2,C13203221_decoy,CASP3,Decoy,0,-9.57778,-6.88,-1.29,-8.791286990353171
CCOC(=O)N1CCC(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2CC(=O)[O-])CC1,C13220166_decoy,CASP3,Decoy,0,-7.63356,-7.1,-2.43,-5.694153206941666
Cc1cccc(C)c1NC(=O)CN(C)C(=O)CSc1nnc(-c2cccs2)n1CC(=O)[O-],C13220209_decoy,CASP3,Decoy,0,-8.22368,-7.47,-2.3,-7.366078543159888
CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)Sc1nc2nc(C)c(CC(=O)[O-])c(C)n2n1,C13222078_decoy,CASP3,Decoy,0,-9.99556,-6.7,-3.52,-8.245350506506911
O=C([O-])C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NCc2ccc(Cn3cccn3)cc2)CC1,C13240858_decoy,CASP3,Decoy,0,-8.56091,-8.61,-1.5,-11.393897737625784
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CC(=O)[O-])C3=O)c(NCCCOC(C)C)nc12,C13713512_decoy,CASP3,Decoy,0,-7.66757,-6.21,-2.36,-7.229945079667526
COc1cc(/C=C2/SC(=S)N(Nc3ccc([N+](=O)[O-])cc3)C2=O)ccc1OCCC(=O)[O-],C16912011_decoy,CASP3,Decoy,0,-7.91789,-6.84,-3.07,-8.543660250367525
CCOc1cc(/C=C2/SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)ccc1OCC(=O)[O-],C16915863_decoy,CASP3,Decoy,0,-8.24423,-6.34,-0.59,-6.513196175361989
CCOc1cc(/C=C2/SC(=S)N(NS(=O)(=O)c3ccc(C)cc3)C2=O)ccc1OCC(=O)[O-],C16915868_decoy,CASP3,Decoy,0,-8.06257,-6.32,-1.39,-6.653939576171863
CCOc1cc(/C=C2/SC(=S)N(NC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)ccc1O[C@@H](C)C(=O)[O-],C16917070_decoy,CASP3,Decoy,0,-6.46711,-5.72,-1.5,-6.693047947371756
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2ccc(C)o2)c1C,C20193264_decoy,CASP3,Decoy,0,-8.72695,-5.84,-2.94,-6.617983712748213
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccccc2)c1C,C09235824_decoy,CASP3,Decoy,0,-8.40794,-7.58,-2.52,-7.608780248963512
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2ccc(C)cc2)c1C,C09353815_decoy,CASP3,Decoy,0,-8.01139,-7.61,-1.73,-10.88254548629707
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1,C09464987_decoy,CASP3,Decoy,0,-8.85425,-7.58,-1.21,-8.24555114613634
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc([N+](=O)[O-])cc2)c1C,C09046252_decoy,CASP3,Decoy,0,-8.975,-7.05,-1.47,-7.36454972682236
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1,C09458743_decoy,CASP3,Decoy,0,-8.4706,-7.6,-1.83,-8.10055790103697
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1,C20582971_decoy,CASP3,Decoy,0,-6.8487,-6.39,-1.31,-5.726978827591293
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)[C@@H]2SC1,C20602386_decoy,CASP3,Decoy,0,-6.57077,-6.97,-2.01,-10.228365944698606
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)[C@H]2SC1,C20602387_decoy,CASP3,Decoy,0,-7.01601,-7.12,-1.59,-6.3619115915115465
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)CCn3nc(C(F)(F)F)c(Cl)c3C)[C@H]2SC1,C22835185_decoy,CASP3,Decoy,0,-8.19344,-7.82,-1.27,-6.540863045628505
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2ccc(C)o2)c1C,C09210203_decoy,CASP3,Decoy,0,-8.14375,-5.29,-2.65,-5.941788787808966
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(Cc3cccnc3)[C@@H]2c2ccccc2OC)c1C,C09292880_decoy,CASP3,Decoy,0,-7.46356,-7.05,-1.01,-7.503386621124241
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(Cc3cccnc3)[C@H]2c2ccccc2OC)c1C,C09292881_decoy,CASP3,Decoy,0,-8.15674,-7.21,-2.3,-7.581281426466316
CCOc1ccc([C@@H]2CC(c3ccc(C)cc3)=NN2C2=NC(=O)[C@@H](CC(=O)NCC(=O)[O-])S2)cc1,C28155809_decoy,CASP3,Decoy,0,-9.30356,-7.15,-2.41,-7.248074149035242
CC(=O)N[C@@H]1[C@@H](Oc2ccccc2/C=C/C(=O)c2ccccc2)O[C@@H]2COC(C)(C)O[C@@H]2[C@H]1OCC(=O)[O-],C35057605_decoy,CASP3,Decoy,0,-6.65243,-7.7,-2.62,-7.043342811578529
COc1cccc(N2CC[NH+]([C@@H](C(=O)[O-])c3cn(CCC(=O)[O-])c4ccc(OC)cc34)CC2)c1,C36367198_decoy,CASP3,Decoy,0,-8.17927,-7.19,-4.51,-6.844008454724082
CO[C@@]1(NC(=O)CSCC#N)C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]21,C03830418_decoy,CASP3,Decoy,0,-9.0324,-5.26,-2.97,-6.30463355167751
CCOC(=O)[C@@H]1c2cc(OCC(=O)N/N=C/C3=C4C=CC=C(C(=O)[O-])[C@@H]4N=C3)ccc2N(C)[C@@H]1C,C38625953_decoy,CASP3,Decoy,0,-9.50121,-6.84,,99.0
COc1ccc(C2=NN(C3=NC(=O)[C@@H](CC(=O)N[C@@H](C)C(=O)[O-])S3)[C@@H](c3ccc(C(C)C)cc3)C2)cc1,C28158567_decoy,CASP3,Decoy,0,-9.63648,-7.36,-2.26,-7.683190893790481
COCCCn1c(SCc2nc3c(c(=O)[nH]2)[C@H](C(=O)[O-])[C@@H](C)O3)nnc1-c1ccccc1Cl,C39680148_decoy,CASP3,Decoy,0,-8.48575,-7.25,-4.81,-6.7921477221090765
COCCCn1c(SCc2nc3c(c(=O)[nH]2)[C@H](C(=O)[O-])[C@H](C)O3)nnc1-c1ccc(Cl)cc1,C39680175_decoy,CASP3,Decoy,0,-8.3688,-5.44,-3.45,-6.303580636402035
CN(C)[C@H](CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1)c1cccs1,C13211511_decoy,CASP3,Decoy,0,-9.5707,-7.39,-2.07,-7.797698144382265
CCOC(=O)C1=C(c2ccc(OC)cc2)CS[C@@H]1NC(=O)CSc1nnc(C)c([O-])n1,C40034111_decoy,CASP3,Decoy,0,-7.70888,-5.98,-3.08,-5.713022623815977
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1,C40076942_decoy,CASP3,Decoy,0,-7.03871,-6.71,-3.42,-5.790830797869085
CCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCO)cc1OCC,C40096608_decoy,CASP3,Decoy,0,-8.50376,-6.43,-1.73,-7.387199097009682
COc1cc([C@@H]2C(C(=O)c3c(C)[nH]c(C)c3C)=C([O-])C(=O)N2CCN2CCOCC2)cc(OC)c1OC,C41534979_decoy,CASP3,Decoy,0,-8.69634,-6.61,-3.21,-7.385935913006532
C#CCN1C(=O)[C@H]2[C@@H](c3ccc(OCCC)cc3)N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C43218334_decoy,CASP3,Decoy,0,-7.47967,-6.46,-2.05,-6.247114474914891
O=C([O-])CCn1c(SCC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)nnc1-c1ccc(F)cc1,C13237573_decoy,CASP3,Decoy,0,-7.88663,-7.06,-1.53,-7.019766876636949
CCc1cc2c(=O)n(CCCOC)c(SCc3nc4oc(C)c(C(=O)[O-])c4c(=O)[nH]3)nc2s1,C13438580_decoy,CASP3,Decoy,0,-8.83177,-5.8,-0.91,-7.322782269253413
O=C(/C(=C(\[O-])N(CCO)Cc1ccccc1)n1cc(Cl)ccc1=O)c1cccc([N+](=O)[O-])c1,C57532298_decoy,CASP3,Decoy,0,-7.25368,-7.11,-2.82,-6.875646296341445
CCOc1cc(/C=N/N=C2\NC(=O)[C@@H](CC(=O)[O-])S2)ccc1OS(=O)(=O)c1ccc(C)cc1,C16115060_decoy,CASP3,Decoy,0,-9.30319,-6.51,-2.04,-6.588892113708684
CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2C(=O)N3C(C(=O)[O-])=C(CSc4nnnn4C)CS[C@@H]23)c2ccc(O)cc2)C(=O)C1=O,C03977813_decoy,CASP3,Decoy,0,-6.3688,-7.92,-2.98,-7.277729130899239
Cc1cc([N+](=O)[O-])nn1[C@H](C)C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]12,C09431476_decoy,CASP3,Decoy,0,-8.32708,-7.43,-3.06,-6.642811423418654
CCOc1cc(/C=N/NC(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc([N+](=O)[O-])c1[O-],C09905873_decoy,CASP3,Decoy,0,-6.95746,-5.88,-1.45,-6.128663318122651
CO/N=C(\C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cnns3)CS[C@@H]12)c1csc(N)n1,C11616470_decoy,CASP3,Decoy,0,-11.7922,-5.56,-1.05,-7.962508436508755
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1Cc1ccco1)Nc1cc([N+](=O)[O-])ccc1F,C13050717_decoy,CASP3,Decoy,0,-8.22711,-7.41,-3.9,-6.766641904820766
Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1Cc1ccco1,C13050738_decoy,CASP3,Decoy,0,-6.97839,-6.4,-1.41,-5.542562130519338
Cc1c(NC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C[C@H]2CCCO2)cccc1[N+](=O)[O-],C13052961_decoy,CASP3,Decoy,0,-6.66219,-8.1,-1.33,-6.975284135306207
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nnnn1-c1c(C)n(C)n(-c2ccccc2)c1=O,C13248120_decoy,CASP3,Decoy,0,-6.52294,-8.25,-2.88,-5.940886688005859
CCn1c(SCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)nc2cc(C(=O)[O-])ccc2c1=O,C13444760_decoy,CASP3,Decoy,0,-7.38264,-6.72,-2.74,-7.337312863669986
CCOc1c([C@H]2C=C(c3ccc(O[C@H](C)C(=O)[O-])cc3)Nc3nnnn32)c(C)nn1CC(C)C,C13462219_decoy,CASP3,Decoy,0,-8.68465,-6.73,-1.46,-6.97066967055401
COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)/C(=C\c2ccc3c(c2)OCO3)NC(=O)c2ccccc2)c1[O-],C15938516_decoy,CASP3,Decoy,0,-8.78647,-7.64,-3.45,-5.557432889485487
COc1ccc([C@H]2CC(=O)C3=C(C2)Nc2nc(N)nn2[C@H]3c2ccc(OCC(=O)[O-])cc2)cc1OC,C18199051_decoy,CASP3,Decoy,0,-8.27106,-5.7,-1.72,-5.83840463151182
COC(=O)[C@]1(Nc2ccc([N+](=O)[O-])cc2)C(C(=O)c2ccccc2)=C([O-])C(=O)N1c1ccc(OC)cc1,C09310183_decoy,CASP3,Decoy,0,-7.24063,-6.14,-2.79,-6.42773940792017
N#Cc1c(NC(=O)CSc2nnc(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2N)sc2c1CCCC2,C20527420_decoy,CASP3,Decoy,0,-7.89086,-7.21,-3.02,-8.72277797644989
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,C20559623_decoy,CASP3,Decoy,0,-9.24492,-7.51,-1.24,-6.303722554686784
O=[N+]([O-])c1ccc([O-])c(/C=N/Nc2nc(SCc3nnc(-c4ccc(Cl)cc4)o3)n[nH]2)c1,C20832572_decoy,CASP3,Decoy,0,-6.76205,-7.42,-3.06,-6.286331613057846
CCCc1nn(C)c2c(=O)nc(-c3cc(S(=O)(=O)[N-]c4ccccc4[N+](=O)[O-])ccc3OCC)[nH]c12,C09144986_decoy,CASP3,Decoy,0,-6.43855,-6.89,-2.31,-6.083312425950906
CC(C)Cc1nnc(NC(=O)CSc2nc(-c3ccc4c(c3)OCO4)nc3cc([O-])nn23)s1,C20987061_decoy,CASP3,Decoy,0,-8.56354,-7.16,-2.06,-6.957698697718149
O=C(CCSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2[O-])n1)Nc1cccc(Br)c1,C21075532_decoy,CASP3,Decoy,0,-8.6378,-7.69,-1.75,-6.760881733913898
CCOc1cc([C@H]2CC(=O)NC3=C2C(=O)C[C@@H](c2cc(OC)c(OC)c(OC)c2)C3)cc([N+](=O)[O-])c1[O-],C21260063_decoy,CASP3,Decoy,0,-7.60185,-6.69,-1.14,-7.860779340653163
CC(=O)Nc1cccc(NC(=O)CSc2nnc(N/N=C/c3cc(Cl)cc(Cl)c3[O-])n2N)c1,C21318492_decoy,CASP3,Decoy,0,-9.10657,-8.35,-3.81,-6.998420768520897
Nn1c(N/N=C/c2cc(Cl)cc(Cl)c2[O-])nnc1SCC(=O)Nc1cccc([N+](=O)[O-])c1,C21318701_decoy,CASP3,Decoy,0,-8.7684,-6.49,-3.23,-6.440379175824484
COc1cc(/C=N/Nc2nnc(SCC(=O)Nc3nc4ccccc4s3)n2N)cc([N+](=O)[O-])c1[O-],C21326953_decoy,CASP3,Decoy,0,-7.74117,-7.17,-2.42,-6.192103320773453
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)c3cnn4c(C(F)F)cc(C5CC5)nc34)[C@H]2SC1,C22831410_decoy,CASP3,Decoy,0,-8.88388,-6.48,-1.06,-6.293840537715655
COc1ccc2nc(NC(=O)C(=O)c3c(C)nn(-c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])c3[O-])sc2c1,C25573771_decoy,CASP3,Decoy,0,-6.02189,-7.5,-2.38,-6.3069269174312
COC(=O)/C(=C(/NNC(N)=O)C(=O)Nc1c(C)cccc1C(C)(C)C)c1nc2ccc(Cl)cc2nc1[O-],C01630176_decoy,CASP3,Decoy,0,-10.8767,-7.58,-2.95,-9.798483576971382
Cc1noc([N-]S(=O)(=O)c2ccc(N/N=C(/C#N)C(=O)Nc3ccccc3C(=O)[O-])cc2)c1C,C32682152_decoy,CASP3,Decoy,0,-4.97569,-8.92,-1.8,-5.677122545445931
CC1(C)[C@H](N(O)C(=O)NC2CCCCC2)N(C2CCCCC2)C(=O)N1CC(=O)NCC(=O)[O-],C33654376_decoy,CASP3,Decoy,0,-8.16085,-6.89,-1.99,-7.787125127245977
COCc1nn(-c2ccc(Cl)cc2)c([O-])c1/C=C1\NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O,C16534180_decoy,CASP3,Decoy,0,-7.57952,-7.18,-2.85,-5.745757468820703
CC(C)(C)NC(=O)[C@H](c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499777_decoy,CASP3,Decoy,0,-5.98357,-6.73,-3.86,-6.302508524639247
Cc1ccc(CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@@H](C(=O)NC(C)(C)C)c2c(O)cc(O)cc2O)o1,C36596616_decoy,CASP3,Decoy,0,-7.87119,-6.44,-1.75,-7.330354109872876
O=S(=O)(NCC[C@H]1NN[C@@H](S(=O)(=O)Cc2ccc(Cl)cc2)O1)c1ccc2nc([O-])oc2c1,C38794318_decoy,CASP3,Decoy,0,-8.98477,-6.59,-2.81,-6.137306181603823
CCOc1cc([C@H](C2=C(C)N=N[C@@H]2O)c2c(C)n[nH]c2[O-])ccc1OC(=O)c1cccc([N+](=O)[O-])c1,C39012662_decoy,CASP3,Decoy,0,-7.53363,-7.32,-4.65,-6.809052225856515
CCOc1cc([C@@H](C2=C(C)N=N[C@@H]2O)c2c(C)n[nH]c2[O-])ccc1OC(=O)c1cccc([N+](=O)[O-])c1,C39012663_decoy,CASP3,Decoy,0,-7.03357,-6.89,-1.78,-6.645947649186519
Cc1cc(NC(=O)CN2CCN(c3ccc(C(=O)c4ccccc4C(=O)[O-])cc3[N+](=O)[O-])CC2)no1,C13452209_decoy,CASP3,Decoy,0,-8.48203,-7.81,-1.23,-6.920653099338655
C[C@H]1CN(C(C)(C)CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCC(C(=O)[O-])CC2)C[C@H](C)O1,C13465326_decoy,CASP3,Decoy,0,-8.88939,-8.54,-3.25,-7.654991242011192
CCOc1cc([C@H](C2=C(C)N=N[C@@H]2O)c2c(C)n[nH]c2[O-])ccc1OC(=O)c1ccc([N+](=O)[O-])cc1,C39699201_decoy,CASP3,Decoy,0,-6.58317,-6.34,-5.38,-5.8283757010229005
CCOC(=O)C1=C(C)N=c2s/c(=C\c3c([O-])[nH]c(=O)[nH]c3=O)c(=O)n2[C@H]1c1ccc(OCC)cc1,C15018693_decoy,CASP3,Decoy,0,-8.36901,-6.78,-1.37,-5.010232072687948
Cn1c(=O)c2c(ncn2CCCC(=O)Nc2nc(SCc3ccc(Cl)cc3)n[n-]2)n(C)c1=O,C09915578_decoy,CASP3,Decoy,0,-7.04913,-6.83,-2.21,-6.255356151259372
C#CCN1C(=O)[C@H]2[C@@H](c3ccc(C(=O)OC)cc3)N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C43218330_decoy,CASP3,Decoy,0,-7.20714,-5.07,-3.24,-5.446987285508329
Cc1ccc(S(=O)(=O)N/N=C(/c2nc3ccc([N+](=O)[O-])cc3nc2[O-])[C@@H](O)c2ccccc2)cc1,C05315847_decoy,CASP3,Decoy,0,-7.44813,-7.83,-1.89,-6.079372237865634
NS(=O)(=O)c1cccc(Nc2nc3ccccc3nc2[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1,C06142079_decoy,CASP3,Decoy,0,-8.61988,-9.44,-2.04,-8.260220236081542
CCN(CC)c1ccc(/C=N/Nc2nc(Sc3nc4c([O-])n(C)c(=O)n(C)c-4n3)n[nH]2)cc1,C21076238_decoy,CASP3,Decoy,0,-7.55739,-5.52,-1.69,-5.901540365106098
CC/C(C)=N/Oc1nc(N/C([O-])=N/S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])nc(N(C)C)n1,C59366556_decoy,CASP3,Decoy,0,-7.63799,-6.1,-1.09,-6.113764251516326
CSc1nnc(C(C)(C)C)n(N/C([O-])=N/S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)c1=O,C59366596_decoy,CASP3,Decoy,0,-9.64297,-5.95,-1.64,-7.372548792124169
CCOc1nc(N/C([O-])=N/S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc(N(C)C)n1,C59366835_decoy,CASP3,Decoy,0,-6.30895,-6.68,-1.45,-6.86916473043135
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)/N=C(\[O-])Nc1cc(F)nc(N2CCCCCC2)n1,C59369804_decoy,CASP3,Decoy,0,-8.73627,-8.04,-0.63,-6.948153514402848
COc1cc(/C=N/Nc2nc(Sc3nc4c([O-])n(C)c(=O)n(C)c-4n3)n[nH]2)cc(OC)c1OC,C20909705_decoy,CASP3,Decoy,0,-6.93576,-8.11,-1.71,-6.294429716118056
COc1ccc(CCN2C(=O)NC([O-])=C3C2=NC(=O)[C@@]3(c2c(C)[nH]n(-c3ccccc3)c2=O)C(F)(F)F)cc1OC,C01837821_decoy,CASP3,Decoy,0,-7.97052,-6.95,-1.95,-6.4897023710423305
O=C([O-])c1ccccc1C(=O)Nc1nnc(Sc2ccc(C(=O)N3CCCC3)cc2[N+](=O)[O-])s1,C59854409_decoy,CASP3,Decoy,0,-4.34702,-6.87,-1.76,-4.026277036074196
COc1ccc(-c2cnc(N3CCc4ccccc4C3)nc2)cc1,C01495231_decoy,CASP3,Decoy,0,-6.29242,-6.57,-1.32,-4.5198385320633125
c1ccc2c(c1)nnn2Cn1c2ccccc2c2ccccc21,C02558998_decoy,CASP3,Decoy,0,-6.69992,-7.06,-2.31,-5.382468166566235
Clc1cccc(Oc2ncnc3c2oc2ccccc23)c1,C03680563_decoy,CASP3,Decoy,0,-6.62367,-5.94,-6.23,-4.915921935132084
Cc1ccc(COn2c(-c3ccccc3)nc3ncccc32)cc1,C01396598_decoy,CASP3,Decoy,0,-5.67881,-6.75,-1.5,-5.908220097096833
Cc1cc2c(s1)[C@H]1CCCC[C@H]1O[C@@H]2c1cccc([N+](=O)[O-])c1,C04745372_decoy,CASP3,Decoy,0,-6.19506,-5.75,-2.78,-4.88395272309767
O=[N+]([O-])c1ccccc1[C@H]1O[C@H]2CCCC[C@@H]2c2sccc21,C04786540_decoy,CASP3,Decoy,0,-4.99687,-6.31,-1.71,-4.7575701725636215
C#CC[C@@](C#Cc1ccccc1)(OCC)n1nnc2ccccc21,C05335144_decoy,CASP3,Decoy,0,-6.24185,-5.58,-2.08,-4.858029128697435
O=Cc1ccc(-n2nncc2C23CC4CC(CC(C4)C2)C3)cc1,C05446266_decoy,CASP3,Decoy,0,-6.23679,-5.52,-1.7,-5.295378549526807
O=[N+]([O-])/C(=C\Sc1nc2ccccc2s1)c1ccccc1,C01437158_decoy,CASP3,Decoy,0,-6.56404,-6.89,-1.78,-6.310561253834045
O=[N+]([O-])c1ccccc1/C=N/c1ccc(Br)cc1,C00065951_decoy,CASP3,Decoy,0,-5.17978,-4.93,-1.3,-4.392031802576736
Cc1ccc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)s1,C08321803_decoy,CASP3,Decoy,0,-4.44511,-5.25,-2.42,-4.795241243924504
Cc1ccc(C2=Nn3c(nnc3-c3ccc(C)cc3)SC2)cc1,C09288481_decoy,CASP3,Decoy,0,-5.61713,-5.71,-0.86,-4.469333501035092
CCN(/N=C/c1ccc(C)cc1)c1cc(C)c(C#N)c(Cl)n1,C12411814_decoy,CASP3,Decoy,0,-7.35571,-5.45,-2.72,-5.299253336216777
COc1cc(OC)cc(Oc2ccnc3cc(Cl)ccc23)c1,C12553477_decoy,CASP3,Decoy,0,-5.96041,-5.93,-4.99,-4.832419030283875
COc1cc2c(cc1/C=C(/C#N)c1ccc(Cl)cc1)OCO2,C15013692_decoy,CASP3,Decoy,0,-6.87982,-5.32,-0.45,-5.281101100490962
CCc1c(C)c(C#N)c2nc3ccccc3n2c1N(CC)CC,C01472959_decoy,CASP3,Decoy,0,-6.54576,-6.08,-0.68,-6.016412625821043
N#C/C(=C\[C@H]1CCCC[C@H]1Cl)C1CCC([N+](=O)[O-])CC1,C17023160_decoy,CASP3,Decoy,0,-7.13359,-5.58,-0.38,-5.202858064044173
C(=C\c1csnn1)\c1ccc(/C=C/c2csnn2)cc1,C17176664_decoy,CASP3,Decoy,0,-8.31589,-6.04,-0.78,-7.822888638085592
CC(C)Cc1nc(N2CCCCC2)c(C#N)c2c1COC(C)(C)C2,C20791735_decoy,CASP3,Decoy,0,-7.88945,-6.13,-1.95,-6.2486061583974015
C[C@@H](Cl)c1c(-c2ccc3c(c2)OCO3)nc2ccccn12,C31915090_decoy,CASP3,Decoy,0,-7.12861,-6.15,-2.27,-5.594706199665301
CCOc1ccc(-c2nc3ccc(C)cn3c2[C@@H](C)C#N)cc1,C31915817_decoy,CASP3,Decoy,0,-6.01384,-6.35,-1.56,-4.778501872152372
c1ccc(-c2nnc3n2N=C(C2CCCCC2)CS3)cc1,C32604265_decoy,CASP3,Decoy,0,-8.06691,-5.85,-0.29,-5.57139167111253
Cc1ccc(C)c(CSC2=NN3CCCC(=O)N=C3S2)c1,C00425831_decoy,CASP3,Decoy,0,-7.83693,-5.84,-0.7,-6.267071331608471
COc1ccc(Oc2nc(SC)nc3ccsc23)cc1,C01398457_decoy,CASP3,Decoy,0,-7.71062,-4.89,-1.62,-5.152047977876011
CSc1ncc(C(=O)Oc2cc(C)cc(C)c2)c(Cl)n1,C39881169_decoy,CASP3,Decoy,0,-7.42559,-5.38,-1.51,-6.028499326596847
O=[N+]([O-])c1cc(Br)cnc1Sc1ccccc1,C42389168_decoy,CASP3,Decoy,0,-5.54378,-5.48,-0.37,-6.614165947205581
O=[N+]([O-])c1cc(Cl)cc(Br)c1N1CCCCC1,C45886170_decoy,CASP3,Decoy,0,-5.12484,-4.37,-0.85,-3.3113032810164165
Cc1cc([N+](=O)[O-])cc(Br)c1N1CCCCC1,C45886340_decoy,CASP3,Decoy,0,-5.14991,-5.48,-0.15,-4.292244836951952
C[C@H]1CCCCN1c1c(Cl)cc(Br)cc1[N+](=O)[O-],C45958980_decoy,CASP3,Decoy,0,-6.77905,-5.44,-1.21,-5.27049848718549
COc1ccc(C(C)(C)C)cc1-c1ccc(C#N)c(N(C)C)n1,C49921093_decoy,CASP3,Decoy,0,-6.2575,-6.15,-2.09,-5.597012618466178
CC/C(=C\c1cc(Br)c(Br)o1)[N+](=O)[O-],C50359283_decoy,CASP3,Decoy,0,-5.97025,-4.23,-0.54,-4.20066808311706
Cc1cc(C)nc(Sc2nnc(Cl)c3ccccc23)n1,C51607610_decoy,CASP3,Decoy,0,-7.84182,-5.62,-1.97,-4.8681488335131
Cc1cccc(CSc2nnnn2-c2c(C)cccc2C)c1,C05169489_decoy,CASP3,Decoy,0,-5.77731,-6.39,-1.31,-5.8475101976234924
Cc1cccc(CSc2nnnn2-c2ccc(C)c(C)c2)c1,C05171432_decoy,CASP3,Decoy,0,-5.44423,-6.44,-2.46,-6.052234632111076
Clc1ccccc1N1CCN(Cc2nc3ccccc3o2)CC1,C55531035_decoy,CASP3,Decoy,0,-6.58678,-6.85,-1.35,-4.96480545892059
CC[C@H](C)c1ccc(C2=Nn3c(nnc3C(C)C)SC2)cc1,C07238897_decoy,CASP3,Decoy,0,-8.07292,-5.68,-1.88,-6.307622571241152
CC(C)c1noc([C@@H](C)Sc2nc3ccccc3s2)n1,C58656411_decoy,CASP3,Decoy,0,-6.81666,-5.67,-0.54,-4.53866530512415
CC(=O)c1nn(-c2ccccc2)/c(=N\c2ccccc2C)s1,C06217928_decoy,CASP3,Decoy,0,-7.66167,-5.87,-0.7,-6.018268800264821
CCOc1nc(Cl)nc(Sc2ccc(Cl)cc2)n1,C61517536_decoy,CASP3,Decoy,0,-8.60079,-4.56,-0.83,-5.908568497137104
CN(C)c1nc(Cl)nc(Sc2ccc(F)c(F)c2)n1,C61543288_decoy,CASP3,Decoy,0,-7.79139,-4.64,-0.66,-4.855354407836888
Cc1ccc(Sc2nc(Cl)nc(N3CCCC3)n2)cc1,C61543588_decoy,CASP3,Decoy,0,-7.57752,-4.96,-0.42,-6.219312921447714
C[C@@H](c1ccccc1F)N(C)c1nc(Cl)nc(Cl)n1,C62028798_decoy,CASP3,Decoy,0,-7.22335,-6.02,-0.97,-5.595097973207713
CCc1ccccc1-n1nnc(C=O)c1-c1ccc(F)c(F)c1,C62217969_decoy,CASP3,Decoy,0,-7.37116,-5.58,-0.63,-5.78870051203899
Cc1ccc(-c2c(C=O)nnn2-c2cccc(F)c2)cc1C,C62239644_decoy,CASP3,Decoy,0,-6.2058,-6.26,-0.01,-6.172317256249862
Cc1ccc(Cn2nnc(C#N)c2-c2ccc(C)c(C)c2)cc1,C62283702_decoy,CASP3,Decoy,0,-7.59495,-8.16,-1.06,-7.576671689529902
N#Cc1nnn(Cc2ccc(Cl)cc2)c1Cc1ccccc1,C62284250_decoy,CASP3,Decoy,0,-7.45993,-6.18,-1.51,-7.343619580906104
CC(C)(C)c1nc2sc(-c3ccccc3F)nn2c1C#N,C62395378_decoy,CASP3,Decoy,0,-7.05063,-5.16,-4.66,-4.196898022615047
CC(C)(C)c1nc2sc(Cc3ccccc3)nn2c1C#N,C62395386_decoy,CASP3,Decoy,0,-7.22555,-7.2,-4.09,-4.974265899288402
O=[N+]([O-])c1ccccc1Oc1c(F)cc(CCl)cc1F,C62723071_decoy,CASP3,Decoy,0,-4.43435,-5.73,-0.95,-4.820032689069582
CCc1nnsc1C(=O)N1CCCc2c(C)cc(C)cc21,C66476587_decoy,CASP3,Decoy,0,-6.38003,-6.56,-0.52,-5.853608631905334
CCc1cc(C)cc(OCC(=O)N/N=C/c2ccc(OCc3ccc(C(=O)[O-])cc3)c(OC)c2)c1,C03889698_decoy,CASP3,Decoy,0,-8.09798,-7.15,-2.38,-5.994403160701582
CCCOc1ccc([C@@H](C)Nc2cnn(-c3ccc(C(=O)[O-])cc3)c(=O)c2Cl)cc1OCCC,C13037510_decoy,CASP3,Decoy,0,-8.02414,-7.19,-1.46,-8.89993664015312
COCCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@@H]1c1ccccc1OC(F)F,C13268463_decoy,CASP3,Decoy,0,-6.97707,-6.1,-1.6,-6.346358737657738
COCCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@H]1c1ccccc1OC(F)F,C13268464_decoy,CASP3,Decoy,0,-6.95881,-7.17,-3.07,-8.622105648128883
CCOCCCn1c(SCC(=O)Nc2ccc(C(=O)[O-])cc2)nnc1-c1ccc(Cl)cc1,C13355589_decoy,CASP3,Decoy,0,-7.65172,-5.71,-0.94,-7.646791016661994
CCCCCCn1c(SCC(=O)Nc2cc(C(=O)[O-])ccc2C(=O)[O-])nc2ccccc2c1=O,C13413155_decoy,CASP3,Decoy,0,-6.5299,-6.94,-1.65,-5.923553063945487
C=CCc1cc(/C=C/c2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)cc(OCC)c1OCc1ccc(Cl)cc1,C09234781_decoy,CASP3,Decoy,0,-7.38307,-7.71,-2.05,-7.3069850536737215
COc1ccc(CC(=O)N(CCCNC(=O)c2nc([O-])c3ccccc3n2)Cc2ccccc2)cc1,C22471896_decoy,CASP3,Decoy,0,-7.62537,-7.04,-2.4,-6.759333690132832
C=CCn1c([S-])nnc1-c1sc(NC(=O)c2ccc(OCCCCCC)c(OC)c2)nc1C,C30671240_decoy,CASP3,Decoy,0,-10.8381,-7.46,-1.95,-12.140766039071112
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCC3OCCO3)N2[C@H]1c1cccc(OC)c1,C34922839_decoy,CASP3,Decoy,0,-8.55083,-7.12,-4.33,-7.77125130585891
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccc(C)cc1,C35696260_decoy,CASP3,Decoy,0,-9.38495,-6.45,-2.23,-6.578845935627851
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1ccc(OC)cc1,C35697038_decoy,CASP3,Decoy,0,-8.71899,-5.49,-1.73,-6.450378209306483
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@@H]1c1ccc(OC)cc1,C35697056_decoy,CASP3,Decoy,0,-9.39765,-6.7,-3.72,-7.628890948868954
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@@H]1c1cccc(OC)c1,C35701799_decoy,CASP3,Decoy,0,-9.67763,-6.68,-3.24,-7.425152720752206
CC[C@@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@@H](c3cc(OC)cc(OC)c3)N12,C35705314_decoy,CASP3,Decoy,0,-7.54692,-5.29,-2.36,-5.849268319525373
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC)[C@@H](c3cccc(Oc4ccccc4)c3)N12,C35705429_decoy,CASP3,Decoy,0,-9.40472,-7.6,-3.43,-8.619435591887935
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@@H]1c1ccc(OC)cc1OC,C36058682_decoy,CASP3,Decoy,0,-7.27473,-6.42,-1.72,-9.964668422012132
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N[C@H](C)CC)N2[C@@H]1c1ccc(OC)cc1OC,C36058691_decoy,CASP3,Decoy,0,-8.59781,-4.78,-1.7,-6.901209215085393
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@H]1c1ccc(OC)cc1OC,C36058697_decoy,CASP3,Decoy,0,-8.74364,-6.58,-1.53,-6.223684596407585
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@@H]1c1ccc(OC)cc1OC,C36058698_decoy,CASP3,Decoy,0,-7.82343,-6.33,-1.77,-6.669547276003681
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@H]1c1cccc(OC)c1OC,C36058709_decoy,CASP3,Decoy,0,-8.58479,-5.23,-2.54,-6.125963840670871
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N[C@H](C)CC)N2[C@@H]1c1cccc(OC)c1OC,C36058721_decoy,CASP3,Decoy,0,-7.53025,-5.83,-1.56,-7.097067041722375
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@@H]1c1cc(OC)ccc1OC,C36058762_decoy,CASP3,Decoy,0,-9.16952,-5.51,-1.72,-7.683451648805758
CCC1=C(C(=O)OC)[C@H](c2ccccc2OC)N2C(/C=C(\[O-])NCCN3CCOCC3)=CSC2=N1,C36063163_decoy,CASP3,Decoy,0,-10.1651,-5.68,-2.99,-7.3749472336167985
CCC1=C(C(=O)OC)[C@H](c2cc(OC)cc(OC)c2)N2C(/C=C(\[O-])NCc3ccc(F)cc3)=CSC2=N1,C36064484_decoy,CASP3,Decoy,0,-8.80502,-6.31,-3.4,-6.818198101535777
COc1cccc([C@H]2C(C(=O)OC(C)(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCC(C)C)N32)c1OC,C36064767_decoy,CASP3,Decoy,0,-9.41991,-6.77,-3.14,-8.130472214669924
COc1cccc([C@@H]2C(C(=O)OC(C)(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCC(C)C)N32)c1OC,C36064768_decoy,CASP3,Decoy,0,-9.93881,-5.83,-3.23,-8.482673547611213
COc1cc(OC)cc([C@@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCC(C)C)N32)c1,C36064839_decoy,CASP3,Decoy,0,-9.18909,-7.5,-3.25,-8.760322038681513
CC[C@@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@@H](c3ccc(OC)c(OC)c3)N12,C36064928_decoy,CASP3,Decoy,0,-9.32313,-5.72,-4.23,-7.292890735232984
CC[C@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@H](c3ccc(OC)cc3OC)N12,C36071675_decoy,CASP3,Decoy,0,-9.32431,-7.72,-2.61,-7.072177689135823
CC[C@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@@H](c3cccc(OC)c3OC)N12,C36071709_decoy,CASP3,Decoy,0,-7.6547,-4.39,-3.91,-5.681838147766101
CCCCNC(=O)[C@@H](c1ccc(C)cc1C)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499640_decoy,CASP3,Decoy,0,-6.68413,-6.48,-1.36,-6.590859752339541
Cc1ccccc1[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499677_decoy,CASP3,Decoy,0,-6.39745,-5.62,-3.12,-6.892986806233878
Cc1ccccc1[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499679_decoy,CASP3,Decoy,0,-7.52127,-6.88,-4.63,-6.45919596784104
CCCCNC(=O)[C@H]([C@@H](C)c1ccccc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499710_decoy,CASP3,Decoy,0,-7.53736,-6.49,-3.82,-7.617117249795462
CCCCNC(=O)[C@@H](c1ccc(C)cc1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596762_decoy,CASP3,Decoy,0,-8.02942,-6.75,-2.19,-7.882763573404205
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OCC)s3)[C@@H]2c2cccc(O)c2)cc1,C09192814_decoy,CASP3,Decoy,0,-9.72967,-6.92,-0.98,-7.4388958511217265
CCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCOC)cc1OC,C39898169_decoy,CASP3,Decoy,0,-8.48965,-5.98,-4.33,-7.132703083640298
CCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCOC)cc1OC,C39898170_decoy,CASP3,Decoy,0,-8.45535,-5.79,-2.81,-7.892655376754835
CCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC)cc1OCC,C39898293_decoy,CASP3,Decoy,0,-8.55796,-5.93,-3.48,-8.436660452801043
CCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC)cc1OCC,C39898294_decoy,CASP3,Decoy,0,-7.77815,-5.21,-2.96,-6.3667584236247725
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(-c3cccs3)n2[C@H](C(=O)[O-])C(C)C)c1C,C13271837_decoy,CASP3,Decoy,0,-9.26243,-6.67,-1.66,-7.072755734358213
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(-c3ccc(Cl)cc3)n2CC(=O)[O-])c1C,C13402141_decoy,CASP3,Decoy,0,-8.16715,-6.91,-2.16,-10.473371744277788
O=C([O-])[C@H]1CCCC[C@H]1C(=O)NCCCCCCCCCCCCNC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-],C48533256_decoy,CASP3,Decoy,0,-7.41046,-7.05,-1.51,-9.741798250777752
CCO/C([O-])=C1\C(COC[C@@](C)(O)c2ccco2)=NC(C)=C(C(=O)OC)[C@@H]1c1cccc(Cl)c1Cl,C26471007_decoy,CASP3,Decoy,0,-9.86907,-5.81,-1.46,-7.670616415600116
CCCCOC(=O)C1=C(C)Nc2nc(SCc3ccccc3F)nn2[C@@H]1c1ccc(C(=O)[O-])cc1,C54642026_decoy,CASP3,Decoy,0,-8.34199,-6.07,-1.9,-6.905531503756127
CCc1cc(C)cc(OCC(=O)N/N=C/c2ccc(OCc3cccc(C(=O)[O-])c3)c(OC)c2)c1,C59247952_decoy,CASP3,Decoy,0,-9.72476,-8.56,-2.2,-7.444922106961372
CCOC(=O)c1ccc(N/C(=N\C(=O)c2cccc(Cl)c2)[N-]Cc2c(C)nn(CC)c2C)cc1,C32971686_decoy,CASP3,Decoy,0,-8.40257,-6.35,-3.3,-5.91161090225499
CCCn1cc(C[N-]/C(=N/C(=O)c2cccc(Cl)c2)Nc2ccc(C(=O)OCC)cc2)c(C)n1,C32972879_decoy,CASP3,Decoy,0,-8.06041,-5.31,-3.23,-5.99754078327983
O=C([O-])c1ccc(/N=C(/NC[C@H]2CCCO2)N2CCN(CCOc3ccc(Cl)cc3)CC2)cc1,C21046509_decoy,CASP3,Decoy,0,-8.78333,-6.74,-1.39,-8.130597773097271
CCOC(=O)c1c(CC(C)C)csc1NC(=O)CSc1nc(C)cc(C)c1C(=O)[O-],C13021997_decoy,CASP3,Decoy,0,-8.23805,-6.71,-1.52,-6.210235723634835
CCCCOc1c(Cl)cc(C(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])cc1OC,C13169058_decoy,CASP3,Decoy,0,-7.82506,-6.67,-3.3,-6.527517854414597
CCOc1ccc(-c2nnc(SCC(=O)N[C@H]3CCC[C@@H](C)[C@@H]3C)n2CCC(=O)[O-])cc1,C13193489_decoy,CASP3,Decoy,0,-9.56904,-6.74,-1.5,-10.170803538158632
CCOc1ccc(-c2nnc(SCC(=O)NCc3ccc(Cl)cc3)n2CC(=O)[O-])cc1,C13194826_decoy,CASP3,Decoy,0,-7.99463,-5.74,-1.47,-6.146514770220327
Cc1ccc(-c2nnc(SCC(=O)Nc3ccccc3SCC#N)n2CCC(=O)[O-])cc1,C13197283_decoy,CASP3,Decoy,0,-7.43189,-6.34,-1.83,-5.799424938249147
CCc1cccc(CC)c1NC(=O)CSc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13197841_decoy,CASP3,Decoy,0,-8.9044,-7.35,-2.09,-7.286503544219453
CCCc1nnc(SCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1CC(=O)[O-],C13201753_decoy,CASP3,Decoy,0,-7.34913,-6.8,-2.96,-5.679480731900476
CCCc1nnc(SCC(=O)Nc2ccc(Sc3cc(C)ccc3C)cc2)n1CC(=O)[O-],C13202947_decoy,CASP3,Decoy,0,-6.54386,-7.71,-2.98,-5.621995362255735
CCC(C)(C)C1CCC(NC(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])CC1,C13219281_decoy,CASP3,Decoy,0,-7.67345,-7.44,-0.74,-6.1568177285571934
CCCCC[C@@H](C)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1CCC(=O)[O-],C13219773_decoy,CASP3,Decoy,0,-8.38517,-6.38,-2.82,-7.022578932709847
CCn1c(SCC(=O)NCCCSc2ccccc2)nc2cc(C(=O)[O-])ccc2c1=O,C13220049_decoy,CASP3,Decoy,0,-7.56772,-5.94,-2.91,-5.862392045492492
COCCOc1cc(NC(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)c(C(=O)[O-])cc1OC,C13451239_decoy,CASP3,Decoy,0,-7.73798,-6.96,-3.15,-5.940499790013118
COCCN(CC(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1cc(C(=O)[O-])ccc1F,C13454405_decoy,CASP3,Decoy,0,-6.18377,-7.5,-2.07,-7.930767920407625
COc1ccc(/C=N/NC(=O)CCCOc2ccc(Cl)cc2Cl)c(C(=O)[O-])c1OC,C02280583_decoy,CASP3,Decoy,0,-7.49493,-6.38,-2.58,-6.70666169136717
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C(C)(C)C)cc2)cc1,C09243142_decoy,CASP3,Decoy,0,-6.64801,-5.16,-1.55,-5.1896977347714985
COCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@H]1c1ccc(O)c(OC)c1,C13548473_decoy,CASP3,Decoy,0,-8.21219,-5.53,-2.13,-7.218813738502668
CCSc1sc(CC)c(C(=O)[O-])c1/C=N/NC(=O)c1cc(OC)c(OC)c(OC)c1,C02950283_decoy,CASP3,Decoy,0,-7.85445,-5.4,-1.56,-7.9184979262525905
C=CCn1c([S-])nnc1-c1sc(NC(=O)c2ccc(OCC(C)C)c(OCC)c2)nc1C,C30671056_decoy,CASP3,Decoy,0,-10.9037,-5.56,-1.89,-9.982026006500233
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1cccs1,C35695843_decoy,CASP3,Decoy,0,-8.35488,-5.36,-2.91,-6.796089477674983
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@H]1c1ccc(OC)c(OC)c1,C36058623_decoy,CASP3,Decoy,0,-8.47716,-6.42,-1.43,-6.817278535758
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCOC)[C@@H]2c2ccc(O)cc2)cc1C,C13451394_decoy,CASP3,Decoy,0,-8.32637,-6.02,-1.43,-6.4991194876174605
CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)[O-])CC[C@@](C)(O)[C@@H]1[C@]1(C)O[C@@H]1CC=C(C)C,C38664925_decoy,CASP3,Decoy,0,-9.37574,-6.42,-1.71,-8.96883904574178
O=C(Cn1c([S-])nnc1-c1cccs1)NCCCCCc1nc(-c2cccs2)no1,C09930192_decoy,CASP3,Decoy,0,-12.2339,-7.43,-1.76,-9.81140966502488
CCCN(CC1=NN[C@@H](c2cccs2)O1)C(=O)CSc1nnc(CC2CCCC2)[n-]1,C39470465_decoy,CASP3,Decoy,0,-10.1034,-4.9,-1.93,-7.199687705760198
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)cc2)[C@@H]1c1ccc(O)c(OCC)c1,C40026629_decoy,CASP3,Decoy,0,-8.36561,-7.45,-2.34,-6.847351038839712
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC=C)[C@H]2c2ccc(O)c(OCC)c2)cc1C,C40027435_decoy,CASP3,Decoy,0,-8.13377,-6.74,-2.27,-6.784550587678737
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@@H]1c1ccc(O)c(OCC)c1,C40027759_decoy,CASP3,Decoy,0,-8.90389,-6.56,-1.7,-8.55079561813506
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2ccc(OCC)cc2)cc1C,C40052202_decoy,CASP3,Decoy,0,-8.37918,-7.03,-1.79,-8.193445650073961
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(N(C)C)cc2)cc1C,C40052393_decoy,CASP3,Decoy,0,-6.75409,-7.7,-1.86,-7.004086931032824
COc1cccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)c1,C40079062_decoy,CASP3,Decoy,0,-7.97093,-7.17,-2.09,-7.503189423919427
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OC(C)C)cc2)[C@@H]1c1ccc(O)c(OCC)c1,C40079408_decoy,CASP3,Decoy,0,-8.28537,-5.74,-1.56,-6.8000856029405226
CCc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40080495_decoy,CASP3,Decoy,0,-8.06904,-5.99,-5.4,-5.804998056177508
COc1cccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)c1OC,C40080893_decoy,CASP3,Decoy,0,-7.74613,-6.51,-1.6,-6.425286642810355
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccc(Cl)c1,C40084265_decoy,CASP3,Decoy,0,-8.97238,-6.41,-1.7,-7.865966379985611
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccccc1Cl,C40084300_decoy,CASP3,Decoy,0,-9.47367,-5.37,-2.51,-6.522960349745
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCC)c(OC)c2)cc1C,C40085696_decoy,CASP3,Decoy,0,-7.9834,-5.95,-2.61,-7.080480936779432
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(C(=O)OC)cc2)cc1C,C40092183_decoy,CASP3,Decoy,0,-6.76676,-6.85,-2.99,-6.040661533874823
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40093329_decoy,CASP3,Decoy,0,-8.05287,-7.25,-1.5,-10.785469103002502
CCN(CC)c1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40093466_decoy,CASP3,Decoy,0,-8.08212,-5.58,-2.69,-6.741124388125181
COc1cccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)c1OC,C40094070_decoy,CASP3,Decoy,0,-8.38615,-6.83,-2.98,-7.641017423395919
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@@H]1c1ccc(OC)cc1,C40400431_decoy,CASP3,Decoy,0,-8.71071,-5.44,-2.32,-6.736094265049634
CCCCN/C([O-])=C(\C#N)C(=O)c1ccc(OCc2cscn2)c(OC)c1,C51009047_decoy,CASP3,Decoy,0,-8.25158,-5.33,-1.63,-6.000348076958208
COc1ccc(CN/C([O-])=C(\C#N)C(=O)CCCC(=O)c2ccc(F)cc2)cc1,C51621052_decoy,CASP3,Decoy,0,-6.71058,-7.11,-0.81,-6.018308692138786
CCCn1cc(C[N-]/C(=N/C(=O)c2cccc(Cl)c2)Nc2cccc(C(=O)OC)c2)c(C)n1,C32972987_decoy,CASP3,Decoy,0,-9.57001,-7.72,-2.36,-7.779058661471232
CCOc1ccc([C@@H](C)NC(=O)Cn2c([S-])nnc2-c2ccc(OC)cc2)cc1OCC,C58111430_decoy,CASP3,Decoy,0,-8.2479,-6.01,-2.5,-6.568452502323345
C=CCc1cc(/C=C2\NC(=O)N(CC)C2=O)cc(OCC)c1OCc1ccc(C(=O)[O-])cc1,C33334295_decoy,CASP3,Decoy,0,-8.3834,-6.22,-2.45,-6.589002999665628
C=CCn1c(COc2cccc(C)c2C)nnc1SCC(=O)Nc1cccc(C(=O)[O-])c1,C59176591_decoy,CASP3,Decoy,0,-8.62935,-7.97,-2.43,-6.902922019847895
Cc1nc(-c2ccc(CCNC(=O)CS(=O)(=O)[N-]c3ccc(OC(C)C)cc3)cc2)cs1,C59362962_decoy,CASP3,Decoy,0,-7.9545,-7.21,-1.45,-5.993532154126464
CCCCN(C)c1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1C(=O)[O-],C33253358_decoy,CASP3,Decoy,0,-7.66825,-6.81,-1.98,-6.755228096745748
CCCCN(Cc1ccccc1)c1[nH+]cc([N-]S(=O)(=O)c2cccs2)cc1C(=O)[O-],C35397573_decoy,CASP3,Decoy,0,-9.82142,-7.29,-2.72,-7.490347729076922
C[C@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1,C08234505_decoy,CASP3,Decoy,0,-6.21865,-5.38,-0.53,-4.729192738948478
Cn1cc(/C=C(\C#N)C(=O)c2cccc(Cl)c2)cn1,C11297680_decoy,CASP3,Decoy,0,-6.36753,-5.33,-0.37,-5.490111129659827
CCSc1nc2sccn2c1C=C(C#N)C#N,C05238181_decoy,CASP3,Decoy,0,-6.08987,-4.49,0.11,-4.514419936242479
CC1(C)S[C@H](N=C=Nc2ccccc2)CN1C=O,C17430024_decoy,CASP3,Decoy,0,-4.94818,-6.09,-2.17,-4.836129760272807
ClCCN1CCO[C@H](c2ccc3c(c2)OCO3)C1,C19730103_decoy,CASP3,Decoy,0,-7.31364,-5.09,-0.75,-5.3886988795346
c1nc(N2CCCCC2)sc1CN1CCOCC1,C20405404_decoy,CASP3,Decoy,0,-7.05302,-4.35,-1.42,-4.549803771114166
CC(=O)O[C@H]1C[C@@H](C)S(=O)(=O)[C@H]2CCCC[C@@H]12,C22015868_decoy,CASP3,Decoy,0,-6.33282,-5.42,-2.28,-5.02600757527497
Cc1noc(C)c1Cn1cnc2cc(F)c(F)cc21,C24425623_decoy,CASP3,Decoy,0,-5.09161,-5.16,-0.92,-4.499626401675833
Cc1cc2oc(=O)cc(CS(C)(=O)=O)c2cc1C,C26507125_decoy,CASP3,Decoy,0,-5.29059,-6.22,-1.34,-3.92009758027524
O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCC2(CC1)OCCO2,C34873386_decoy,CASP3,Decoy,0,-6.81765,-5.78,-0.26,-5.11493193949178
C=C1[C@H]2[C@H]3OC(=O)C(=C)[C@@H]3CCC(=C)[C@@H]2C[C@H]1OC(C)=O,C35465456_decoy,CASP3,Decoy,0,-6.63746,-5.57,-0.21,-5.471861730767349
CC(=O)N(c1ccc(C)cc1)c1nc(C=O)cs1,C36379799_decoy,CASP3,Decoy,0,-5.2816,-4.81,-0.89,-4.791536084945745
O=C1CCCCCCN1Cc1nnsc1Cl,C36820311_decoy,CASP3,Decoy,0,-7.21273,-4.31,-0.71,-4.345314127211108
Cc1nnc(SCc2nnsc2Cl)s1,C37488114_decoy,CASP3,Decoy,0,-8.6017,-4.05,-0.27,-6.016743180181357
CN(C(=O)C1CCCCC1)[C@@]1(C)CCS(=O)(=O)C1,C07736480_decoy,CASP3,Decoy,0,-6.59652,-4.81,-0.33,-4.6184044438413325
Cc1cc(C)n2cc(CSc3ccccn3)nc2n1,C12588988_decoy,CASP3,Decoy,0,-6.27037,-4.67,-2.17,-4.276377391927234
CN(C)C(=O)c1csc(-c2cc3ccccc3n2C)n1,C38910008_decoy,CASP3,Decoy,0,-5.29027,-5.57,-1.26,-4.307240798390157
COc1c(Cl)c(OC)c2c(c1Cl)OCC2=O,C39000739_decoy,CASP3,Decoy,0,-5.76616,-4.37,-1.42,-4.181162997079654
O=C1N=C(CN2CCCC2)N=C2S[C@@H]3CCCCC3=C12,C39312694_decoy,CASP3,Decoy,0,-7.89262,-5.09,-0.96,-3.752773966515959
N#C[C@H]1C(=O)N=C(c2ccco2)C=C1c1ccccc1,C39355918_decoy,CASP3,Decoy,0,-7.12901,-6.98,0.34,-4.279778241299901
C[C@H]1CN(C(=O)c2sccc2-n2cccc2)C[C@H](C)O1,C40489133_decoy,CASP3,Decoy,0,-4.64855,-4.79,-2.58,-3.761363509889701
C[C@@H]1CN([C@@H](C#N)c2ccc(N(C)C)cc2)CCO1,C41345215_decoy,CASP3,Decoy,0,-6.44939,-5.54,-0.61,-5.990215062398762
C[C@H](c1ccc2c(c1)OCCCO2)[C@@H](C#N)N(C)C,C41347690_decoy,CASP3,Decoy,0,-6.34829,-5.73,-0.65,-5.355518537176643
Cc1ccc([C@H]2CN(C(=O)c3ccncc3)C[C@H](C)O2)cc1,C41422627_decoy,CASP3,Decoy,0,-6.03591,-6.17,-2.72,-5.191616920781729
C[C@H](Cn1ccnc1)n1ccc2c1CC(C)(C)CC2=O,C41708735_decoy,CASP3,Decoy,0,-6.39134,-6.5,-0.72,-5.8577911163960055
CN(C(=O)c1cnc(Cl)c(Cl)c1)c1nccs1,C41841999_decoy,CASP3,Decoy,0,-6.89507,-3.97,-2.77,-4.355870772794258
O=Cc1c(N2CCCSCC2)nc2ccccn12,C42444191_decoy,CASP3,Decoy,0,-5.10804,-5.09,-1.32,-4.041735468782755
C[C@@H]1CN([C@H](C)C(=O)N2[C@H](C)CCC[C@H]2C)C[C@H](C)O1,C43303881_decoy,CASP3,Decoy,0,-5.85602,-5.12,-1.78,-4.908250721756961
CC[C@@H]1CO[C@H](C)CN1C(=O)C1(C#N)CCCCC1,C44766227_decoy,CASP3,Decoy,0,-5.12399,-5.5,-2.88,-5.287899075876178
N#CC1(C(=O)N2CCN(C3CC3)CC2)CCCCCC1,C44766327_decoy,CASP3,Decoy,0,-5.98117,-4.85,-1.76,-4.271473422058201
Cc1nn(C(C)(C)C)c(C)c1C(=O)N1C[C@H](C)C[C@H](C)C1,C44837876_decoy,CASP3,Decoy,0,-5.66458,-5.44,-5.63,-3.699664030496913
O=C(Cl)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1,C45958480_decoy,CASP3,Decoy,0,-6.31485,-6.46,-1.89,-3.820916419699679
CN(C)c1ccc(C(=O)N2CCc3ccccc32)cn1,C46120162_decoy,CASP3,Decoy,0,-4.30801,-6.38,-1.37,-4.610417110557477
Cc1cc([C@@H]2CCCN2C(=O)c2cc(C)sc2C)on1,C47266453_decoy,CASP3,Decoy,0,-6.36591,-5.09,-0.7,-4.664411189434259
C[C@@H]1C[C@H](C)CN(C(=O)CSc2nncs2)C1,C47822997_decoy,CASP3,Decoy,0,-7.20797,-6.78,-0.56,-9.206490422864936
C[C@@H]1C[C@@H](C)CN(C(=O)CSc2nncs2)C1,C47823003_decoy,CASP3,Decoy,0,-7.71833,-4.16,-0.55,-5.381882698979906
Cc1ccc(-c2nc(C(=O)N3CCSCC3)cs2)o1,C48600660_decoy,CASP3,Decoy,0,-6.9022,-5.46,-2.5,-3.9407371683073777
Cc1cnn(CC(=O)N2CCc3sccc3[C@H]2C)c1,C49088685_decoy,CASP3,Decoy,0,-6.73978,-5.96,-0.75,-5.779143648712963
CC[C@@H]1CO[C@H](C)CN1c1nc(C)c(C(C)=O)s1,C54863517_decoy,CASP3,Decoy,0,-7.31413,-4.98,-4.43,-5.378356293128554
CC1CCN(c2ccc(=O)n(C[C@@H](C)C#N)c2)CC1,C57831093_decoy,CASP3,Decoy,0,-6.44488,-4.89,-0.97,-5.467660027534285
SCc1cc(-c2ccc3c(c2)OCCCO3)on1,C57961527_decoy,CASP3,Decoy,0,-6.80789,-4.67,-0.44,-4.038850214005303
C[C@@H]1CCCN(S(=O)(=O)N2C[C@H](C)C[C@H](C)C2)C1,C58645688_decoy,CASP3,Decoy,0,-6.38639,-5.13,-1.35,-4.355470210542525
Clc1ccc(Cn2ccnc2-c2cnccn2)cc1,C60361723_decoy,CASP3,Decoy,0,-6.34087,-5.53,-1.06,-5.765023501139472
N#Cc1ncccc1Cn1cc(-c2ccccc2)cn1,C61664709_decoy,CASP3,Decoy,0,-6.29796,-5.57,-2.14,-4.69313342851248
Cc1ccc(=O)n(Cc2nc(Cl)ccc2Cl)n1,C61810501_decoy,CASP3,Decoy,0,-5.99386,-5.51,-2.95,-3.357276944436543
N#C[C@H]1CCC[C@@H]1N1C(=O)C[C@H](c2ccccc2)C1=O,C61890039_decoy,CASP3,Decoy,0,-6.38468,-5.64,-1.94,-4.476070003911223
Clc1cnn(CN2CCOc3ccccc3C2)c1,C66350824_decoy,CASP3,Decoy,0,-6.70612,-4.38,-0.77,-4.279088044095247
Cc1ncsc1CN(C)c1ncnc2ccccc12,C66467511_decoy,CASP3,Decoy,0,-6.13166,-5.65,-1.14,-5.196584062316394
O=C(OC1CCCCCC1)[C@@H]1CCS(=O)(=O)C1,C66778469_decoy,CASP3,Decoy,0,-6.83884,-5.68,0.01,-4.523033087266154
C[C@H]1CN(C2CCN(C(=O)C3(C)CCCC3)CC2)CCO1,C67306177_decoy,CASP3,Decoy,0,-6.21918,-5.47,-0.8,-4.588166087678256
O=C1OC(c2cccc3ccccc23)=N/C1=C/c1cccc(F)c1,C00430425_decoy,CASP3,Decoy,0,-5.985,-7.52,-1.9,-3.9411051122172447
Fc1ccccc1CSc1nnc2sc3ccccc3n12,C00087396_decoy,CASP3,Decoy,0,-8.46788,-6.52,-1.47,-6.185493634222184
CCCC1CCC(C2=N/C(=C\c3ccc(C)cc3)C(=O)O2)CC1,C04588472_decoy,CASP3,Decoy,0,-6.83228,-5.07,-2.31,-3.939931651527396
ClC[C@H]1CN(c2ccccc2)[C@@]2(O1)SCCN2c1ccccc1,C04600975_decoy,CASP3,Decoy,0,-6.14051,-4.99,-0.94,-5.639262591651596
COc1ccc(-c2c/c(=N\c3ccccc3)c3cc(F)ccc3o2)cc1,C04738057_decoy,CASP3,Decoy,0,-6.6502,-5.42,-3.76,-3.579902188205124
CC1(C)C(=O)O[C@@H](c2ccc(Cl)cc2)[C@@H](c2ccccc2)C1=O,C04751448_decoy,CASP3,Decoy,0,-5.99566,-6.64,-1.18,-4.957605103748976
S=C1N(c2ccccc2)[C@H](c2ccccc2Cl)N2CCCN12,C00551755_decoy,CASP3,Decoy,0,-7.55843,-6.01,-1.24,-5.755963076934929
Cc1ccccc1CSc1nnc(-c2ccc(F)cc2)n1C,C00615107_decoy,CASP3,Decoy,0,-5.40981,-6.48,-0.7,-5.679459688041844
COc1cc(/C=C/c2ccc3ccccc3n2)cc(Cl)c1OC,C05065507_decoy,CASP3,Decoy,0,-7.30651,-5.89,-1.86,-5.048958572319868
C=CCSc1nc(-c2cccc(C)c2)nc2c1COC(C)(C)C2,C05203968_decoy,CASP3,Decoy,0,-8.52898,-5.46,-1.36,-5.588651516674161
CC(=O)O[C@@H]1C[C@H]2[C@H]3CC[C@H]4CCCC[C@]4(C)[C@@H]3CC[C@]2(C)C1=O,C05227855_decoy,CASP3,Decoy,0,-7.73195,-7.51,-1.37,-6.473844561780256
Cc1ccc(CSc2nnc(-c3ccccc3Cl)n2C)cc1,C05448192_decoy,CASP3,Decoy,0,-6.12018,-6.46,-1.11,-6.236697188224534
Clc1cc(Br)ccc1Oc1ncnc2sccc12,C05560706_decoy,CASP3,Decoy,0,-7.239,-5.72,-1.63,-5.308267532643072
Cc1nn(-c2ccccc2)c(C)c1/N=C/c1ccc(Cl)cc1Cl,C00993853_decoy,CASP3,Decoy,0,-6.25315,-6.94,-1.34,-4.492047657479688
CN(c1ccccc1)[C@@H]1C=C(c2ccccc2)OC(=O)C1(Cl)Cl,C05390369_decoy,CASP3,Decoy,0,-6.84423,-6.62,-1.12,-4.579532481730062
Cc1ccccc1S[C@@H](c1ccccc1)n1nnc2ccccc21,C05756375_decoy,CASP3,Decoy,0,-5.98699,-6.51,-2.11,-6.2157779663526505
Clc1nccc(Oc2ccc3cc(Br)ccc3c2)n1,C07737361_decoy,CASP3,Decoy,0,-6.41634,-5.67,-1.72,-4.05143670910698
CCc1ccc(/C=N/N2CCN(c3ccc(Cl)cc3)CC2)cc1,C01740051_decoy,CASP3,Decoy,0,-6.8733,-5.31,-1.42,-3.4000401323032072
CCSc1ccc(C(=O)/N=c2/sc3ccccc3n2C)cc1,C09294718_decoy,CASP3,Decoy,0,-7.48359,-5.42,-2.08,-4.418301460237436
CCN(c1ccccc1)S(=O)(=O)c1ccc(C)c2ccccc12,C12291146_decoy,CASP3,Decoy,0,-5.76433,-7.12,-1.28,-6.247239859535619
O=C(O/N=C/c1ccc(F)c(Cl)c1)c1ccc(Cl)cc1,C00106535_decoy,CASP3,Decoy,0,-7.32361,-5.61,-0.27,-5.149995233983483
Cc1ccc(-c2cn3cc(-c4cccc(Cl)c4)nc3n2C)cc1,C04678459_decoy,CASP3,Decoy,0,-7.47884,-5.69,-1.61,-4.68696761663217
Cc1cc(C)c(-c2ccc(SCc3ccccn3)nn2)cc1C,C07570768_decoy,CASP3,Decoy,0,-6.50139,-6.22,-1.25,-4.903863530462589
Cc1ccc(-n2c(C)cc(/C=N/c3ccc(N(C)C)cc3)c2C)cc1,C03170395_decoy,CASP3,Decoy,0,-6.35716,-6.72,-0.95,-4.6606973381019285
COC[C@H](C)n1c(C)cs/c1=N\c1ccc(Cl)c(F)c1,C15635048_decoy,CASP3,Decoy,0,-7.03717,-4.69,-1.39,-5.329451556739067
CO[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@H]2CC[C@]2(C)C[C@H](OC(C)=O)C[C@@H]32)C1,C17002838_decoy,CASP3,Decoy,0,-7.98831,-5.77,-0.49,-6.423713326969901
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@H]2CC[C@]2(C)C=C(C=O)C[C@@H]32)C1,C17005228_decoy,CASP3,Decoy,0,-7.70235,-5.49,-1.73,-4.837037427113498
Cc1nc(Oc2ccc(F)cc2)c2c3c(sc2n1)CCCC3,C21932742_decoy,CASP3,Decoy,0,-7.48738,-6.79,-0.43,-5.606180221189079
Clc1ccc2c(Oc3ccc(Br)cc3)ncnc2c1,C23199747_decoy,CASP3,Decoy,0,-6.22291,-4.9,-0.67,-3.594187762392476
CC(=O)O[C@H]1CC[C@@H]2[C@@H]3CC[C@@H]4CC(=O)C[C@H](C)[C@@]4(C)[C@@H]3CC[C@@]12C,C33645112_decoy,CASP3,Decoy,0,-7.45287,-5.68,-1.19,-5.434806622699403
CC(=O)O[C@H]1CC[C@@H]2[C@@H]3CC[C@H]4CC(=O)C[C@@H](C)[C@@]4(C)[C@@H]3CC[C@@]12C,C33645115_decoy,CASP3,Decoy,0,-7.52274,-6.88,-1.79,-5.891822364960416
Clc1cc(Cl)c(OCc2nnsc2Cl)cc1Cl,C35163601_decoy,CASP3,Decoy,0,-8.86225,-5.11,-0.85,-7.64344828997727
ClCc1c(Oc2cccc(Cl)c2Cl)nc2sccn12,C35429289_decoy,CASP3,Decoy,0,-9.05541,-5.58,-3.01,-5.961668562862243
COc1ccccc1-n1c([C@@H](C)Cl)nc2cccc(Cl)c21,C36910497_decoy,CASP3,Decoy,0,-6.64995,-5.31,-1.99,-5.132318006982104
CCCc1ccc(-c2cn3nc(Br)sc3n2)cc1,C36939171_decoy,CASP3,Decoy,0,-6.5097,-6.11,-1.71,-4.698485178221719
CSc1nc2sc3c(c2c(=O)n1-c1ccc(C)cc1)CCCC3,C00246472_decoy,CASP3,Decoy,0,-6.9364,-5.97,-2.6,-6.024405439887823
Cc1nnc(C)c2c(C)n(C(c3ccccc3)c3ccccc3)c(C)c12,C04870081_decoy,CASP3,Decoy,0,-7.46895,-5.83,-1.67,-6.727206509470849
COc1ccccc1[C@@H]1CN(c2ccccc2)N=C1c1cccs1,C04021905_decoy,CASP3,Decoy,0,-9.38123,-5.88,-1.29,-7.801322928427328
CC1(C)[C@@]2(C(=O)N(c3ccccc3)c3ccccc3)CC[C@]1(C)C(=O)C2,C04185874_decoy,CASP3,Decoy,0,-5.24684,-6.01,-3.19,-6.494699937649487
CC(C)c1ccc(C2=NC(=O)C3=C4CC[C@H](C)C[C@@H]4SC3=N2)cc1,C39344369_decoy,CASP3,Decoy,0,-7.40103,-5.37,-1.63,-3.92747396246312
CC1=C2C(=O)N=C(SC/C=C/c3ccccc3)N=C2S[C@H]1C,C39770474_decoy,CASP3,Decoy,0,-8.34652,-6.17,-1.51,-6.760808182920495
Cc1cc(C)c2c(n1)sc1c(SCCC(C)C)ncnc12,C40373618_decoy,CASP3,Decoy,0,-7.75466,-5.6,-3.94,-5.040176191652414
CC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@H]2CC[C@]2(C)C(=O)[C@H](C)C[C@@H]32)C1,C43722556_decoy,CASP3,Decoy,0,-6.72314,-5.58,-3.17,-3.966780963296259
CC(=O)O[C@@H]1CC[C@H]2[C@H]3CC(=O)[C@@H]4CCCC[C@]4(C)[C@@H]3CC[C@@]12C,C43756777_decoy,CASP3,Decoy,0,-6.65056,-5.41,-1.43,-4.608545667722008
Cc1ccc(-c2nc3cc(C)c(C)cc3n2CCCC#N)cc1C,C57869011_decoy,CASP3,Decoy,0,-7.2301,-6.68,-0.75,-6.305912376078779
Cc1ccc(/C=C/c2ccn(Cc3ccccc3C#N)c(=O)c2)cc1,C57869669_decoy,CASP3,Decoy,0,-6.44212,-5.85,-1.72,-4.561251091921872
Cc1cc2n(n1)[C@@H](c1ccc(Cl)cc1)CC(c1ccccc1)=N2,C00217108_decoy,CASP3,Decoy,0,-6.83236,-5.75,-1.94,-5.102308188789816
COc1ccc2c(c1)CCc1sc(/N=C/c3ccc(F)cc3)nc1-2,C59459298_decoy,CASP3,Decoy,0,-6.9353,-5.59,-0.96,-4.343124426604989
Cc1ccc(-n2cnnc2S[C@@H](C)c2cccc(F)c2)c(C)c1,C59832507_decoy,CASP3,Decoy,0,-6.97168,-5.43,-2.61,-6.418530204381213
O=C(c1csc(-c2cccs2)n1)N1CC2C[C@@H]3CC1C[C@H](C2)C3,C65814044_decoy,CASP3,Decoy,0,-9.3039,-6.75,-5.44,-8.076992226458204
CC1CCN(C(=O)CSc2ncnc3c2nnn3-c2ccc(F)cc2)CC1,C04166652_decoy,CASP3,Decoy,0,-7.01183,-5.88,-0.76,-4.908376067179917
CCc1ccc2c(Cn3cc(S(=O)(=O)N(C)C)ccc3=O)cc(=O)oc2c1,C05918101_decoy,CASP3,Decoy,0,-6.4445,-6.73,-1.58,-6.523099271941838
Cc1cnc(C)c(N2CCN(C(=O)[C@@H]3CCC(=O)N(CC4CCCCC4)C3)CC2)n1,C11844273_decoy,CASP3,Decoy,0,-8.66125,-6.19,-1.81,-5.818252734357865
O=C(c1ccccc1Br)N1CCN(c2ccc(-n3cccn3)nn2)CC1,C13008821_decoy,CASP3,Decoy,0,-6.23407,-6.03,-0.85,-4.839084853180064
COC(=O)c1c2c(nc3c1c(-c1cccs1)nn3[C@@H]1CCS(=O)(=O)C1)CCC2,C16850665_decoy,CASP3,Decoy,0,-8.3842,-6.26,-2.35,-6.665564668862861
CCc1ocnc1C(=O)N1CCC[C@@H]1c1ccc(C(=O)N2CCOCC2)s1,C19223616_decoy,CASP3,Decoy,0,-7.37822,-6.92,-2.45,-5.495240187247582
O=C(C1CCN(c2ncnc3ccccc23)CC1)N1CCN(c2nccs2)CC1,C19376143_decoy,CASP3,Decoy,0,-8.94168,-6.68,-1.15,-4.955897273586977
Cc1c(C(=O)N2CCCC2)oc2c1-c1nn(CC(=O)N3CCC(C)CC3)cc1CC2,C20510597_decoy,CASP3,Decoy,0,-8.65278,-7.48,-1.06,-9.299589186239464
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1CN(C)c1ncnc2cc(Cl)ccc12,C21674641_decoy,CASP3,Decoy,0,-8.40119,-7.41,-1.85,-7.254656906624007
CCN1[C@@H]2c3ccccc3N(S(C)(=O)=O)[C@H]1c1ccccc1N2S(C)(=O)=O,C14945023_decoy,CASP3,Decoy,0,-6.39533,-6.27,-1.95,-5.3943721516657055
Cc1cccc(-c2ccnc3nc(N4CCN(C(=O)[C@@H](C)Cl)CC4)nn23)c1,C23310855_decoy,CASP3,Decoy,0,-7.74269,-5.86,-1.62,-6.094278060737481
Cc1nnc(-c2cc(C3CC3)n(-c3cccc(C(=O)N4CCCC[C@@H]4C)c3)n2)o1,C23325638_decoy,CASP3,Decoy,0,-7.53677,-7.33,-1.65,-6.137335275443423
CN(Cc1nc2ccccc2s1)CN1C(=O)C(=O)N(C2CCCCC2)C1=O,C24455941_decoy,CASP3,Decoy,0,-6.30161,-6.89,-1.0,-5.536041493026826
Cc1nc(C)c2c(C)c(C(=O)N(C)[C@H](C)c3ccc(-n4cncn4)cc3)sc2n1,C32754355_decoy,CASP3,Decoy,0,-6.39657,-5.38,-0.81,-4.964669772393934
N#Cc1c(CN2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)cn2ccccc12,C32888333_decoy,CASP3,Decoy,0,-8.15003,-7.85,-1.94,-6.726914296304521
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=CC=NN2[C@@H]3C(=O)c2ccccc2)cc1,C06186600_decoy,CASP3,Decoy,0,-7.4873,-7.05,-1.9,-6.198980790006408
Cc1nnsc1C(=O)N1CCN(C2=NN=C(c3cccs3)CS2)CC1,C36709963_decoy,CASP3,Decoy,0,-8.226,-6.04,-1.72,-5.300369234188139
Cc1ccc(C(=O)N2CCN(C(=O)[C@@H]3C[C@H]3c3cccs3)CC2)cc1[N+](=O)[O-],C38727939_decoy,CASP3,Decoy,0,-5.19607,-6.22,-1.0,-5.274308567625165
COc1nn(C)cc1C(=O)N1CCN(c2nc3c(C)c(C)ccc3s2)CC1,C36687944_decoy,CASP3,Decoy,0,-7.50254,-7.32,-0.68,-5.640242218936338
CN1CCN(C(=O)[C@@H]2CN(S(C)(=O)=O)c3cc(C(C)(C)C)ccc3O2)CC1,C38858557_decoy,CASP3,Decoy,0,-5.99164,-5.82,-1.51,-3.967307556545075
COc1cc2c(cc1OC)C1=Cc3ccc(OC)c(OC)c3S(=O)(=O)N1C=C2,C39328270_decoy,CASP3,Decoy,0,-6.58368,-7.06,-1.53,-5.772987641809551
CCOc1ccccc1C1=NN=C2CCN(C(=O)Cn3cc(Cl)cn3)C[C@H]21,C39445555_decoy,CASP3,Decoy,0,-7.77842,-6.61,-2.02,-6.429796184857195
Cc1ccccc1Cn1cc(C(=O)N2CCC(N3C[C@@H](C)O[C@@H](C)C3)CC2)nn1,C19633916_decoy,CASP3,Decoy,0,-8.32682,-7.2,-0.48,-5.303753383295044
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(-c4ccc(C)cc4)nn3)CC2)CC1,C40906939_decoy,CASP3,Decoy,0,-7.36035,-6.61,-2.29,-6.928157401814096
Cn1nc(C(=O)N2CCN(C(=O)c3ccco3)CC2)cc1-c1ccc(Cl)cc1,C41211383_decoy,CASP3,Decoy,0,-7.17218,-6.29,-1.84,-4.93082121977967
C[C@H](Sc1nc2ncccn2n1)C(=O)N(C)Cc1nc2ccccc2s1,C28514136_decoy,CASP3,Decoy,0,-4.63625,-7.62,-1.16,-5.175126622802575
O=C([C@@H]1CCCc2ccccc21)N1CCN(c2nnnn2-c2ccccc2)CC1,C46706259_decoy,CASP3,Decoy,0,-7.86073,-7.16,-1.08,-6.099941788520035
Cc1nn(C)c(Cl)c1C(=O)N1CCN(C(=O)c2ccccc2OC(F)F)CC1,C46718087_decoy,CASP3,Decoy,0,-7.2933,-6.69,-3.17,-6.280838314609372
Cn1ncc2c(N3CCN(C(=O)[C@H]4CCC[C@@H](C(F)(F)F)C4)CC3)ncnc21,C46912128_decoy,CASP3,Decoy,0,-6.59959,-6.12,-4.29,-4.800017871458513
CC(C)(C)n1nc2c(c1-n1cccc1)CN(C(=O)c1cc3ccccc3oc1=O)C2,C56911156_decoy,CASP3,Decoy,0,-6.79087,-6.1,-3.04,-4.694313356300026
CC(=O)N1CCC(C(=O)N2Cc3nn(-c4cccc(C)c4)c(-n4cccc4)c3C2)CC1,C56911785_decoy,CASP3,Decoy,0,-5.97126,-6.41,-2.56,-4.034103125176077
S=c1oc(-c2cccc(Cl)c2)nn1CN1CCN(c2ncccn2)CC1,C57584356_decoy,CASP3,Decoy,0,-8.2912,-5.46,-1.0,-5.097473238381187
C[C@@H]1C[C@H](C)CN(C(=O)CCCc2nnc3n(C)c(=O)c4sccc4n23)C1,C06817088_decoy,CASP3,Decoy,0,-6.89198,-6.55,-2.09,-5.358766277087288
Cn1cc(C(=O)N2CCO[C@H](c3ccccc3)C2)c(-c2ccc3c(c2)OCCCO3)n1,C27907773_decoy,CASP3,Decoy,0,-6.75842,-6.68,-0.91,-5.52593300249578
Cn1cc(C(=O)N2CCN(Cc3nc(-c4cccs4)no3)CC2)c2ccccc21,C25608239_decoy,CASP3,Decoy,0,-8.14688,-7.4,-2.62,-6.144037744736671
Cc1cccc(N2C(=O)C[C@@H](N3CCN(c4ccc5c(c4)OCO5)CC3)C2=O)c1,C20408177_decoy,CASP3,Decoy,0,-7.32462,-7.58,-4.4,-5.232346759860154
O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)N1CCCC[C@@H]1C1OCCO1,C60347081_decoy,CASP3,Decoy,0,-8.60542,-7.36,-2.01,-7.09304326583781
CC[C@@H](C)C(=O)/N=C1\S[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc2c(c1)OCO2,C17043058_decoy,CASP3,Decoy,0,-8.42649,-5.84,-0.61,-5.768984793125745
Cc1nccn1-c1ccc(N2CCC[C@@H](C(=O)N3CCc4ccccc43)C2)nn1,C62165309_decoy,CASP3,Decoy,0,-7.38514,-7.29,-1.28,-5.352698715731597
CN(CC1=NC(=O)[C@H]2SC=CC2=N1)C(=O)c1nn(-c2ccccc2F)c2c1CCC2,C63405832_decoy,CASP3,Decoy,0,-6.28723,-8.65,-1.33,-5.865034167654152
Cc1ccccc1C1=N/C(=C\c2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)C(=O)O1,C63438848_decoy,CASP3,Decoy,0,-7.58542,-7.16,-1.31,-5.917681925871039
Cc1cc(C(=O)N2CCN(Cn3ncnc3-c3ccccc3Cl)CC2)c(C)o1,C64028285_decoy,CASP3,Decoy,0,-6.92088,-7.56,-1.93,-6.24124626928613
Cc1ccc(C2=C[C@H](C(=O)N3CC[C@H]4C(=Nc5ccccc54)[C@@H]3c3ccccn3)N=N2)o1,C39430635_decoy,CASP3,Decoy,0,-7.59132,-7.23,-1.11,-6.89992291480495
CC(C)(C)c1ccc(C(=O)N2CCN(C(=O)[C@H]3C=C(c4ccccn4)N=N3)CC2)cc1,C64449658_decoy,CASP3,Decoy,0,-6.08043,-7.05,-1.02,-4.53982352836359
O=C(c1ccco1)N1CCC(c2ccn3ncc(C(=O)N4CCCC4)c3c2)CC1,C64761577_decoy,CASP3,Decoy,0,-7.15265,-6.88,-1.02,-6.579420760348504
Cc1ccc(S(=O)(=O)N2CCc3c(c(C(=O)N4CCCC4)nn3C)C2)c(C)c1,C64893361_decoy,CASP3,Decoy,0,-7.71038,-6.52,-1.05,-7.147586847686224
O=S(=O)(c1cccs1)N1CC[C@H](n2c(-c3ccoc3)nc3cccnc32)C1,C65271763_decoy,CASP3,Decoy,0,-8.05511,-6.63,-2.37,-7.062373979461728
Cn1c(-c2ccccc2)nnc1[C@H](C#N)C(=O)/C=C\c1ccc2c(c1)OCCO2,C66865951_decoy,CASP3,Decoy,0,-7.5971,-6.64,-0.01,-7.858045132256642
O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCCn2ncnc21,C67281337_decoy,CASP3,Decoy,0,-8.23208,-6.42,-2.0,-6.231577498550215
O=c1cc(CS(=O)(=O)c2cc3c(cc2Cl)OCCO3)nc2ccccn12,C67488432_decoy,CASP3,Decoy,0,-7.62313,-6.9,-0.76,-4.633842485665187
CCN(CC)C(=O)Cn1c(=O)n(-c2ccccc2F)c(=O)c2oc3ccccc3c21,C05114947_decoy,CASP3,Decoy,0,-6.15784,-6.54,-2.93,-6.145149068271827
Cc1cc(C(=O)Cn2cnc3c(oc4ccccc43)c2=O)c(C)n1C[C@H]1CCCO1,C05241936_decoy,CASP3,Decoy,0,-7.12391,-6.72,-1.15,-5.8850544375747855
C[C@@H]1Oc2ccc(Cl)cc2N(CC(=O)c2ccc3c(c2)N(C)C(=O)CO3)C1=O,C05920665_decoy,CASP3,Decoy,0,-8.2667,-7.81,-1.82,-6.486209060347458
Cc1cc(=O)n2nc(CSc3nnc(-c4cccs4)n3C3CC3)sc2n1,C08255917_decoy,CASP3,Decoy,0,-8.51483,-7.16,-2.97,-6.386591310516629
O=C(c1ccco1)N1CCN(C(=O)[C@@H]2CC(c3cccc(Br)c3)=NO2)CC1,C00814973_decoy,CASP3,Decoy,0,-8.49711,-6.26,-0.88,-5.110833547345252
Cc1cc(=O)c(C(=O)N2CCN(C(=O)C3CC3)CC2)nn1-c1ccccc1C(F)(F)F,C09385653_decoy,CASP3,Decoy,0,-6.30334,-8.55,-1.27,-6.83209245524376
Cc1nc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)nn1-c1ccc(Cl)cc1,C09836832_decoy,CASP3,Decoy,0,-7.08199,-7.4,-2.7,-6.375839319034654
O=C(OCc1nnc(-c2ccc(Br)o2)o1)C1C[C@H]2CCC[C@@H](C1)C2=O,C11132295_decoy,CASP3,Decoy,0,-7.29637,-5.81,-0.02,-4.67817200013206
CCOC(=O)[C@H]1CCCN(C(=O)C[C@H]2CSc3nc4c(c(=O)n32)CCCC4)C1,C11613604_decoy,CASP3,Decoy,0,-7.53699,-6.1,-1.0,-5.940831704113003
COc1ccc(-c2ccnc(-n3ncc(C(=O)N4CCCCCC4)c3C)n2)cc1F,C12450113_decoy,CASP3,Decoy,0,-7.49278,-6.72,-1.21,-5.710129366319428
O=C(c1ccc2c(c1)OCO2)[C@H]1CCCN(C(=O)c2scc3c2OCCO3)C1,C12744883_decoy,CASP3,Decoy,0,-6.23591,-7.62,-1.67,-5.770225868877691
C[C@@H]1CCc2c(sc3ncnc(N4CCN(S(=O)(=O)N5CCCC5)CC4)c23)C1,C12813688_decoy,CASP3,Decoy,0,-9.79359,-5.8,-1.51,-6.114644532780623
CSc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-],C12973354_decoy,CASP3,Decoy,0,-5.75287,-5.88,-3.65,-5.136753659369138
COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2-c2ccc(N(C)C)cc2)cc1,C02437135_decoy,CASP3,Decoy,0,-6.37401,-6.58,-0.91,-5.364401535466556
Cc1ccc2sc(N3CCN(C(=O)C4CCN(S(C)(=O)=O)CC4)CC3)nc2c1C,C13705039_decoy,CASP3,Decoy,0,-8.96502,-7.42,-1.94,-5.621865520303424
Cc1nc(-c2cnn(-c3ccccc3)c2)n2c1CN(C(=O)[C@H]1CC(=O)c3ccccc31)CC2,C14532224_decoy,CASP3,Decoy,0,-7.7283,-7.55,-3.41,-6.033275173395261
Cc1ccccc1C(=O)N1CCC2(CC1)SCCN2C(=O)c1ccc([N+](=O)[O-])cc1,C16490593_decoy,CASP3,Decoy,0,-6.14043,-7.06,-2.8,-5.890716829951804
COc1ccc(C2=NO[C@@H]3C(=O)N(c4cccc(Br)c4)C(=O)[C@H]23)cc1OC,C18130333_decoy,CASP3,Decoy,0,-8.702,-7.05,-1.18,-5.361034168822139
O=C(CSc1nnc(-c2ccncc2)o1)N1CCN(c2ccccc2F)CC1,C18279041_decoy,CASP3,Decoy,0,-7.30624,-8.34,-1.54,-6.2461774180278375
O=C(c1cc(Br)ccc1-n1cnnn1)N1CCN(c2ccc(F)cc2)CC1,C20729355_decoy,CASP3,Decoy,0,-6.98565,-6.4,-1.16,-5.482173991350652
Cc1nn(C)c2ncc(C(=O)OCc3cc4c(cc3Br)OCCO4)cc12,C24198258_decoy,CASP3,Decoy,0,-8.05808,-6.64,-2.2,-4.65579929403895
COc1ccc(C(=O)N2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)c(F)c1,C24282932_decoy,CASP3,Decoy,0,-6.24798,-6.11,-4.33,-5.584361608915938
COc1ccc(-c2nc(CN3CCN(C(=O)C4=COCCO4)CC3)cs2)cc1,C32760369_decoy,CASP3,Decoy,0,-8.46368,-6.78,-1.41,-7.665815382987555
Cc1sc2nc(C3CC3)nc(N3CCN(C(=O)c4ccc5c(c4)OCO5)CC3)c2c1C,C35866673_decoy,CASP3,Decoy,0,-7.20998,-6.47,-0.45,-5.872988050074722
O=C(c1cc2ccccc2oc1=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C01330155_decoy,CASP3,Decoy,0,-8.06402,-6.81,-2.36,-5.070955403775537
Fc1ccccc1N1CCN([C@@H](c2ccncc2)c2nnnn2C2CCCC2)CC1,C19349886_decoy,CASP3,Decoy,0,-7.37298,-6.63,-1.18,-5.823493246234374
Fc1ccccc1N1CCN([C@H](c2ccncc2)c2nnnn2C2CCCC2)CC1,C19349888_decoy,CASP3,Decoy,0,-7.23267,-7.38,-0.59,-7.085423056889065
Cc1cc2oc(C(=O)N(Cc3ccco3)[C@@H]3CCS(=O)(=O)C3)cc(=O)c2cc1Cl,C04283127_decoy,CASP3,Decoy,0,-8.69038,-6.22,-1.97,-6.563434962344103
O=C1C[C@@H](C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)CN1c1cccc(Cl)c1,C40080385_decoy,CASP3,Decoy,0,-8.12749,-8.66,-1.74,-6.347340651302373
O=C(c1cnn(-c2ccccc2)n1)N1CCC(Oc2nc3c(F)cccc3s2)CC1,C49432087_decoy,CASP3,Decoy,0,-8.32921,-7.77,-1.28,-6.563737934867207
Cc1cccc(N2CCN(C(=O)CCc3nn4c(C(C)C)nnc4s3)CC2)c1,C49663463_decoy,CASP3,Decoy,0,-7.26495,-6.21,-4.86,-5.139533273305704
CC(=O)N1CCN(c2ccc(OC(=O)c3c(C)nn(C(C)(C)C)c3C)cc2)CC1,C51255193_decoy,CASP3,Decoy,0,-6.46316,-6.34,-2.94,-4.418054333553068
COc1ccc(N2CCN([C@@H]3CCCN(C(=O)c4cn5ccsc5n4)C3)CC2)cc1,C55100252_decoy,CASP3,Decoy,0,-7.50044,-6.2,-2.47,-5.508501404510539
COc1ncccc1C(=O)N1Cc2nn(-c3ccc(C)c(C)c3)c(-n3cccc3)c2C1,C56913123_decoy,CASP3,Decoy,0,-7.34281,-5.98,-1.99,-5.413352185817781
CCN1CCN(C(=O)c2nnc3sc(-c4ccc(Br)cc4)nn23)CC1,C57354673_decoy,CASP3,Decoy,0,-7.81852,-7.32,-0.5,-6.08247249155533
C[C@@H]1CCc2sc(-c3nn(CN4CCN(c5cnccn5)CC4)c(=S)o3)cc2C1,C14250405_decoy,CASP3,Decoy,0,-9.72406,-7.87,-2.69,-6.382353042159728
C[C@H]1CCc2sc(-c3nn(CN4CCN(c5cnccn5)CC4)c(=S)o3)cc2C1,C14250407_decoy,CASP3,Decoy,0,-9.73541,-5.89,-2.37,-5.646032067013554
CC(C)C(=O)N1CCC[C@H](C(=O)N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)C1,C58354874_decoy,CASP3,Decoy,0,-7.45903,-6.96,-1.83,-5.687245517315687
O=C([C@@H]1C[C@@H](n2cnnn2)CN1Cc1cc2ccccc2s1)N1CCCCCC1,C14977545_decoy,CASP3,Decoy,0,-9.02151,-9.0,-2.63,-8.612426304965688
Cn1c(SCc2cn3cc(Cl)cc(Cl)c3n2)nnc1[C@@H]1CCS(=O)(=O)C1,C60333932_decoy,CASP3,Decoy,0,-8.03321,-6.93,-0.32,-6.378759939836977
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H]3C=C(c4cccs4)N=N3)CC2)c(C)c1,C63561399_decoy,CASP3,Decoy,0,-9.58531,-6.19,-2.16,-6.371271045810689
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H]3C=C(c4cccs4)N=N3)CC2)c(C)c1,C63561402_decoy,CASP3,Decoy,0,-10.0866,-6.12,-1.6,-6.5791910840311845
O=C(C1=Nc2cc(Cl)ccc2C1)N1CCN(S(=O)(=O)N2CCCCCC2)CC1,C40079996_decoy,CASP3,Decoy,0,-7.44054,-6.93,-0.62,-5.299784369029141
CC1=C2C(=O)N=C([C@@H](C)OC(=O)c3cccc(N4CCCC4=O)c3)N=C2S[C@@H]1C,C64138825_decoy,CASP3,Decoy,0,-8.09334,-8.47,-1.9,-6.247426985410774
Cc1cc(C)cc(C(=O)N2CCCN(c3cc(=O)n(C(C)C)c(=O)n3C(C)C)CC2)c1,C65024470_decoy,CASP3,Decoy,0,-7.56433,-6.95,-1.91,-6.934761395990396
CCC(CC)C(=O)/N=C1/S[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc2c(c1)OCO2,C05377346_decoy,CASP3,Decoy,0,-7.12003,-5.44,-0.57,-5.9459970119424
O=C(c1cc2c(s1)CCCC2)N1CCN(c2ncccc2-c2nnc(C3CC3)o2)CC1,C65118194_decoy,CASP3,Decoy,0,-8.52338,-7.41,-1.45,-6.771670681187521
CC1=C(c2ccc(C)c(C)c2)S(=O)(=O)N=C1N1CCCN(C(=O)[C@@H]2CCOC2)CC1,C65239486_decoy,CASP3,Decoy,0,-7.34209,-8.16,-0.76,-5.498460064331283
CC(C)c1noc(-c2cccnc2N2CCCN(C(=O)c3ccccc3F)CC2)n1,C65258037_decoy,CASP3,Decoy,0,-7.2147,-6.92,-2.32,-6.485261953394175
CC[C@@H](C)n1ncc2c(C(=O)N3CCCN(C(=O)C(C)(C)C)CC3)cc(C)nc21,C66727790_decoy,CASP3,Decoy,0,-7.03756,-5.34,-1.83,-5.895744299348681
COc1ccc(-c2cc(C(F)F)n3ncc(C(=O)N4CCN(c5cccc(Cl)c5)CC4)c3n2)cc1,C00649082_decoy,CASP3,Decoy,0,-8.15384,-6.51,-0.36,-6.146190789925942
O=CC12c3ccccc3C(c3ccccc31)[C@@H]1C(=O)N(c3ccc(Br)cc3[N+](=O)[O-])C(=O)[C@@H]12,C08426001_decoy,CASP3,Decoy,0,-6.19935,-6.34,-3.19,-4.578522124332404
Cc1c(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(=O)oc2c(C)c3oc4c(c3cc12)CCCC4,C08877690_decoy,CASP3,Decoy,0,-7.53813,-9.49,-0.69,-5.850894885673932
CS(=O)(=O)c1nc(S(=O)(=O)c2ccc(Cl)cc2)c(N2CCN(c3ccccc3)CC2)s1,C08912358_decoy,CASP3,Decoy,0,-9.99053,-8.05,-2.86,-10.714163244174022
Cc1c(-n2c(/C=C/c3cn(C)c4ccccc34)nc3ccccc3c2=O)c(=O)n(-c2ccccc2)n1C,C09185212_decoy,CASP3,Decoy,0,-7.12925,-7.79,-2.68,-4.826331233473616
Cc1nnc(N2CCC[C@H](C(=O)N3CCc4ccccc43)C2)c2nn(-c3ccc(Cl)cc3)c(C)c12,C09224374_decoy,CASP3,Decoy,0,-9.16304,-7.46,-4.67,-6.389626446244382
C[C@H]1CCc2sc(-c3nnc(SCC(=O)N4CCC[C@@H]4c4ccc5c(c4)OCCO5)o3)cc2C1,C09665329_decoy,CASP3,Decoy,0,-9.55061,-8.17,-2.91,-6.308371898096783
O=c1c(Cl)c(N2CCN(c3nc(C(F)(F)F)nc4ccccc34)CC2)cnn1-c1ccccc1,C09741525_decoy,CASP3,Decoy,0,-6.31666,-8.3,-1.44,-5.321880246434314
C[C@@H]1Cc2ccccc2N1C(=O)CSc1nc2nn(-c3ccccc3)c(=O)c-2c2n1CCCCC2,C09965575_decoy,CASP3,Decoy,0,-6.85774,-7.93,-0.72,-5.979802186272929
O=C(Cn1cnc2c(cnn2-c2ccccc2Cl)c1=O)N1c2ccccc2CCc2ccccc21,C01330945_decoy,CASP3,Decoy,0,-7.83687,-6.64,-1.84,-6.72326331531563
O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCN(c2c(F)c(F)c(Cl)c(F)c2F)CC1,C13946241_decoy,CASP3,Decoy,0,-7.19561,-7.41,-0.5,-8.369821538367914
Cc1ccc(Cn2cc(-n3c(S)nnc3-c3nn(C)c(C(F)(F)F)c3Br)cn2)cc1,C02808457_decoy,CASP3,Decoy,0,-10.0038,-6.34,-0.53,-7.288713273180097
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCC2(CC1)SCCN2C(=O)c1cccc(Br)c1,C16491916_decoy,CASP3,Decoy,0,-4.31593,-6.78,-0.94,-4.515658882088229
O=C(C1CCN(c2ncnc3c2sc2ncccc23)CC1)N1CCN(c2ccc(Cl)cc2)CC1,C16842233_decoy,CASP3,Decoy,0,-9.83172,-7.24,-1.46,-5.524448682642157
Cc1c(C(=O)N2CC[C@@H]3CCCC[C@H]3C2)sc2ncnc(N3CCC(N4CCOCC4)CC3)c12,C23128644_decoy,CASP3,Decoy,0,-9.58217,-6.37,-1.11,-6.209821513552242
O=C([C@H]1CN(C(=O)Cc2csc(-c3ccccc3Cl)n2)c2ccccc2O1)N1CCOCC1,C24283032_decoy,CASP3,Decoy,0,-8.06413,-7.49,-1.74,-5.087776462738643
O=C(c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1)N1CCO[C@@H](c2ccc(F)cc2)C1,C29116564_decoy,CASP3,Decoy,0,-8.26085,-7.4,0.12,-6.061995035272493
Cc1cccc(N2CCN(C(=O)[C@H]3CN(S(C)(=O)=O)c4cc(C(C)(C)C)ccc4O3)CC2)c1C,C30945029_decoy,CASP3,Decoy,0,-7.46576,-9.18,-2.45,-5.87253834169029
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2,C32551474_decoy,CASP3,Decoy,0,-8.19416,-8.29,-4.53,-7.779868762473887
O=[N+]([O-])c1ccc(CSC2=N[C@H]3CS(=O)(=O)C[C@@H]3N2c2ccc(Br)cc2F)cc1,C32640670_decoy,CASP3,Decoy,0,-9.13978,-8.55,-3.29,-8.942278475372936
CC1CCN(c2nccnc2Oc2ccc(C(=O)N3CCN(c4ccccc4Cl)CC3)cc2)CC1,C33296725_decoy,CASP3,Decoy,0,-7.00615,-7.46,-3.42,-5.614385999241788
Cc1ccc2nc(N3C[C@@H](C)O[C@H](C)C3)c(/C=C3/SC(=S)N(C4CCCCC4)C3=O)c(=O)n2c1,C33446163_decoy,CASP3,Decoy,0,-7.10487,-8.47,-1.99,-4.749969663307375
CC(C)(C)c1ccc(C(=O)N2CCN(Cc3cc(=O)n4nc(-c5ccccc5)sc4n3)CC2)cc1,C35509613_decoy,CASP3,Decoy,0,-8.20126,-7.59,-0.84,-5.915260871120136
CCOc1ccc([C@@H]2c3c(oc4ccc(Cl)cc4c3=O)C(=O)N2c2nc(C)c(C)s2)cc1OC,C35513884_decoy,CASP3,Decoy,0,-9.56713,-6.51,-4.64,-6.188776059261588
CCOc1ccc([C@H]2c3c(oc4ccc(Cl)cc4c3=O)C(=O)N2c2nc(C)c(C)s2)cc1OC,C35513885_decoy,CASP3,Decoy,0,-7.56742,-7.23,-2.93,-5.874553346528256
COc1cc(OC)cc(C(=O)N2CCN(c3nc(C4CC4)nc4sc5c(c34)CC[C@@H](C)C5)CC2)c1,C35525000_decoy,CASP3,Decoy,0,-8.5118,-5.92,-2.64,-5.6187285610801405
O=C([C@@H]1Cc2ccccc2N2CCN(c3cnccn3)C[C@H]12)N1CCN(c2cccc(Cl)c2)CC1,C35894296_decoy,CASP3,Decoy,0,-9.73952,-7.91,-3.63,-7.437215355425633
O=C(c1ccc(Cl)cc1)N1CCN(c2nc(C3CC3)nc3c2cnn3-c2ccccc2Cl)CC1,C35992341_decoy,CASP3,Decoy,0,-9.30723,-6.47,-1.96,-6.287334678145835
Cc1nc(N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c2c(C)nn(-c3ccccc3Cl)c2n1,C36000425_decoy,CASP3,Decoy,0,-9.19286,-7.44,-2.29,-7.0781551743920845
CN1c2ncnc(Cl)c2/N=C(\Br)Cc2cc(F)cc(S(=O)(=O)Oc3ccccc3)c21,C39479953_decoy,CASP3,Decoy,0,-8.69064,-7.05,-1.44,-6.0719520849003175
O=C(CSc1nc2ccccc2c2nc3ccccc3n12)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1,C12628219_decoy,CASP3,Decoy,0,-7.19617,-7.2,-2.22,-6.422647985326398
Cc1ccc(CN2C(=O)/C(=C\c3c(N4C[C@@H](C)O[C@@H](C)C4)nc4ccc(C)cn4c3=O)SC2=S)cc1,C33469196_decoy,CASP3,Decoy,0,-8.2814,-7.03,-4.32,-6.503224803393067
CC(=O)O[C@@H]1C[C@H]2C(C)(C)C=CC(=O)[C@]2(C)[C@H]2CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@@H]4O[C@@]43[C@@]21C,C03978208_decoy,CASP3,Decoy,0,-7.60576,-8.71,-1.21,-6.697796745242843
O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCO3)SC(=S)N1Cc1ccco1,C39850207_decoy,CASP3,Decoy,0,-8.66375,-6.95,-1.27,-7.557620905191358
O=C1c2oc3ccc(F)cc3c(=O)c2[C@H](c2cccc([N+](=O)[O-])c2)N1c1cccc(Br)c1,C39875782_decoy,CASP3,Decoy,0,-6.75802,-6.93,-2.97,-4.661877552721496
Cc1ccc2nc(Oc3ccccc3F)c(/C=C3\SC(=S)N(Cc4ccco4)C3=O)c(=O)n2c1,C39999238_decoy,CASP3,Decoy,0,-9.13149,-7.98,-2.38,-7.008900662939191
Cc1ccc2nc(Oc3cccc(C)c3C)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(=O)n2c1,C39999298_decoy,CASP3,Decoy,0,-8.55976,-8.48,-4.54,-7.155284415821205
O=C(C1CCN(c2ccc(-c3noc(C4CC4)n3)cc2F)CC1)N1CCN(C2CCCCC2)CC1,C40901849_decoy,CASP3,Decoy,0,-9.73846,-6.76,-2.99,-7.215702216034752
CC(=O)c1ccc(N2CCN(C(=O)C3CCN(c4ccc(-c5ccc(F)cc5)nn4)CC3)CC2)cc1,C40919393_decoy,CASP3,Decoy,0,-8.55929,-5.82,-3.32,-4.900458555133388
CC(=O)O[C@@H]1C[C@@H]2C(C)(C)C=CC(=O)[C@@]2(C)[C@@H]2CC[C@]3(C)[C@H](c4ccoc4)OC(=O)[C@@H]4O[C@@]43[C@@]12C,C43721414_decoy,CASP3,Decoy,0,-7.908,-6.99,-1.51,-6.081679412227564
CC(=O)O[C@@H]1C[C@@H]2C(C)(C)C(=O)[C@@H]3O[C@@H]3[C@@]2(C)[C@H]2CC[C@@]3(C)C(=CC(=O)O[C@H]3c3ccoc3)[C@@]12C,C43721492_decoy,CASP3,Decoy,0,-8.22043,-6.28,-3.12,-5.755838928478405
CC(C)(C)c1ccc2c(c1)N(S(C)(=O)=O)C[C@@H](C(=O)N1CCN(c3cccc(Cl)c3)CC1)O2,C44786984_decoy,CASP3,Decoy,0,-9.2802,-8.32,-1.95,-6.051724921292795
Cc1c(C(=O)N2CCN(C(=O)C(C)(C)c3ccccc3)CC2)sc2nc3n(c(=O)c12)CCCCC3,C46577101_decoy,CASP3,Decoy,0,-7.44734,-7.33,-1.04,-5.471897037401089
Cc1ccc(-n2c(-c3ccccc3)cnc2SCc2nnc3n(C)c(=O)c4sccc4n23)cc1,C46850101_decoy,CASP3,Decoy,0,-6.51149,-7.02,-1.81,-5.269544298218249
Cc1c(C(=O)N(Cc2ccc(N3CCCCC3)o2)[C@@H]2CCS(=O)(=O)C2)oc2ccc(Cl)cc12,C47132043_decoy,CASP3,Decoy,0,-10.1053,-6.74,-2.36,-7.638156249045347
O=C(c1ccc2c(c1)OCO2)[C@@H]1[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@H]2c3ccccc3C=CN12,C15989674_decoy,CASP3,Decoy,0,-8.67386,-7.22,-1.3,-6.243501544734213
O=C(c1ccc2c(c1)OCO2)[C@H]1[C@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@H]2c3ccccc3C=CN21,C49916776_decoy,CASP3,Decoy,0,-8.81614,-7.58,-1.38,-7.244506356206645
O=c1cc(-c2cc3cc(Br)ccc3oc2=O)c2ccc3c(c2o1)CN(C[C@H]1CCCO1)CO3,C41663933_decoy,CASP3,Decoy,0,-9.07623,-8.4,-1.85,-5.387856722247389
COC(=O)c1sc2nc(C)nc(SCC3=NC(=O)C4=C5CC[C@@H](C)C[C@H]5SC4=N3)c2c1C,C39945280_decoy,CASP3,Decoy,0,-9.78447,-6.86,-1.27,-6.392172687083432
O=C(CN1C(c2ccccc2)=C[C@@H](c2ccc(Cl)cc2)n2nnnc21)N1CCc2ccccc2C1,C64793590_decoy,CASP3,Decoy,0,-6.69515,-7.38,-1.2,-5.20658500014381
COc1ccccc1N(Cc1cc(=O)n2ccsc2n1)S(=O)(=O)c1ccc(Cl)c(Cl)c1,C03357681_decoy,CASP3,Decoy,0,-8.48782,-6.83,-2.84,-7.953814343797929
O=C1c2ccccc2S(=O)(=O)N1CCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1,C08641495_decoy,CASP3,Decoy,0,-8.08144,-8.74,-2.23,-7.858972552955469
CC(C)c1cccc2sc(N3CCN(C(=O)C4CCN(S(=O)(=O)c5cccs5)CC4)CC3)nc12,C09034724_decoy,CASP3,Decoy,0,-10.7042,-6.29,-2.02,-7.4561106800968275
CCOC(=O)CCn1/c(=N/C(=O)c2ccccc2Br)sc2cc3c(cc21)OCCO3,C09586893_decoy,CASP3,Decoy,0,-9.5307,-7.22,-2.51,-7.497163364904851
C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)C1,C09665337_decoy,CASP3,Decoy,0,-6.89246,-7.81,-4.38,-6.0879326617087415
O=C(Cn1cc(S(=O)(=O)CC(=O)N2CCCc3ccccc32)c2ccccc21)N1CCCCCC1,C09519786_decoy,CASP3,Decoy,0,-8.16083,-7.84,-2.0,-7.26011936568552
C[C@@H]1CCc2c(sc3nc(C4CC4)nc(SCC(=O)N4CCN(C(=O)c5ccco5)CC4)c23)C1,C01377337_decoy,CASP3,Decoy,0,-9.69132,-7.6,-3.44,-6.838353784410505
CN1C(=CC(=O)CSc2nnc(N3CCOCC3)n2-c2cccc(F)c2)C(C)(C)c2ccccc21,C12741393_decoy,CASP3,Decoy,0,-8.44643,-7.33,-2.73,-7.532902621050784
COc1cc2nc(-c3cc4c(c(OC)c3)OCCN(C(=O)/C=C/c3cccs3)C4)cc(C)c2cc1OC,C12152039_decoy,CASP3,Decoy,0,-9.38302,-8.32,-1.23,-7.374044892394848
Cc1cc(C)cc(N2C[C@@H](C(=O)Oc3cccc(N4C(=O)[C@H]5[C@@H]6C=C[C@@H]([C@@H]7C[C@H]67)[C@@H]5C4=O)c3)CC2=O)c1,C13857072_decoy,CASP3,Decoy,0,-8.62606,-8.72,-1.61,-2.45935628180063
Cn1c2c(cc(-c3ccc(OC(F)(F)F)cc3)c1=O)CN(C(=O)c1ccc(-n3cccn3)cc1)CC2,C14748429_decoy,CASP3,Decoy,0,-6.57616,-6.02,-1.86,-4.774126879519014
COc1cccc(N2CCN(c3nccn4nc(-c5ccc(Br)cc5)c(C=O)c34)CC2)c1,C15829458_decoy,CASP3,Decoy,0,-8.50576,-6.2,-0.97,-5.5125063883295855
Cc1ccc(-n2nnnc2-c2cn(CC(=O)c3ccc(Br)cc3)c3ccccc3c2=O)cc1,C16311488_decoy,CASP3,Decoy,0,-8.17178,-9.22,-4.58,-8.149037051740514
COc1cccc(-c2nnc(SCc3nc(C(=O)N4CCCC4)cs3)n2-c2ccc(C)cc2)c1,C16460746_decoy,CASP3,Decoy,0,-8.99226,-7.58,-0.27,-8.19956563148672
CCN(CC(=O)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1Cl)C(=O)c1cccc([N+](=O)[O-])c1,C16528850_decoy,CASP3,Decoy,0,-7.99353,-7.94,-3.97,-6.962740444015027
CC1CCN(C(=O)CN2CN(c3ccccc3)C3(CCN(C(=O)/C=C/c4ccccc4)CC3)C2=O)CC1,C16647447_decoy,CASP3,Decoy,0,-8.32383,-7.57,-1.04,-6.7573351786804725
CCCn1nnnc1CSC1=N/C(=C\c2ccc(Cl)c(Cl)c2)C(=O)N1c1ccccc1F,C18423450_decoy,CASP3,Decoy,0,-8.22885,-6.21,-4.01,-6.640426177414507
CC[C@H](C(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1)n1c2ccccc2c2nc(=O)cc(C)n21,C20464945_decoy,CASP3,Decoy,0,-6.96875,-6.8,-2.15,-5.075571779412225
C[C@@H]1CCc2c(sc3nc(SCC(=O)c4ccc5c(c4)OCO5)n(C[C@@H]4CCCO4)c(=O)c23)C1,C22214336_decoy,CASP3,Decoy,0,-9.72037,-6.73,-2.74,-6.642680405672931
CC(C)n1ncc2c(C(=O)N3CCN(c4ncc(C(F)(F)F)cc4Cl)CC3)cc(C3CC3)nc21,C23967958_decoy,CASP3,Decoy,0,-8.25815,-6.8,-2.57,-5.647866937725574
Brc1ccccc1-c1nnc(CSc2nnc(N3CCCCC3)n2-c2ccccc2)o1,C26676973_decoy,CASP3,Decoy,0,-9.21481,-7.61,-0.62,-6.429718623564599
CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1,C26687945_decoy,CASP3,Decoy,0,-8.73705,-5.43,-4.64,-4.776048367879622
CS(=O)(=O)N1CC[C@@H](C(=O)N2CCN(C/C=C/c3ccccc3)CC2)Oc2ccc(Cl)cc21,C30944747_decoy,CASP3,Decoy,0,-8.95175,-6.93,-2.02,-6.034430042594227
O=C(c1ccc(CN2C(=O)COc3ccccc32)o1)N1CCN(C(c2ccccc2)c2ccccc2)CC1,C16532935_decoy,CASP3,Decoy,0,-9.08417,-8.11,-2.65,-7.169930528720864
Cc1ccccc1Cn1c2ccccc2c2nnc(SCCCC(=O)N3C[C@H](C)O[C@@H](C)C3)nc21,C35156573_decoy,CASP3,Decoy,0,-7.45757,-7.84,-0.7,-6.1664671163985405
C=CCn1c(SCc2nc(C(=O)N3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)co2)nc2scc(C)c2c1=O,C35497829_decoy,CASP3,Decoy,0,-8.42699,-7.02,-4.73,-5.352573430939741
CCCC(=O)N1CCN(C(=O)c2cnn(-c3nc(-c4ccc(Cl)cc4)cs3)c2C(C)C)C[C@@H]1C,C00962506_decoy,CASP3,Decoy,0,-7.45273,-6.34,-2.02,-5.314709865717207
O=C(c1ccccc1F)N1CCN(c2nc(Cc3ccccc3)nc3c2cnn3-c2ccccc2)CC1,C35908290_decoy,CASP3,Decoy,0,-7.33212,-7.25,-1.57,-6.070060394845007
CCOC(=O)C1CCN(C(=O)[C@H](C)Sc2nc3sc4c(c3c(=O)n2CC)CC[C@@H](C)C4)CC1,C36801324_decoy,CASP3,Decoy,0,-8.60038,-6.02,-1.52,-6.123571474005411
Cc1cc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)S(=O)(=O)c2ccccc2)ccc1Cl,C02425196_decoy,CASP3,Decoy,0,-7.7294,-7.3,-2.84,-7.0735263893598095
Cc1ccc(-c2csc3ncn(CC(=O)N(C4CCCC4)[C@@H]4CCS(=O)(=O)C4)c(=O)c23)cc1C,C08943498_decoy,CASP3,Decoy,0,-9.81719,-6.28,-0.89,-7.414918363884764
CN(C[C@@H]1N=NC2=C1CCCCC2)C(=O)C[C@@]1(c2ccccc2F)CC(=O)N(C2CCCCC2)C1=O,C39371901_decoy,CASP3,Decoy,0,-7.66761,-7.67,-2.6,-7.023612478494652
CCOc1c2c(n(S(=O)(=O)Oc3ccccc3)c1C)-c1nccc(Br)c1C(=O)CC2,C39459025_decoy,CASP3,Decoy,0,-8.68874,-6.42,-0.21,-7.0471447078582825
CCCn1c(N2C[C@@H](C)O[C@@H](C)C2)c(/C=C2/SC(=S)N(C3CCCC3)C2=O)c(C)c(C#N)c1=O,C39770428_decoy,CASP3,Decoy,0,-8.23006,-6.48,-0.96,-6.29826713426519
CCCn1c(N2C[C@@H](C)O[C@H](C)C2)c(/C=C2/SC(=S)N(C3CCCC3)C2=O)c(C)c(C#N)c1=O,C39770430_decoy,CASP3,Decoy,0,-7.55985,-5.61,-2.01,-6.162385172924651
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@H]4CCCO4)C3=O)c(Oc3ccc(F)cc3)nc12,C39835979_decoy,CASP3,Decoy,0,-9.00483,-6.86,-1.49,-6.51024397438736
O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCCO3)SC(=S)N1Cc1ccco1,C39850188_decoy,CASP3,Decoy,0,-7.03737,-6.56,-3.07,-5.336439033329458
Cc1ccc2nc(Oc3ccccc3F)c(/C=C3\SC(=S)N(C[C@H]4CCCO4)C3=O)c(=O)n2c1,C39999237_decoy,CASP3,Decoy,0,-8.51843,-6.86,-1.18,-6.892697520261406
O=C1/C(=C/c2c(Oc3ccc(Cl)cc3)nc3ccccn3c2=O)SC(=S)N1C[C@H]1CCCO1,C40221184_decoy,CASP3,Decoy,0,-9.46144,-6.26,-1.95,-6.236552151371247
CCOC(=O)C1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n(-c3ccc4c(c3)OCO4)c2C)CC1,C40373986_decoy,CASP3,Decoy,0,-8.84187,-6.77,-2.12,-6.8093711988284085
COc1ccc(-n2nc(C(F)(F)F)c3c2C(=O)N(c2ccc(C4(N5CCCCC5=O)CC4)cc2)CC3)cc1,C40873729_decoy,CASP3,Decoy,0,-7.94203,-6.94,-2.91,-5.923380464612489
CC[C@H](C(=O)N1CCN(Cc2cc(=O)n3nc(-c4ccccc4F)sc3n2)CC1)c1ccccc1,C41077467_decoy,CASP3,Decoy,0,-9.11351,-6.62,-3.06,-5.96440606453423
Cc1ccc2nc3c(c(C(=O)OCC(=O)N(C4CCCCC4)[C@H]4CCS(=O)(=O)C4)c2c1)CCCC3,C22665735_decoy,CASP3,Decoy,0,-9.59325,-8.42,-2.64,-7.9480836972308655
COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1c3ccccc3C=CN1[C@@H]2C(=O)c1ccc(Cl)cc1,C36003732_decoy,CASP3,Decoy,0,-8.08414,-6.85,-0.9,-6.233608615360666
CCN(C(=O)c1cc(-c2ccccc2F)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1)C1CCCCC1,C57309559_decoy,CASP3,Decoy,0,-7.98797,-6.67,-2.21,-6.265008801040895
COC(=O)c1ccc(Cl)c(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1,C59333130_decoy,CASP3,Decoy,0,-9.24836,-7.24,-3.85,-8.694776809051094
CCOC(=O)c1c(N2C(=O)[C@@H]3[C@H](ON(c4ccccc4C)[C@H]3c3ccccc3)C2=O)sc(C)c1C,C08741708_decoy,CASP3,Decoy,0,-6.81893,-6.82,-3.38,-5.79647603382209
CC1=NC(C)=C(C(=O)N2CCCCC2)[C@H]1S(=O)(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1,C63652654_decoy,CASP3,Decoy,0,-7.19838,-7.92,-1.61,-6.592339774354641
COc1ccc(C(=O)[C@H]2[C@@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@H]3c4ccccc4C=CN32)cc1OC,C15988982_decoy,CASP3,Decoy,0,-8.14258,-7.39,-3.6,-7.24706867967121
CCOc1ccc(-c2cc3c(SCC(=O)N4CCN(c5ccccc5F)CC4)nccn3n2)cc1,C67290490_decoy,CASP3,Decoy,0,-8.00649,-6.19,-2.3,-6.217598579543084
CC(C)N1C(=O)C(=O)N(CC(=O)N2N=C3/C(=C/c4cccs4)CCC[C@@H]3[C@H]2c2cccs2)C1=O,C08855881_decoy,CASP3,Decoy,0,-6.50546,-7.15,-3.43,-4.50065888179668
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)/C=C/c1cc(Cl)c2c(c1)OCCCO2,C09415177_decoy,CASP3,Decoy,0,-8.34275,-8.61,-2.29,-6.846670226506457
C[C@@H]1CCc2c(sc3nc(SCC(=O)N(CCC#N)CCC#N)n(Cc4ccco4)c(=O)c23)C1,C09533215_decoy,CASP3,Decoy,0,-9.53638,-5.28,-5.37,-7.517945674535738
C[C@@H]1CN(C(=O)Cn2cc(S(=O)(=O)CC(=O)N3CCc4ccccc43)c3ccccc32)C[C@@H](C)O1,C10459883_decoy,CASP3,Decoy,0,-7.92407,-7.68,-0.6,-6.7500881658129845
Cc1cc(C)cc(N(CCC#N)C(=O)COC(=O)c2sc3nc4n(c(=O)c3c2C)CCCCC4)c1,C11061604_decoy,CASP3,Decoy,0,-7.88736,-8.26,-2.38,-7.360605951440167
N#CCCN(C(=O)COC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)c1ccccc1F,C11368662_decoy,CASP3,Decoy,0,-8.94473,-7.24,-3.49,-7.838048263572169
O=C(CSc1nccn1-c1cccc(Cl)c1)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1,C12525199_decoy,CASP3,Decoy,0,-8.43564,-6.39,-2.01,-7.26704831027566
COc1ccc(/C=c2\s/c(=C(/C#N)c3nnc4n3CCCCC4)n(-c3ccccc3)c2=O)cc1OC,C13306470_decoy,CASP3,Decoy,0,-7.72078,-7.6,-3.13,-6.049702331464496
Cc1ccc(-c2cc3c(c(OC[C@@H]4CCCCO4)c2)OCCN(C(=O)c2cnn4cccnc24)C3)s1,C14987840_decoy,CASP3,Decoy,0,-10.2424,-7.32,-3.22,-8.29883258441831
Cc1cc(C(=O)N2CCN(S(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)ccc1[N+](=O)[O-],C15937702_decoy,CASP3,Decoy,0,-5.48664,-6.77,-1.41,-4.927546485251062
COc1ccc(-c2cc(C(=O)N3CCN(C(C)=O)CC3)n(-c3ccc(Cl)c(Cl)c3)n2)c(OC)c1,C16573397_decoy,CASP3,Decoy,0,-8.9758,-6.44,-1.94,-6.82406423823579
Cc1ccc(CN(Cc2ccc3c(c2)OCO3)C(=O)CN(C[C@@H]2CCCO2)C(=O)c2cccc(Cl)c2)o1,C16649980_decoy,CASP3,Decoy,0,-8.18286,-6.88,-3.95,-7.003925384254884
Cc1cc(C)c2c(-c3ccccc3)nc(SCC(=O)N3CCN([C@H]4CCS(=O)(=O)C4)CC3)n2n1,C19355061_decoy,CASP3,Decoy,0,-8.44247,-7.44,-2.13,-6.106384777514039
CC1(C)Cc2c(c(N3CCOCC3)nc3sc4c(SCCN5CCOCC5)ncnc4c23)CO1,C20358263_decoy,CASP3,Decoy,0,-10.2836,-5.92,-1.17,-6.004584524869142
COc1ccc(C)cc1-n1c(SCC(=O)N(CCC#N)CCC#N)nc2cc(Cl)ccc2c1=O,C09415411_decoy,CASP3,Decoy,0,-8.29447,-6.33,-3.77,-8.390981050694636
Cc1cccc(-n2c(S[C@@H](C)C(=O)N3CCN(c4ccccc4)CC3)nnc2N2CCOCC2)c1,C21621056_decoy,CASP3,Decoy,0,-9.08529,-7.04,-2.32,-7.1004952506807015
O=C(c1cn(-c2ccccc2)nc1-c1cccs1)N1CCN(S(=O)(=O)N2CCCCCC2)CC1,C22200642_decoy,CASP3,Decoy,0,-8.00973,-5.87,-5.27,-6.48811828616731
CCn1c(CCC(=O)N(C)Cc2ccccc2N2CCCC2)nc2cc(S(=O)(=O)N(C)C)ccc21,C24190797_decoy,CASP3,Decoy,0,-9.16218,-7.13,-0.83,-7.034765603727839
COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)CN1C(=O)N(C)C3(CCCCC3)C1=O)CC2,C24591714_decoy,CASP3,Decoy,0,-9.8164,-7.84,-0.97,-10.158374598301329
Cc1ccc(N(CCC#N)C(=O)CSc2nnc(N3CCOCC3)n2Cc2ccccc2)cc1C,C24789366_decoy,CASP3,Decoy,0,-8.51616,-6.66,-3.48,-7.637557681463833
Brc1ccccc1-c1nnc(CSc2nnc(N3CCOCC3)n2-c2ccccc2)o1,C26226484_decoy,CASP3,Decoy,0,-8.81248,-6.37,-0.62,-6.964945353330691
Cc1cc(C)c(/C=C/c2onc(C)c2S(=O)(=O)N2CCC[C@H](C(=O)N3CCN(C)CC3)C2)c(C)c1,C33250936_decoy,CASP3,Decoy,0,-7.91797,-8.66,-2.84,-7.310973412558742
CC[C@H]1SC2=NC(C)=C(C(=O)OCc3ccccc3)[C@@H](c3ccc(OC(C)=O)c(OC)c3)N2C1=O,C33423355_decoy,CASP3,Decoy,0,-7.70135,-5.03,-2.45,-5.772882690270476
O=C(CN(C[C@@H]1CCCO1)C(=O)c1ccccc1F)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C33705255_decoy,CASP3,Decoy,0,-7.61572,-6.37,-2.28,-7.159015079065568
C[C@@H]1CN(C(=O)CN2CCc3sccc3[C@@H]2c2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1,C34829588_decoy,CASP3,Decoy,0,-7.46691,-6.48,-3.17,-6.424270400528341
C[C@H]1CN(C(=O)CN2CCc3sccc3[C@@H]2c2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1,C34829589_decoy,CASP3,Decoy,0,-9.44574,-6.63,-2.68,-6.279917048003452
COC(=O)c1c(C(=O)N2CCN(C(=O)c3ccccc3Br)[C@@H](C)C2)nc(C)nc1C(C)C,C35176346_decoy,CASP3,Decoy,0,-8.02409,-6.31,-2.79,-6.151841200443466
COc1cc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nncs2)ccc1OCc1ccccc1,C35490378_decoy,CASP3,Decoy,0,-8.92876,-6.19,-1.17,-6.774562629738652
CCN1CCN(C(=O)Cc2csc3nc(C)c(-c4cc(C)n(-c5cccc(C)c5)n4)c(=O)n23)CC1,C35911866_decoy,CASP3,Decoy,0,-8.15458,-6.73,-2.98,-5.587015035203746
COc1ccccc1OC[C@@H]1c2ccsc2CCN1C(=O)CN(C[C@@H]1CCCO1)C(=O)c1ccco1,C36118127_decoy,CASP3,Decoy,0,-8.45476,-6.6,-4.66,-7.705239238859013
COc1ccccc1OC[C@H]1c2ccsc2CCN1C(=O)CN(C[C@H]1CCCO1)C(=O)c1ccco1,C36118137_decoy,CASP3,Decoy,0,-8.40717,-6.94,-3.98,-8.354632621141315
CCCN(C(=O)c1cc(S(=O)(=O)N(C)c2ccc(OCC)cc2)ccc1C)[C@@H]1CCS(=O)(=O)C1,C12548755_decoy,CASP3,Decoy,0,-7.80917,-8.45,-4.02,-8.343223877907697
CCOc1ccc([C@H]2c3c(oc4c(C)cc(C)cc4c3=O)C(=O)N2[C@@H]2CCS(=O)(=O)C2)cc1OC,C38648833_decoy,CASP3,Decoy,0,-8.66543,-7.12,-1.29,-6.799405405854653
CCOc1ccc([C@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2[C@@H]2CCS(=O)(=O)C2)cc1OC,C38649009_decoy,CASP3,Decoy,0,-9.10208,-7.92,-2.59,-8.00673908289638
COc1ccc(N2CCN(C(=O)c3cnc4c(c(C)nn4-c4ccc(OC)cc4)c3Cl)CC2)cc1,C39705278_decoy,CASP3,Decoy,0,-8.25511,-5.93,-1.06,-7.616364993560373
CCOC(=O)[C@H]1CCCN(c2c(/C=C3/SC(=S)N([C@H](C)CC)C3=O)c(C)c(C#N)c(=O)n2CC)C1,C39769468_decoy,CASP3,Decoy,0,-8.39335,-7.05,-2.42,-7.68003101236593
CCCn1c(N2C[C@@H](C)O[C@@H](C)C2)c(/C=C2/SC(=S)N(CCCOCC)C2=O)c(C)c(C#N)c1=O,C39770422_decoy,CASP3,Decoy,0,-7.83051,-6.26,-2.17,-6.340043182039559
COc1cc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2ccc(Cl)cn2)cc(OC)c1OC,C02406534_decoy,CASP3,Decoy,0,-8.2043,-6.18,-1.9,-5.912011530727471
O=C(CN1CCN(C(=O)C2CCN(c3ccc(-c4cccc(Cl)c4)nn3)CC2)CC1)N1CCCC1,C40919561_decoy,CASP3,Decoy,0,-9.29092,-7.01,-1.48,-8.410667640173443
O=C(c1nn([C@@H]2CCS(=O)(=O)C2)c2c1CCCC2)N(Cc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1,C40987675_decoy,CASP3,Decoy,0,-9.56344,-6.66,-1.69,-8.377752079533549
O=C(c1nn([C@H]2CCS(=O)(=O)C2)c2c1CCCC2)N(Cc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1,C40987677_decoy,CASP3,Decoy,0,-8.12511,-8.56,-2.63,-7.486278899116694
COc1ccc(CN(C(=O)CCc2ncc(-c3ccc(C)cc3)o2)[C@@H]2CCS(=O)(=O)C2)cc1OC,C41020520_decoy,CASP3,Decoy,0,-8.47493,-7.82,-1.47,-6.654838698178784
COc1cccc(C(=O)N2CCN(Cc3cc(=O)n4nc(-c5ccc(Cl)cc5)sc4n3)CC2)c1,C41077503_decoy,CASP3,Decoy,0,-10.1366,-8.79,-1.73,-6.922898452804042
C[C@@H]1CCc2c(sc3nc(SCCn4nc5ccccn5c4=O)n(C[C@H]4CCCO4)c(=O)c23)C1,C45705514_decoy,CASP3,Decoy,0,-9.19506,-5.71,-1.82,-6.072280174573164
COc1ccc(-c2cc(C(=O)N3CCC[C@@H](c4nnc5ccccn45)C3)c3ccccc3n2)cc1OC,C45865665_decoy,CASP3,Decoy,0,-7.61684,-9.99,-2.82,-7.871856963891766
N#C[C@@H]1C(=O)N=C(SCCSC2=NC(=O)[C@H](C#N)C3(CCCC3)[C@@H]2C#N)[C@@H](C#N)C12CCCC2,C55484427_decoy,CASP3,Decoy,0,-9.40218,-7.12,-2.61,-7.554668390652429
C=CCn1c(SCC(=O)N2CCN(c3ccccc3)CC2)nnc1[C@@H]1CCCN1C(=O)c1cccc(C)c1,C59180201_decoy,CASP3,Decoy,0,-9.34185,-6.98,-1.94,-6.002461848578889
CCn1cc(/C=C2\Oc3c(cc4c(c3C)OCN(CCN3CCOCC3)C4)C2=O)c2cc(OC)ccc21,C41589242_decoy,CASP3,Decoy,0,-9.50299,-7.23,-0.93,-6.299710811049881
COc1cccc(C(=O)N2CCN(Cc3cc(=O)n4nc(-c5cccc(Cl)c5)sc4n3)CC2)c1,C46031759_decoy,CASP3,Decoy,0,-8.68217,-8.01,-1.26,-9.384557823758325
Cc1cccc(-n2c(SCCS(C)(=O)=O)nnc2[C@@H]2CN(CCS(C)(=O)=O)c3ccccc32)c1,C65551750_decoy,CASP3,Decoy,0,-10.2229,-6.82,-0.58,-8.174851984964077
Cc1nc(Cl)c([N+](=O)[O-])c(N2CCCCCC2)n1,C04350960_decoy,CASP3,Decoy,0,-6.49817,-5.09,-0.04,-5.380349126858716
Cc1cccc(-c2nnc3sc(-c4cnccn4)nn23)c1,C04511674_decoy,CASP3,Decoy,0,-6.69645,-5.36,-0.57,-4.497862729104302
Cc1ccc2onc(Cc3nn4c(C)nnc4s3)c2c1,C00385463_decoy,CASP3,Decoy,0,-7.23845,-5.72,-0.83,-4.9275358534739055
Cc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(C)c2)o1,C05173033_decoy,CASP3,Decoy,0,-4.2416,-6.42,-1.72,-4.743373905310753
CCc1nnc(-n2nc(C)cc2C)n1/N=C/c1ccccc1,C03152542_decoy,CASP3,Decoy,0,-6.65618,-6.99,-1.31,-6.208756904845891
N#Cc1ccccc1Oc1nnnn1-c1ccccc1,C03426823_decoy,CASP3,Decoy,0,-4.54855,-6.13,-0.31,-4.670036228390081
Cc1ccc2nc(COC(=O)c3ccoc3C)cc(=O)n2c1,C07848940_decoy,CASP3,Decoy,0,-6.17793,-5.22,-0.65,-4.844641475342654
COc1cc2c(cc1OC)C(C[N+](=O)[O-])=NC(C)(C)C2,C00094501_decoy,CASP3,Decoy,0,-5.79595,-5.24,-0.86,-5.53799924482024
Cc1ccc(-n2nnnc2SCc2ccno2)cc1,C09254130_decoy,CASP3,Decoy,0,-5.85253,-5.09,-0.91,-4.606175447244576
COC(=O)[C@H]1Sc2nnc(-c3cccs3)n2N=C1C,C09280715_decoy,CASP3,Decoy,0,-7.23706,-4.51,-0.44,-5.12718082606724
Cc1cccn2cc(CSc3nnnn3C(C)C)nc12,C09316685_decoy,CASP3,Decoy,0,-5.45577,-5.67,-1.64,-6.132249099898227
CN(c1ccc2nnnn2n1)[C@H]1CCc2ccccc21,C12760649_decoy,CASP3,Decoy,0,-6.89659,-8.82,-1.19,-9.322097133189231
COc1ccc(-c2nnc3ccc(N(C)C)nn23)cc1,C09340409_decoy,CASP3,Decoy,0,-6.12554,-5.11,-1.05,-4.465361153840298
CCCn1nc(Oc2cc(C)nc(Cl)n2)ccc1=O,C16808308_decoy,CASP3,Decoy,0,-5.74019,-5.06,-2.78,-4.281426483746146
O=[N+]([O-])c1cn(Cc2ccc(Cl)c3cccnc23)cn1,C31655575_decoy,CASP3,Decoy,0,-5.71734,-5.15,-3.27,-4.157387541514965
COc1ncc(-c2cnc3ccccc3n2)c(OC)n1,C32576627_decoy,CASP3,Decoy,0,-6.13245,-4.87,-1.2,-5.55089081107333
C(=C\c1nn2c(-c3ccco3)nnc2s1)\c1ccco1,C33542926_decoy,CASP3,Decoy,0,-6.44415,-5.26,-0.77,-4.353565720591356
O=Cc1c(-n2nnc3ccccc32)nc2ccccn12,C35433385_decoy,CASP3,Decoy,0,-5.4115,-5.64,-3.66,-4.099731829379151
Cc1nc2ccccn2c1N(C=O)c1ccc2c(c1)OCO2,C01412096_decoy,CASP3,Decoy,0,-5.86642,-5.62,-1.82,-4.974251068130193
c1cc2c(cc1-n1nnnc1SCC1CC1)OCO2,C00088544_decoy,CASP3,Decoy,0,-6.41658,-4.83,-0.17,-4.926374013432806
O=[N+]([O-])c1ccc(-n2nncc2-c2ccccc2)cc1,C00192398_decoy,CASP3,Decoy,0,-4.91977,-5.84,0.53,-4.703232088851706
O=C1[C@@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@@H]1C=C[C@H]2C1,C04134896_decoy,CASP3,Decoy,0,-5.27534,-6.24,-0.85,-4.743976540581044
CC1(C)OC[C@@H]([C@@]23OC(C)(C)[C@]2([C@@H]2COC(C)(C)O2)O3)O1,C05482354_decoy,CASP3,Decoy,0,-5.9678,-5.62,-0.36,-3.7299447800271417
CC1(C)OC[C@@H]([C@]23OC(C)(C)[C@@]2([C@@H]2COC(C)(C)O2)O3)O1,C05482320_decoy,CASP3,Decoy,0,-6.2845,-4.88,-0.64,-4.661893735791135
Cn1nccc1-c1nn2c(Cc3ccccc3)nnc2s1,C40288387_decoy,CASP3,Decoy,0,-8.01933,-7.05,-1.29,-7.279933420322935
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C=O)CC(C)(C)O1,C45695682_decoy,CASP3,Decoy,0,-5.05667,-5.01,-0.63,-4.513122442294884
C[C@H]1CN(CC(=O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)O1,C45699100_decoy,CASP3,Decoy,0,-5.7317,-4.86,-3.01,-4.455284454087907
Cc1ccc([C@H](C)N(C)C(=O)c2ccc([N+](=O)[O-])o2)s1,C48801577_decoy,CASP3,Decoy,0,-5.82484,-5.28,-1.19,-6.136023234557062
CSC1=NC(=O)C[C@@H](c2ccc([N+](=O)[O-])cc2)[C@H]1C#N,C49899677_decoy,CASP3,Decoy,0,-5.19228,-5.15,-0.49,-3.807498385174101
O=[N+]([O-])c1ccc(Sc2cnnc(Cl)n2)cc1,C51040223_decoy,CASP3,Decoy,0,-5.37982,-4.66,-0.36,-4.21846260079719
O=[N+]([O-])c1ccc(N2CCC3(CC2)OCCO3)s1,C54389818_decoy,CASP3,Decoy,0,-5.62605,-4.91,-0.7,-4.079126678377515
Cc1ccnc(C[C@H](C)N(C)c2ncnc3oc(C)nc23)c1,C55387378_decoy,CASP3,Decoy,0,-6.12512,-7.45,-1.07,-6.474341050296379
O=[N+]([O-])c1ccc2c(c1)N(CN1CCOC1=S)CC2,C57101268_decoy,CASP3,Decoy,0,-6.61568,-5.41,-0.5,-5.457655746229539
N#CCn1c(-c2ccccn2)nc2cc3c(cc21)OCO3,C57803920_decoy,CASP3,Decoy,0,-6.68151,-5.61,-0.24,-4.7888811910717495
Cn1c(/C(C#N)=C\c2csnn2)nnc1-c1ccccc1,C58250226_decoy,CASP3,Decoy,0,-7.43142,-5.67,-1.15,-5.748220293386843
Cc1occc1CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C59431933_decoy,CASP3,Decoy,0,-6.12769,-5.36,-1.29,-4.627522032213296
CN(C)/C=N/c1ccc2nnc(-c3ccccc3)n2n1,C04698673_decoy,CASP3,Decoy,0,-6.9427,-5.46,-0.78,-5.591082057942792
Cc1cc(C)c(Cn2c(-c3cnccn3)noc2=O)c(C)c1,C60359842_decoy,CASP3,Decoy,0,-5.77925,-5.45,-1.63,-5.220099631715258
Cc1cccc(-n2nnnc2SCc2ccno2)c1,C60752489_decoy,CASP3,Decoy,0,-6.20276,-5.82,-0.6,-6.593688135379077
CN(C)c1nc(Cl)nc(N(C)C2CCOCC2)n1,C61538039_decoy,CASP3,Decoy,0,-6.76849,-4.61,-3.97,-4.602198381077611
CN(CC(F)(F)F)c1nc(Cl)nc(-n2cccn2)n1,C61538177_decoy,CASP3,Decoy,0,-5.7784,-4.98,-0.37,-3.7659846221573146
C[C@H]1CCN(c2nc(Cl)nc(-n3cccn3)n2)C1,C61538381_decoy,CASP3,Decoy,0,-6.16565,-4.94,-0.9,-4.650360247134235
CN(C)c1nc(Cl)nc(Sc2nccn2C)n1,C61543492_decoy,CASP3,Decoy,0,-6.87025,-4.49,-2.04,-4.405867267318619
COc1cc(-n2nnc(C=O)c2C)c(OC)cc1Cl,C62240751_decoy,CASP3,Decoy,0,-6.0737,-5.04,-0.72,-5.039080170171268
Cc1cccc(-c2c(C=O)nnn2Cc2c(C)noc2C)c1,C62314663_decoy,CASP3,Decoy,0,-6.81535,-7.25,-0.61,-12.638980600677977
N#Cc1nnn(-c2nc3c(s2)CCCC3)c1[C@@H]1CCCO1,C62427519_decoy,CASP3,Decoy,0,-8.19418,-6.19,-0.06,-5.696341306296852
CC1=CC[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2C1,C00440003_decoy,CASP3,Decoy,0,-5.8049,-5.67,-1.73,-3.749752272992001
Cc1noc2ncnc(N3CCN(c4ccccc4)CC3)c12,C20575128_decoy,CASP3,Decoy,0,-6.65247,-5.5,-0.49,-4.844289722319634
Cc1cc2ncn(-c3ccc(-n4cnnc4)nc3)c2cc1C,C65488016_decoy,CASP3,Decoy,0,-6.04496,-5.27,-1.3,-4.13483827491643
CSc1nnc(Sc2ccncc2[N+](=O)[O-])s1,C66796709_decoy,CASP3,Decoy,0,-6.38021,-4.23,-1.2,-5.113500113416284
CCO[C@H]1CCC[C@H](n2cnc3c(I)ncnc32)O1,C01677271_decoy,CASP3,Decoy,0,-7.33864,-5.28,-1.66,-4.942912510333871
CCO[C@H]1CCC[C@@H](n2cnc3c(I)ncnc32)O1,C01677269_decoy,CASP3,Decoy,0,-7.26015,-5.03,-2.32,-5.7968265705936135
Cc1ccc(S(=O)(=O)N(C)C2=NS(=O)(=O)c3ccccc32)cc1,C00858955_decoy,CASP3,Decoy,0,-6.33836,-6.16,-0.91,-5.190061641151922
Cc1ccc(Cn2ccc(N3C(=O)[C@@H]4[C@H](C3=O)[C@H]3CC[C@@H]4O3)n2)cc1,C06922866_decoy,CASP3,Decoy,0,-7.34962,-5.93,-2.13,-6.297248157550011
Cc1cccc(Cn2cc(N3C(=O)[C@@H]4[C@H](C3=O)[C@H]3CC[C@@H]4O3)cn2)c1,C06924242_decoy,CASP3,Decoy,0,-7.33123,-6.4,-0.85,-5.376735237031994
Cc1ccc(N2C[C@H](c3nc(-c4ccncc4)no3)CC2=O)cc1F,C09318730_decoy,CASP3,Decoy,0,-6.51142,-7.0,-0.77,-5.100104858558034
Fc1ccccc1N1CCN(Cc2nnnn2-c2ccccc2)CC1,C23697774_decoy,CASP3,Decoy,0,-6.73788,-6.44,-1.07,-5.503290846072596
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cccc(-n2cnnn2)c1,C23764391_decoy,CASP3,Decoy,0,-5.24279,-6.28,-0.6,-5.3646071946222245
Cc1csc(S[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)n1,C23958230_decoy,CASP3,Decoy,0,-7.56232,-5.22,-1.85,-4.99058239715522
C[C@H](Sc1ncnc2c1cnn2C)C(=O)N1CCc2sccc2C1,C28761835_decoy,CASP3,Decoy,0,-8.40728,-6.33,-1.45,-6.253790652282309
COCC(=O)/N=C1\S[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(C)c(C)c1,C32508303_decoy,CASP3,Decoy,0,-8.1444,-6.67,-0.94,-5.603436049721583
Cc1ccc(-c2cc(C(=O)N3CCCC3)nn2[C@H]2CCS(=O)(=O)C2)cc1,C33325502_decoy,CASP3,Decoy,0,-8.19074,-6.49,-2.88,-5.988268010456924
CC(=O)c1ccc(N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc1,C01054159_decoy,CASP3,Decoy,0,-6.92891,-7.14,-0.62,-5.364195683291083
CN1C(=S)S[C@](C)(/[N+]([O-])=C\c2cccc([N+](=O)[O-])c2)C1(C)C,C39369165_decoy,CASP3,Decoy,0,-5.00329,-5.57,-2.27,-4.8754224474424666
CC(C)(C)N1C[C@H]([C@@H]2N=CC(c3ccc4c(c3)OCCO4)=N2)CC1=O,C39430081_decoy,CASP3,Decoy,0,-7.03822,-6.12,-2.93,-5.343635063861739
CC1=N[C@@H](CN(C)C(=O)[C@@H]2CCC(=O)N(C3CCCCCC3)C2)N=C1,C39467557_decoy,CASP3,Decoy,0,-7.96011,-5.37,-1.4,-4.807360367603647
O=C(C(=O)N1CCC2=NN=C(c3ccccc3F)[C@H]2C1)c1ccco1,C39557986_decoy,CASP3,Decoy,0,-5.77269,-5.91,-0.47,-5.210728141314838
N#Cc1nc(C2CC2)oc1N1CCN(C(=O)c2cc(F)cc(F)c2)CC1,C40087059_decoy,CASP3,Decoy,0,-7.23572,-6.42,-1.66,-6.366346088706404
C[C@@H]1CN(C(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)CCO1,C40509318_decoy,CASP3,Decoy,0,-5.88885,-6.17,-2.21,-4.777176604317056
CN(C)c1ccc([C@@H](C#N)N2CCN(C(=O)c3ccco3)CC2)cc1,C41260351_decoy,CASP3,Decoy,0,-6.59182,-5.9,-2.56,-5.172401867099769
CN(C)c1ccc([C@H](C#N)N2CCN(C(=O)c3ccco3)CC2)cc1,C41260353_decoy,CASP3,Decoy,0,-6.79666,-5.88,-2.06,-4.896113513878451
Cc1cccn2cc(CS(=O)(=O)CC(=O)N3CCCC[C@H]3C)nc12,C46183181_decoy,CASP3,Decoy,0,-5.91741,-6.01,-1.67,-5.054043120551016
Cc1ccccc1-n1ncc(C(=O)N(C)Cc2c(C)noc2C)c1C,C47644002_decoy,CASP3,Decoy,0,-6.20602,-7.09,-1.73,-6.502545213696698
Cn1cc(S(=O)(=O)Oc2ccc(Br)cc2C=O)cn1,C48660113_decoy,CASP3,Decoy,0,-6.61542,-6.24,-4.26,-6.124050757414195
Cc1cc(C(=O)N(C)S(=O)(=O)c2ccc3c(c2)OCCO3)c(C)s1,C48709038_decoy,CASP3,Decoy,0,-7.34189,-6.74,-0.97,-5.523265271904918
O=S1(=O)CC[C@@H](n2cc(-c3cnn(Cc4ccccc4)c3)cn2)C1,C49590030_decoy,CASP3,Decoy,0,-7.11102,-5.63,-1.47,-5.035031500759823
CC(C)c1nnc2sc(CCC(=O)N3CCc4ccccc43)nn12,C49663525_decoy,CASP3,Decoy,0,-5.74682,-6.93,-0.72,-5.091137648687854
Cc1cc(=O)oc2cc(OC(=O)[C@H]3CCS(=O)(=O)C3)c(Cl)cc12,C51499531_decoy,CASP3,Decoy,0,-6.95037,-6.41,-1.05,-4.334301353630708
Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2csnn2)c1C,C56268955_decoy,CASP3,Decoy,0,-6.77204,-7.72,-1.25,-9.48299700237828
O=C(c1cc(Cl)c2c(c1)OCO2)N1CCN(C[C@@H]2CCCO2)CC1,C57575437_decoy,CASP3,Decoy,0,-7.96279,-5.4,-2.1,-5.9368309244565625
Cn1cnnc1S[C@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O,C59417287_decoy,CASP3,Decoy,0,-8.04754,-5.75,-1.02,-5.795130834709354
Cc1noc(C)c1CSc1ncnc2c1c(Br)nn2C,C60378686_decoy,CASP3,Decoy,0,-6.10057,-5.34,-0.66,-4.146331281538592
COCC(=O)/N=C1\S[C@@H]2CS(=O)(=O)C[C@H]2N1c1cccc(Cl)c1,C05271687_decoy,CASP3,Decoy,0,-7.28588,-5.67,-1.38,-5.911529063283431
CN(C)c1ncccc1C(=O)N1CC[C@@H](c2ccc3c(c2)OCO3)C1,C62320736_decoy,CASP3,Decoy,0,-6.94956,-6.09,-1.03,-5.754159039023107
Clc1ccc(CN2CCN(C3=NC=NC4=NC=N[C@H]43)CC2)c(Cl)c1,C63376342_decoy,CASP3,Decoy,0,-7.66903,-7.31,-1.44,-6.851917781415692
CCc1ccc(N2C(=O)C[C@@H](N3CCC4(CC3)OCCO4)C2=O)cc1,C18077640_decoy,CASP3,Decoy,0,-6.22219,-6.95,-1.67,-5.931102141684443
CC1=NC(C)=C(C(=O)N2CCCCC2)[C@@H]1S(=O)(=O)N1CCCCC1,C63652778_decoy,CASP3,Decoy,0,-6.82989,-6.9,-0.64,-7.395556519781053
Cn1cc(/C=C/C(=O)N2CCC3=NN=C(c4cccc(F)c4)[C@H]3C2)cn1,C63846453_decoy,CASP3,Decoy,0,-7.0398,-7.17,-0.81,-6.066027811028872
O=C(c1ccsc1)N1CCCN(c2ccc([N+](=O)[O-])s2)CC1,C64029753_decoy,CASP3,Decoy,0,-7.99523,-5.96,-2.78,-5.696504045877373
C[C@@H]1C[C@H](C)CN(S(=O)(=O)N2CCCN(c3nccs3)CC2)C1,C64403328_decoy,CASP3,Decoy,0,-8.54992,-5.28,-2.3,-6.3287087501401285
CCC(=O)/N=C1/S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(N(C)C)cc1,C05267849_decoy,CASP3,Decoy,0,-7.37106,-5.17,-1.09,-5.236557341820231
CC(C)CN1C[C@H](C(=O)N2CCC3=C(C2)[C@@H](C2CCC2)N=N3)CC1=O,C65383113_decoy,CASP3,Decoy,0,-7.57457,-7.02,-3.43,-5.882132630534517
C#CCN(C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)C1CCCCC1,C65777242_decoy,CASP3,Decoy,0,-8.02555,-8.28,-2.46,-10.685827392410433
Cc1cccc(N(C)C(=O)C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1,C66218272_decoy,CASP3,Decoy,0,-7.6049,-6.78,-1.68,-6.543550733242775
N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnns3)n2)cc1,C66544602_decoy,CASP3,Decoy,0,-8.36907,-5.85,-1.25,-5.827840879061949
CCCC(=O)N1CCC[C@@H]1C(=O)N1CCCN(C(=O)C(C)(C)C)CC1,C66727591_decoy,CASP3,Decoy,0,-6.77343,-5.96,-1.03,-6.238802456809414
CC(C)(C)C(=O)N1CCCN(C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)CC1,C66728282_decoy,CASP3,Decoy,0,-6.63518,-5.19,-1.33,-5.536722733906864
Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)cn1,C66768801_decoy,CASP3,Decoy,0,-7.27584,-5.91,-3.16,-6.030962883122082
Cc1cc(C)c(CS(=O)(=O)Cc2cc(=O)n(C)c(=O)n2C)c(C)c1,C67224906_decoy,CASP3,Decoy,0,-6.00433,-6.64,-0.61,-5.806363074079947
CCO[C@@H]1CCCN(C(=O)C2=NN(c3cccc(C)c3)C(=O)CC2)C1,C67520279_decoy,CASP3,Decoy,0,-6.62582,-6.85,-0.81,-6.201926429321605
CS(=O)(=O)N1CCC[C@H](c2nnc(S)n2-c2cnn(Cc3ccc(Cl)cc3Cl)c2)C1,C02808647_decoy,CASP3,Decoy,0,-10.1598,-6.2,-2.97,-6.957326468094176
Cc1cccc(-n2ccnc2SCC(=O)N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)c1,C08825807_decoy,CASP3,Decoy,0,-8.19643,-7.39,-1.26,-6.24250775907183
CS(=O)(=O)c1ncc(Cl)c(C(=O)N(Cc2ccc(Cl)cc2)[C@H]2CCS(=O)(=O)C2)n1,C08915249_decoy,CASP3,Decoy,0,-8.61048,-7.17,-1.75,-7.022674522687648
Cc1c(C(=O)N(C)C)sc2c1c(=O)n(-c1ccccc1)c(=O)n2CC(=O)N(C)c1ccccc1,C02956901_decoy,CASP3,Decoy,0,-7.81469,-6.96,-2.5,-7.228056845861349
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)c1ccc2noc(-c3ccccc3)c2c1,C09494949_decoy,CASP3,Decoy,0,-8.81045,-6.95,-1.72,-6.101238126799523
CSCCn1/c(=N/C(=O)c2ccc(N3C(=O)CCC3=O)cc2)sc2cc3c(cc21)OCO3,C09564822_decoy,CASP3,Decoy,0,-7.98064,-5.75,-1.49,-5.381618559802515
O=C(OCc1cc(F)cc2c1O[C@H](c1ccsc1)OC2)C1=CC=CN2CCS(=O)(=O)N=C12,C09594957_decoy,CASP3,Decoy,0,-10.9017,-7.11,-1.01,-6.942602515351475
CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1,C09727608_decoy,CASP3,Decoy,0,-7.93786,-8.79,-2.96,-6.996568773808788
COc1ccc([C@H]2[C@H](C(=O)N3CCC4(CC3)OCCO4)CCC(=O)N2c2ccc(OC)cc2)cc1,C09776582_decoy,CASP3,Decoy,0,-7.53646,-6.57,-2.99,-5.612034101469638
COc1ccc([C@H]2[C@@H](C(=O)N3CCC4(CC3)OCCO4)CCC(=O)N2c2ccc(OC)cc2)cc1,C09776584_decoy,CASP3,Decoy,0,-6.88704,-7.38,-0.44,-6.244813806780175
COc1cc(=O)n2c(c1C(=O)N(C)Cc1cscn1)CCN(C(=O)c1cc(C)ccc1C)CC2,C12079320_decoy,CASP3,Decoy,0,-8.83843,-6.19,-1.34,-8.09511731722219
COC(=O)c1c(OC[C@H]2CCCCO2)cc(=O)n2c1CCN(C(=O)C#Cc1ccccc1)CC2,C12280908_decoy,CASP3,Decoy,0,-7.73391,-6.1,-1.32,-6.094534683097204
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)c1ccc(-n2cnc3ccccc32)cc1,C12563051_decoy,CASP3,Decoy,0,-7.31253,-8.86,-1.41,-7.84823329141079
O=C(c1nccnc1-c1nc2ccccc2s1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1,C13164716_decoy,CASP3,Decoy,0,-7.47817,-7.7,-1.37,-6.284330630455589
CCn1nc(C(=O)N2CCN(c3ccccc3)CC2)c2c1CCN(C(=O)Cc1csc(C)n1)C2,C14732691_decoy,CASP3,Decoy,0,-7.37457,-6.19,-1.79,-5.507480361350828
CC(=O)c1ccc(N2CCN(C(=O)Cc3c(C)nc4nc(C(F)(F)F)nn4c3C)CC2)c(F)c1,C14899789_decoy,CASP3,Decoy,0,-8.01821,-7.71,-1.36,-6.013460171330814
COc1cc(=O)n2c(c1C(=O)N1CCSCC1)CCN(C(=O)[C@@H](C)Oc1ccccc1)CC2,C14977252_decoy,CASP3,Decoy,0,-7.66098,-6.83,-2.44,-8.555990275818086
COC(=O)c1c(S(=O)(=O)N2CCCC2)sc2c1CCN(C(=O)c1ccccc1C(C)=O)C2,C14984736_decoy,CASP3,Decoy,0,-8.87564,-6.1,-2.67,-6.420828439299887
O=C(C[C@]1(c2ccccc2F)CC(=O)N(C2CCCC2)C1=O)N1CCCN(c2ncccn2)CC1,C14999575_decoy,CASP3,Decoy,0,-7.6538,-7.52,-1.28,-6.241488461158971
Cc1ccc(-n2c(S[C@H](C)C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)nc1,C18439478_decoy,CASP3,Decoy,0,-6.55477,-6.96,-3.55,-6.171768482582517
CSc1nc2nc(C)c(CC(=O)N3CCCN(c4ccc(C(F)(F)F)cn4)CC3)c(C)n2n1,C22700171_decoy,CASP3,Decoy,0,-8.30918,-5.65,-3.3,-5.597461531867623
CCn1cc(CN2CCN(C(=O)c3cc(-c4ccc(Cl)cc4)nc4c3c(C)nn4C)CC2)cn1,C22714176_decoy,CASP3,Decoy,0,-9.2579,-7.01,-1.83,-6.819639183120158
COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1,C12790438_decoy,CASP3,Decoy,0,-8.19913,-8.01,-2.72,-6.6053312890726605
Cn1ncc2c(N3CCN(CCS(=O)(=O)c4ccc(Br)cc4)CC3)ncnc21,C14856593_decoy,CASP3,Decoy,0,-8.47363,-7.04,-2.33,-6.084664083674718
COCCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(C)c2N2C[C@H](C)O[C@@H](C)C2)SC1=S,C33452365_decoy,CASP3,Decoy,0,-8.43683,-4.57,-0.93,-5.918808858771377
COc1cc(/C=c2\sc3nc(-c4ccncc4)nn3c2=O)cc(Br)c1OC(C)=O,C34107645_decoy,CASP3,Decoy,0,-8.11633,-5.49,-1.32,-5.384887070297052
CCc1nnc(N2C(=O)c3oc4ccc(F)cc4c(=O)c3[C@@H]2c2ccc(C(=O)OC)cc2)s1,C35512190_decoy,CASP3,Decoy,0,-6.88934,-6.03,-3.19,-5.445178151996771
COc1ccc(-c2cc(N3CCN([C@H]4CC(=O)N(c5ccc(F)cc5)C4=O)CC3)nc(C)n2)cc1,C12463243_decoy,CASP3,Decoy,0,-8.87055,-6.95,-1.46,-5.884168149366915
CCn1cc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C38485015_decoy,CASP3,Decoy,0,-7.55006,-6.23,-3.67,-6.51554968145251
CCn1cc(C(=O)N2CCN(C(=O)c3ccccc3SC)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C38485052_decoy,CASP3,Decoy,0,-9.126,-7.07,-3.8,-6.887998555926429
C[C@H](SCC1=NC(=O)C2=C(c3ccccc3)CSC2=N1)C(=O)N1CCN(S(C)(=O)=O)CC1,C38775726_decoy,CASP3,Decoy,0,-7.71307,-7.83,-1.13,-6.297116191122552
CC1=N[C@H](C(=O)[O-])[C@@H](C)[C@H]1C(=O)/C=C/c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2,C39701006_decoy,CASP3,Decoy,0,-8.54097,-6.9,-1.96,-6.310293558012606
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)N(C3CCCC3)[C@H]3CCS(=O)(=O)C3)CC2=O)cc1,C19297653_decoy,CASP3,Decoy,0,-9.37953,-8.46,-1.78,-9.099967969038357
Cc1ccc(-c2ccc(N3CCC(C(=O)N4CCN(CC(=O)N5CCCC5)CC4)CC3)nn2)cc1,C40907014_decoy,CASP3,Decoy,0,-8.31661,-7.29,-2.22,-5.06527771044705
O=C(CN1CCN(C(=O)C2CCN(c3ccc(-c4ccc(F)cc4)nn3)CC2)CC1)N1CCCCC1,C40919403_decoy,CASP3,Decoy,0,-8.78827,-8.11,-1.14,-6.716214421604343
O=C(c1nn([C@@H]2CCS(=O)(=O)C2)c2c1CCCC2)N(Cc1ccc(F)cc1)[C@@H]1CCS(=O)(=O)C1,C40987731_decoy,CASP3,Decoy,0,-9.59166,-7.22,-4.88,-7.247357494775349
O=C1c2c(c(-c3cccs3)nn2[C@@H]2CCS(=O)(=O)C2)[C@H](c2ccco2)N1Cc1ccco1,C41003918_decoy,CASP3,Decoy,0,-9.49255,-5.6,-1.62,-6.760503720897916
O=C1c2c(c(-c3cccs3)nn2[C@H]2CCS(=O)(=O)C2)[C@@H](c2ccco2)N1Cc1ccco1,C41003920_decoy,CASP3,Decoy,0,-9.00828,-6.99,-3.26,-7.107568453723849
O=C(c1cnc(OCC(F)(F)F)c(Cl)c1)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1,C46903215_decoy,CASP3,Decoy,0,-9.41413,-6.08,-1.93,-5.697831252001518
CC(C)c1c(C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3F)CC2)cnn1-c1ccccn1,C46912682_decoy,CASP3,Decoy,0,-7.45957,-6.72,-2.26,-6.059114236830303
Cc1ccc(-n2nc3c(c2-n2cccc2)CN(C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)C3)cc1,C56911570_decoy,CASP3,Decoy,0,-6.15384,-6.67,-2.07,-4.805192763502977
Cc1ccccc1-n1nc2c(c1-n1cccc1)CN(C(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C2,C56912480_decoy,CASP3,Decoy,0,-6.64847,-5.83,-1.97,-4.8463037018226975
Cc1ccc(-n2nc3c(c2-n2cccc2)CN(C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)C3)c(C)c1,C56912919_decoy,CASP3,Decoy,0,-6.18249,-6.64,-2.08,-5.124451866656893
COc1ccc(N2CCN(C(=O)Cn3c(N4CCc5ccccc5C4)nc(C)cc3=O)CC2)cc1,C57506622_decoy,CASP3,Decoy,0,-8.14444,-6.85,-2.46,-6.199973007421142
COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)CC1,C58820013_decoy,CASP3,Decoy,0,-6.62958,-7.32,-3.93,-5.992180760948894
CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CCN(S(=O)(=O)[C@@H]2CCS(=O)(=O)C2)CC1,C59332458_decoy,CASP3,Decoy,0,-8.3271,-6.81,-4.03,-6.48813446719126
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)CC1=NC(=O)C2=C[C@H](c3ccccc3)SC2=N1,C39793046_decoy,CASP3,Decoy,0,-9.61434,-7.78,-3.39,-6.325299556766986
CCC1=C(C)C[C@H](c2nnc(CN3CCN(CC4=NC(=O)C5=C(C)[C@H](C)SC5=N4)CC3)o2)S1,C39937877_decoy,CASP3,Decoy,0,-11.1074,-6.66,-4.67,-6.387454240470992
C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(=O)n(CCC(=O)N2CCN(c3ccccc3)CC2)n1,C64892113_decoy,CASP3,Decoy,0,-6.98279,-7.9,-2.18,-6.7929380546005085
Cc1ccc(C)c(N2CCN(C(=O)[C@H]3CCCN(S(=O)(=O)c4cn(C(C)C)cn4)C3)CC2)c1,C64958195_decoy,CASP3,Decoy,0,-8.2081,-8.87,-1.05,-6.624138848369436
CCS(=O)(=O)N1CCC[C@H](c2nnc(S)n2-c2ccn(Cc3c(F)cccc3Cl)n2)C1,C02808360_decoy,CASP3,Decoy,0,-11.0617,-7.55,-1.73,-8.129167651166055
COCCCN1C(=O)/C(=C/c2c(N3CCN(c4ccccc4)CC3)nc3ccccn3c2=O)SC1=S,C08859264_decoy,CASP3,Decoy,0,-9.23638,-7.43,-0.83,-7.033136385899704
CCc1ccc(CN(C(=O)c2nc(S(=O)(=O)CC)ncc2Cl)[C@H]2CCS(=O)(=O)C2)cc1,C08868828_decoy,CASP3,Decoy,0,-8.07339,-6.53,-2.99,-7.079867678894519
CCCN(CCC)c1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N([C@H]2CCS(=O)(=O)C2)C1=O,C09003848_decoy,CASP3,Decoy,0,-8.90404,-7.47,-1.24,-7.596718612425233
COc1ccc(Cl)c2sc(N(Cc3cccnc3)C(=O)c3cccc(N4C(=O)CCC4=O)c3)nc12,C09326522_decoy,CASP3,Decoy,0,-8.70516,-7.14,-1.92,-7.940320354083134
O=C(Cn1nnc(-c2ccc(Br)cc2)n1)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1,C09576831_decoy,CASP3,Decoy,0,-8.50195,-6.91,-1.09,-6.820473748111236
Cc1ccc(S(=O)(=O)CCC(=O)N(Cc2ccco2)c2nc3c(S(C)(=O)=O)cccc3s2)cc1,C10827860_decoy,CASP3,Decoy,0,-9.38577,-7.68,-1.88,-7.558210669043666
CCS(=O)(=O)c1cccc(C(=O)N(Cc2ccco2)c2nc3c(S(C)(=O)=O)cccc3s2)c1,C10827955_decoy,CASP3,Decoy,0,-9.32281,-8.19,-1.9,-8.120437479014024
CS(=O)(=O)c1ccccc1C(=O)N(C[C@@H]1CCCO1)c1nc2c(S(C)(=O)=O)cccc2s1,C10829776_decoy,CASP3,Decoy,0,-8.49526,-6.04,-1.59,-7.122463177860104
CCS(=O)(=O)c1cccc(C(=O)N(C[C@H]2CCCO2)c2nc3c(S(C)(=O)=O)cccc3s2)c1,C10829882_decoy,CASP3,Decoy,0,-9.17172,-6.5,-4.73,-7.688041159682804
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)c1ccc(F)cc1Cl)CC2,C11909221_decoy,CASP3,Decoy,0,-8.55655,-6.82,-1.49,-6.501981019828187
COc1cc(=O)n2c(c1C(=O)N(C)[C@@H](C)c1ccco1)CCN(C(=O)C1(c3ccccc3)CC1)CC2,C12037204_decoy,CASP3,Decoy,0,-8.08829,-6.94,-1.6,-7.106019561844336
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)c1cc(Cl)ccc1F)CC2,C12050490_decoy,CASP3,Decoy,0,-9.20215,-7.39,-2.88,-7.439914649959394
O=C(c1ccc(N2C(=O)CCC2=O)cc1)N(CCCn1ccnc1)c1nc2ccc(Cl)cc2s1,C10581225_decoy,CASP3,Decoy,0,-8.0518,-6.21,-2.16,-5.714024778547353
C[C@H](Sc1nnc(-c2ccccn2)c(-c2ccccn2)n1)C(=O)c1ccc(N2CCCC2=O)cc1,C13566526_decoy,CASP3,Decoy,0,-8.80032,-8.14,-0.88,-10.230927968787094
Cc1noc(C)c1CO[C@H]1CN(C(=O)CCc2nc3ccccc3s2)CC(=O)N(CC(C)C)C1,C14538861_decoy,CASP3,Decoy,0,-8.23396,-6.01,-4.23,-6.415692440005761
COC(=O)c1c(OCCc2ccsc2)cc(=O)n2c1CCN(C(=O)c1ccnc(Cl)c1)CC2,C14994969_decoy,CASP3,Decoy,0,-10.6595,-6.41,-0.61,-6.43672253189462
CS(=O)(=O)N1CCN(C(=O)CSc2nnc(-c3ccc(Cl)cc3)n2-c2ccccc2)CC1,C18256760_decoy,CASP3,Decoy,0,-8.50184,-7.28,-1.98,-6.518469406655033
CC[C@@H](C)N(C(=O)CSc1nnc(N2CCCC2)n1-c1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1,C19605030_decoy,CASP3,Decoy,0,-8.32737,-5.51,-2.63,-5.388330382907967
CC[C@H](C)N(C(=O)CSc1nnc(N2CCCC2)n1-c1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1,C19605031_decoy,CASP3,Decoy,0,-8.39304,-6.82,-3.91,-8.089683106894148
Cc1ccc(C(=O)N2CCC[C@@H]2c2nnc(SCC(=O)N3CCN(c4ccccc4)CC3)n2C)cc1,C20293393_decoy,CASP3,Decoy,0,-8.6876,-9.26,-2.05,-7.052915659593337
COC(=O)c1c(OC[C@@H]2CC(=O)N(C)C2)cc(=O)n2c1CCN(Cc1c(F)ccc(F)c1F)CC2,C14981830_decoy,CASP3,Decoy,0,-9.49383,-7.74,-2.46,-7.468267646836886
CS(=O)(=O)N(Cc1nnc(SCC(=O)N2CCCC2)n1-c1ccccc1)c1ccc(F)cc1,C20416258_decoy,CASP3,Decoy,0,-8.46821,-7.11,-2.99,-7.68096158828315
CCOC(=O)c1ccc(-n2c(=S)sc3c(=O)n(C[C@@H]4CCCO4)c(SCC#N)nc32)cc1,C03026948_decoy,CASP3,Decoy,0,-10.2781,-5.72,-1.6,-11.931860969461454
CCn1c(CN2CCN(Cc3nc4ccccc4s3)CC2)nc2cc(S(=O)(=O)N(C)C)ccc21,C22799477_decoy,CASP3,Decoy,0,-9.9761,-5.9,-2.06,-5.878869474131118
Cc1ccc(-n2c(C)nnc2SCC(=O)N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)cc1,C24137202_decoy,CASP3,Decoy,0,-7.65849,-8.45,-1.23,-6.419973744573629
CCn1c(SCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)nnc1-c1ccc(Cl)cc1,C24139537_decoy,CASP3,Decoy,0,-9.51142,-7.28,-2.19,-6.606779084252673
COCCCN1C(=O)/C(=C\c2c(N3C[C@H](C)O[C@@H](C)C3)nc3c(C)cccn3c2=O)SC1=S,C27016460_decoy,CASP3,Decoy,0,-8.74761,-6.93,-1.99,-7.246028177545617
CCOc1cc(C=C2C(=O)N([C@@H]3CCS(=O)(=O)C3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C,C27194178_decoy,CASP3,Decoy,0,-9.38195,-5.76,-1.07,-6.5146730136107935
COc1ccc(CC(=O)/N=C2\S[C@@H]3CS(=O)(=O)C[C@@H]3N2c2ccc(N(C)C)cc2)cc1OC,C32502803_decoy,CASP3,Decoy,0,-8.71156,-5.97,-2.97,-6.510292107837929
CCOC(=O)C1CCN(c2c(/C=C3\SC(=S)N(C(C)C)C3=O)c(C)c(C#N)c(=O)n2C)CC1,C33447381_decoy,CASP3,Decoy,0,-8.31729,-7.04,-2.22,-6.99086214754269
C=CCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(C)c2N2CCC(C(=O)OCC)CC2)SC1=S,C33447386_decoy,CASP3,Decoy,0,-9.08072,-6.9,-1.93,-7.255058876335513
COCC(=O)N1C[C@@H](C(=O)N2CCN(c3ccccc3F)CC2)C[C@H](c2ccc(OC)c(OC)c2)C1,C34730591_decoy,CASP3,Decoy,0,-8.45793,-6.69,-2.01,-6.306577706742593
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)c3cccc(Br)c3)[C@@H](C)C2)c1C(=O)OCC,C35126768_decoy,CASP3,Decoy,0,-9.13341,-7.02,-3.23,-7.642515617744923
Cc1nc(C)c(C(=O)OCC(C)C)c(C(=O)N2CCN(C(=O)c3ccc(Br)cc3)[C@H](C)C2)n1,C35174163_decoy,CASP3,Decoy,0,-7.93508,-5.76,-2.19,-6.071685220409519
O=C(c1ccco1)N(CCN1CCOCC1)CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1,C35947931_decoy,CASP3,Decoy,0,-9.7853,-6.86,-3.6,-7.52745389505212
COCCN(CC(=O)N1CCN(c2ccc(-c3ccc(F)cc3)nn2)CC1)C(=O)c1ccccc1F,C36072605_decoy,CASP3,Decoy,0,-7.27271,-6.6,-1.73,-5.294690532296558
C[C@@H]1CN(C(=O)Cn2cc(S(=O)(=O)CC(=O)N(C)c3ccccc3)c3ccccc32)C[C@@H](C)O1,C10460846_decoy,CASP3,Decoy,0,-8.4826,-8.12,-4.36,-7.137474368973211
CCN(CC)C(=O)Cn1cnc2sc(C(=O)N3CCN(c4ccc(F)cc4)CC3)c(C)c2c1=O,C02477375_decoy,CASP3,Decoy,0,-8.53598,-6.29,-2.14,-5.738166694334798
CN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)n1C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1,C09662763_decoy,CASP3,Decoy,0,-9.81626,-7.14,-4.54,-6.163115996401154
COc1ccc(S(=O)(=O)CC(=O)N(Cc2ccncc2)c2nc3c(OC)cccc3s2)cc1,C38835833_decoy,CASP3,Decoy,0,-6.75866,-5.47,-2.08,-6.21930793403514
CSn1c(C)c(S(=O)(=O)C(C)C)c2c1-c1nccc(S(=O)(=O)Oc3ccccc3)c1C(=O)CC2,C39459408_decoy,CASP3,Decoy,0,-9.39484,-5.91,-2.64,-6.544321462658727
C=CCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CC)c2N2CCC(C(=O)OCC)CC2)SC1=S,C39769487_decoy,CASP3,Decoy,0,-8.28849,-5.15,-1.9,-6.420348294717591
CCCn1c(N2C[C@@H](C)O[C@H](C)C2)c(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)c(C)c(C#N)c1=O,C39990263_decoy,CASP3,Decoy,0,-9.03366,-6.15,-2.08,-6.878970538470292
Cc1ccccc1-n1c(SCC(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)nnc1-c1ccncc1,C17660968_decoy,CASP3,Decoy,0,-8.16267,-7.23,-1.54,-8.798660578295166
CCCS(=O)(=O)c1ccc(-c2cc(C(=O)N(Cc3cccs3)[C@@H]3CCS(=O)(=O)C3)no2)cc1,C40325235_decoy,CASP3,Decoy,0,-11.0317,-6.76,-2.62,-7.467137786852897
CCc1ccc(CN(C(=O)c2nn([C@@H]3CCS(=O)(=O)C3)c3c2CCCC3)[C@H]2CCS(=O)(=O)C2)cc1,C40987692_decoy,CASP3,Decoy,0,-10.0441,-7.72,-4.75,-8.748735331850906
Cc1ccc(-n2c(SCC(=O)N(C3CC3)[C@H]3CCS(=O)(=O)C3)nnc2N2CCCCC2)cc1,C12556175_decoy,CASP3,Decoy,0,-8.90371,-7.19,-2.19,-7.777843628412001
CCOC(=O)Cn1c2c(sc1=O)[C@H](c1ccco1)[C@@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1S2,C18140404_decoy1,CASP3,Decoy,0,-8.01921,-6.14,,-6.511790842116455
CCOC(=O)Cn1c2c(sc1=O)[C@H](c1ccco1)[C@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1S2,C18140404_decoy2,CASP3,Decoy,0,-8.58891,-6.39,,-6.81998542456037
CCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(CCc2ccc(OC)c(OC)c2)C1=O,C02347170_decoy,CASP3,Decoy,0,-9.99027,-7.69,-4.08,-9.248686571177752
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCC(C)C)C3=O)c(NCCCn3ccnc3)nc12,C08743792_decoy,CASP3,Decoy,0,-8.143,-7.2,-2.14,-6.932899106384872
COc1ccc(CCN2C(=O)[C@@](NC(=O)c3ccco3)(C(F)(F)F)C3=C2CC(C)(C)CC3=O)cc1OC,C03627388_decoy,CASP3,Decoy,0,-9.32637,-7.97,-1.22,-8.46313769981821
O=C(Oc1ccc(N(C(=O)c2ccncc2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccncc1,C09030658_decoy,CASP3,Decoy,0,-6.47001,-5.81,-2.83,-5.537923844138357
CN(C)c1ccc([C@H](CNS(=O)(=O)c2ccc3c(c2)OCCO3)S(=O)(=O)c2ccc(F)cc2)cc1,C09080440_decoy,CASP3,Decoy,0,-9.00981,-6.8,-1.38,-8.304829430714134
O=S(=O)(Cc1ccc(Cl)cc1)NC[C@H](c1ccco1)S(=O)(=O)c1ccc2c(c1)OCCO2,C09082239_decoy,CASP3,Decoy,0,-9.04311,-6.61,-3.24,-6.9559399850099854
CCc1ccc(N2C[C@H](c3nnc(NC(=O)CCS(=O)(=O)Cc4ccccc4)s3)CC2=O)cc1,C09198822_decoy,CASP3,Decoy,0,-9.46343,-7.22,-4.06,-6.386915328893887
CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(CCCOC)/c1=N\C(=O)/C=C/C=C\SC,C09222281_decoy,CASP3,Decoy,0,-10.2331,-5.6,-2.07,-8.251181852508177
CCn1c(CCNC(=O)c2ccccc2F)nnc1SCC(=O)N1CCN(c2ccccc2)CC1,C09265082_decoy,CASP3,Decoy,0,-8.34047,-7.8,-1.85,-6.981295481537713
CC(C)CN(C(=O)COC(=O)C1CCN(C(=O)c2ccc(Cl)cc2)CC1)[C@H]1CCS(=O)(=O)C1,C09440143_decoy,CASP3,Decoy,0,-7.86312,-7.23,-1.69,-6.673479082763564
O=C(CCCS(=O)(=O)c1ccccc1)N(Cc1ccccn1)c1nc2ccc([N+](=O)[O-])cc2s1,C10218436_decoy,CASP3,Decoy,0,-7.16694,-6.64,-2.89,-6.103356081566161
Cc1ccccc1-n1cnnc1SCC(=O)NCCN1C(=O)S/C(=C\c2ccccc2F)C1=O,C10244445_decoy,CASP3,Decoy,0,-8.10332,-7.05,-2.52,-5.823466981901452
COc1ccc(C)c2sc(N(CCCn3ccnc3)C(=O)CCS(=O)(=O)c3ccccc3)nc12,C10585119_decoy,CASP3,Decoy,0,-9.15515,-6.22,-3.36,-7.091390265213026
COc1cc(OC)c(C2=CCN(C(=O)CCc3c(C)nc4nc(SC)nn4c3C)CC2)c(OC)c1,C11918789_decoy,CASP3,Decoy,0,-8.37761,-6.11,-1.64,-6.004028843315811
CCCOc1ccc([C@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccc(OC)c(OC)c2)cc1OC,C12276032_decoy,CASP3,Decoy,0,-10.2316,-6.49,-0.88,-9.600936766735016
COc1ccc2nc(N(CCCn3ccnc3)C(=O)c3ccc(S(=O)(=O)C(C)C)cc3)sc2c1,C10583016_decoy,CASP3,Decoy,0,-7.66754,-6.27,-3.0,-6.228352556374323
Cc1nn(C)cc1/C=C1\N=C(SCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)N(C2CC2)C1=O,C02800017_decoy,CASP3,Decoy,0,-7.56285,-6.97,-1.84,-6.535036370273046
CC(C)CN(C(=O)CN1C(=O)N[C@@](Cc2ccccc2)(c2ccccc2)C1=O)[C@H]1CCS(=O)(=O)C1,C09637518_decoy,CASP3,Decoy,0,-8.59467,-7.62,-3.82,-8.481346702210427
O=C(NCc1ccncc1)c1csc(CSc2nnc(-c3ccncc3)n2-c2ccccc2F)n1,C16464588_decoy,CASP3,Decoy,0,-9.32145,-6.33,-3.7,-6.155770828160942
Cc1c(NC(=O)CCCN2C(=O)S/C(=C\C=C\c3ccccc3)C2=O)c(=O)n(-c2ccccc2)n1C,C01469842_decoy,CASP3,Decoy,0,-7.83387,-7.54,-3.69,-5.896224234642611
COc1ccc(-c2nc(C(=O)NCCN3C(=O)S/C(=C\c4ccccc4)C3=O)cs2)cc1OC,C18946713_decoy,CASP3,Decoy,0,-7.71901,-8.48,-3.58,-6.3152529192324725
COCCN(Cc1cc2ccc(Cl)cc2nc1N1CCC[C@H](CO)C1)C(=O)c1ccc2c(c1)OCO2,C14999111_decoy,CASP3,Decoy,0,-8.07752,-6.2,-3.62,-7.18449329517
COc1cccc(/C=C/C(=O)N2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1OC(F)F,C26363921_decoy,CASP3,Decoy,0,-7.62541,-8.78,-1.87,-7.056802502171776
Cc1ccc(-n2cnnc2SCC(=O)NCCN2C(=O)S/C(=C\c3ccc(F)cc3)C2=O)cc1,C30772439_decoy,CASP3,Decoy,0,-7.2619,-7.9,-2.56,-6.139869905991169
COc1cc(C(=O)/N=c2/c(C)cccn2C(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC,C02088775_decoy,CASP3,Decoy,0,-8.94913,-5.8,-2.65,-7.106362213402092
C[C@@H]1CN(c2cc(Cl)nc(SCC(=O)NCCc3ccccn3)n2)CCN1C(=O)c1ccccc1,C34805716_decoy,CASP3,Decoy,0,-9.87088,-7.3,-5.83,-7.845449603062902
COCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)c1ccc(Cl)cc1,C35355711_decoy,CASP3,Decoy,0,-9.0342,-6.83,-2.76,-7.2713682034804865
C=CCN([C@@H](C)C(=O)c1c(C)c(C(=O)OC)n(C)c1C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C35542876_decoy,CASP3,Decoy,0,-7.45404,-7.37,-4.89,-9.497631873493734
O=C(CN(CCN1CCOCC1)C(=O)C1CCCC1)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C35767329_decoy,CASP3,Decoy,0,-8.67142,-7.06,-2.86,-8.098586971556777
COc1ccc(C(=O)N2CCO[C@H](CN(CC3CC3)C(=O)c3ccc(OC)c(OC)c3)C2)cc1OC,C35864244_decoy,CASP3,Decoy,0,-7.10838,-6.91,-1.74,-6.843371753608957
CCn1c(C)c(C(=O)CN(C[C@H]2CCCO2)S(=O)(=O)c2ccc(Cl)cc2)c(C)c1C(=O)OC,C35869484_decoy,CASP3,Decoy,0,-8.89644,-5.61,-1.73,-6.141464537138317
CC(=O)N1CCN(C(=O)c2coc(CN(CCc3c[nH]c4ccccc34)Cc3ccc(Cl)cc3)n2)CC1,C36064068_decoy,CASP3,Decoy,0,-8.60579,-8.39,-3.76,-6.971637809236018
CCn1c(SCC(=O)N2CCN(CC(=O)NC3CC3)CC2)nnc1-c1ccc(Cl)cc1Cl,C14239341_decoy,CASP3,Decoy,0,-9.25509,-6.75,-2.3,-6.961372553900938
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccco2)N(Cc2ccco2)C(=O)C#Cc2ccccc2)cc1,C36500081_decoy,CASP3,Decoy,0,-8.43177,-8.29,-0.99,-9.535893128035983
COCCn1nnnc1[C@@H](c1ccc(OC)c(OC)c1)N1CCN(c2nc3ccccc3s2)CC1,C19593926_decoy,CASP3,Decoy,0,-8.09153,-6.07,-2.7,-6.111830547077377
COc1cc(OC)c([C@H]2SCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1OC,C38806786_decoy,CASP3,Decoy,0,-6.25779,-5.97,-0.7,-5.601435583900513
COCCCN1C(=O)C[C@@](CC(=O)N(C)C[C@H]2N=NC3=C2CCCCC3)(c2ccccc2OC)C1=O,C39430109_decoy,CASP3,Decoy,0,-7.64148,-5.77,-2.93,-6.3895986771413735
CCOC(=O)c1c(Cn2cncn2)cc2cc(S(=O)(=O)C(C)C)c(F)cc2c1-c1cccc(O)c1,C39502838_decoy,CASP3,Decoy,0,-8.91595,-6.5,-0.51,-7.261703914628554
COc1cc(C(=O)N2[C@@H](C(=O)NCc3ccco3)CS[C@@H]2c2ccc(F)cc2)cc(OC)c1OC,C40362276_decoy,CASP3,Decoy,0,-6.60422,-6.37,-1.94,-6.181815913947769
CC(C)CN(C(=O)COC(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCS(=O)(=O)C1,C45399644_decoy,CASP3,Decoy,0,-8.72057,-7.35,-1.32,-6.809373146758508
O=C(CSc1nnc(-c2ccc(F)cc2)n1CCN1CCOCC1)N[C@H]1CCOc2ccccc21,C45447156_decoy,CASP3,Decoy,0,-7.87851,-7.36,-1.75,-5.977858276223784
CCN(CCNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1)c1cccc(C)c1,C45861803_decoy,CASP3,Decoy,0,-9.86024,-7.83,-2.34,-8.030778522765232
COc1cc(CCC(=O)OCC(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cc(OC)c1OC,C45874345_decoy,CASP3,Decoy,0,-9.30246,-7.32,-2.43,-6.529567356259104
COc1cc(C(=O)N2[C@@H](C(=O)NCc3ccccn3)CS[C@@H]2c2ccc(F)cc2)cc(OC)c1OC,C00960887_decoy,CASP3,Decoy,0,-7.60933,-6.97,-2.4,-6.779300853930731
COc1cc(C(=O)OCCN(C2=NS(=O)(=O)c3ccccc32)c2ccccc2)cc(OC)c1OC,C01461754_decoy,CASP3,Decoy,0,-7.66341,-7.89,-2.55,-7.473157758140887
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(Cl)c(C)c3)c(OC)c2)/C(=O)N=C2SC(C(C)C)=NN2/1,C26593237_decoy,CASP3,Decoy,0,-8.00801,-7.79,-1.86,-6.672774716366456
CCN(C(=O)[C@@H](C)OC(=O)CCC1=NC(=O)C2=C3CCCC[C@@H]3SC2=N1)[C@@H]1CCS(=O)(=O)C1,C39932081_decoy,CASP3,Decoy,0,-7.40559,-6.96,-0.78,-5.891015978478175
[H]/N=C1C(=C/c2ccc(OCCOc3ccccc3Cl)c(OCC)c2)/C(=O)N=C2SC(CC)=NN2/1,C27549685_decoy,CASP3,Decoy,0,-8.25991,-6.63,-0.95,-6.176231836590055
[H]/N=C1C(=C\c2cc(Br)c(OCCCOc3ccccc3)c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C20236387_decoy,CASP3,Decoy,0,-8.02735,-7.22,-1.8,-5.625913568622339
CC(=O)C1=C(C)C(C(=O)CSc2nnc(COc3ccc(Cl)cc3)n2Cc2ccco2)=N[C@H]1C,C40012356_decoy,CASP3,Decoy,0,-9.62941,-7.77,-2.5,-7.172375685457991
CCc1nnc2c3c4c(sc3nc(C)n12)CCC4,C00078274_decoy,CASP3,Decoy,0,-7.08031,-5.26,-0.59,-4.473749516207584
COc1ccc2nc3cc(Cl)ccc3[n+]([O-])c2c1,C04426043_decoy,CASP3,Decoy,0,-5.62828,-5.19,-1.82,-3.913504578618024
CC(C)=CC(=O)N1CCN(C(=O)C=C(C)C)CC1,C01622696_decoy,CASP3,Decoy,0,-4.79289,-5.02,-1.57,-3.554818610938874
Brc1ccc(/C=N\n2cnnc2)s1,C00255763_decoy,CASP3,Decoy,0,-5.98187,-4.2,-0.28,-4.5985926347568
Cc1ccc(C)c(S(=O)(=O)n2ccc(C)n2)c1,C02702338_decoy,CASP3,Decoy,0,-5.29855,-5.05,-1.22,-4.565275017122501
CN(C)C(=O)/C=C/c1cc(Cl)c2c(c1)OCO2,C14113452_decoy,CASP3,Decoy,0,-5.72389,-4.42,-1.51,-4.184437547377512
Cc1ccc(N2C(=O)[C@@H]3CSCN3C2=O)cc1,C01612876_decoy,CASP3,Decoy,0,-5.05127,-5.47,-2.21,-2.816731717434996
O=CCn1cnc2sc3c(c2c1=O)CCCC3,C01972951_decoy,CASP3,Decoy,0,-5.86381,-4.69,-0.12,-4.363249321492956
C/C=C(\C)C(=O)N1CCC(=O)N(CC(C)C)CC1,C20271255_decoy,CASP3,Decoy,0,-5.08578,-4.58,-5.11,-4.475482718756467
Cc1ccc(CN2CCc3nncn3CC2)c(C)c1,C20598606_decoy,CASP3,Decoy,0,-6.27364,-5.0,-0.3,-4.975153073710294
O=[N+]([O-])c1cnccc1I,C21982026_decoy,CASP3,Decoy,0,-3.98274,-2.99,-0.23,-2.4372291871944145
Cc1cc(C)nc(Sc2nc(C)cc(C)n2)n1,C25493056_decoy,CASP3,Decoy,0,-6.08385,-5.32,-2.38,-6.061668455321247
Cc1ccc(/C=C/C(=O)N2CCn3cccc3[C@H]2C)o1,C30265872_decoy,CASP3,Decoy,0,-5.80302,-6.22,-1.75,-4.62901061500726
CC1(C)OC[C@@H]([C@@H]2SC[C@H]3OC(C)(C)O[C@H]23)O1,C35566972_decoy,CASP3,Decoy,0,-6.98312,-5.03,-0.46,-3.30730728367079
Cc1csc2nc(-c3ccccn3)c(CC#N)n12,C36256013_decoy,CASP3,Decoy,0,-5.61303,-5.2,-1.99,-4.801793935740172
Cc1nn(C)c(Cl)c1CN1C[C@H](C)O[C@@H](C)C1,C37515170_decoy,CASP3,Decoy,0,-6.41967,-4.95,-1.78,-4.341729326898321
Cc1nc(Cn2cc(Br)cn2)oc1C,C38074868_decoy,CASP3,Decoy,0,-5.53567,-4.91,-2.19,-3.356294539180681
CC(C)C1=NC(=O)[C@H](C#N)C2=C1COC(C)(C)C2,C38573941_decoy,CASP3,Decoy,0,-6.18582,-4.81,0.01,-4.631002656842043
CCCC1=NC(=O)C2=C3C[C@H](C)OC[C@H]3SC2=N1,C39143094_decoy,CASP3,Decoy,0,-7.38974,-5.5,-0.62,-4.5256564581530005
CC1=C2C(=NN(c3ccccc3)[C@@H]2C)C(=S)N=N1,C39290156_decoy,CASP3,Decoy,0,-6.86931,-5.9,0.15,-4.936130936685983
CC[C@H]1C=C2C(=O)N=C(c3ccccn3)N=C2S1,C39312448_decoy,CASP3,Decoy,0,-5.53532,-5.46,-1.39,-4.309243655264807
CCOC(=O)c1sc2c(c1C)=C(C)CC(=O)N=2,C39606433_decoy,CASP3,Decoy,0,-7.3466,-6.02,-0.97,-7.27598351380382
CCC[C@@H](C#N)N1C(=O)CC2(CCCCC2)C1=O,C40222319_decoy,CASP3,Decoy,0,-5.62982,-4.93,-0.68,-4.157917675595225
Cc1nn(-c2c(CCl)c(C)nn2C)c(C)c1C,C40730692_decoy,CASP3,Decoy,0,-5.97649,-4.95,-1.96,-5.232667029022761
O=C=NC(=O)COc1cc(Cl)cc(Cl)c1,C41296811_decoy,CASP3,Decoy,0,-6.20014,-4.25,-1.2,-4.312303630845143
O=C(c1csnn1)N1CCCc2ccccc21,C41611318_decoy,CASP3,Decoy,0,-7.46007,-6.73,-0.64,-8.095296147821552
CC[C@H]1CN(c2nc3c(cc2C#N)CCC3)CCO1,C42249813_decoy,CASP3,Decoy,0,-6.37113,-4.87,-3.57,-4.282695132221577
Clc1nccnc1-n1cc(Br)cn1,C43538419_decoy,CASP3,Decoy,0,-6.0568,-3.95,-0.27,-3.6492401752343913
CCC(C#N)(CC)C(=O)N1CCO[C@@H]2CCC[C@H]21,C44767325_decoy,CASP3,Decoy,0,-5.06709,-4.58,-0.55,-3.526442278320129
C[C@@H]1CN(C(=O)c2cc(Cl)cn2C)[C@H](C)CO1,C45448751_decoy,CASP3,Decoy,0,-5.56033,-4.75,-0.85,-5.2814219708948364
CN(Cc1ccco1)c1snc(Cl)c1C#N,C47405249_decoy,CASP3,Decoy,0,-5.93339,-5.26,-2.46,-4.856125859091999
C[C@H](CC#N)C(=O)c1cc(Cl)c2c(c1)OCO2,C48259150_decoy,CASP3,Decoy,0,-6.49451,-5.67,-1.13,-5.411313066170987
Cc1c(C(=O)N2CCSCC2)oc2c1C(=O)CCC2,C48600647_decoy,CASP3,Decoy,0,-6.95711,-5.64,-0.63,-5.916297118277733
CC(C)(C)CC(=O)N1CCC2(CC1)OCCCO2,C49705944_decoy,CASP3,Decoy,0,-6.12785,-4.18,0.12,-4.21403592593818
Brc1ccc(-n2nnnc2C2CC2)cc1,C50309034_decoy,CASP3,Decoy,0,-5.82927,-5.23,-0.14,-4.612792754134127
N#Cc1cc2c(nc1N1CCCC[C@H]1C=O)CCC2,C54268084_decoy,CASP3,Decoy,0,-6.50001,-5.03,-1.23,-5.167547448767963
Cc1ccc(-n2ccnc2S(C)(=O)=O)cc1C,C57538207_decoy,CASP3,Decoy,0,-6.35301,-5.87,-1.39,-5.284636492019704
N#Cc1cccnc1N1CCOc2ccccc2C1,C58003373_decoy,CASP3,Decoy,0,-5.81987,-6.05,-0.45,-4.162404921359124
O=C1CCCC[C@@H]1Sc1nnc2ccccn12,C06115144_decoy,CASP3,Decoy,0,-5.70895,-5.23,-1.3,-4.643559218451853
C[C@@H]1CN(Cc2nnsc2Cl)C[C@@H](C)O1,C35164719_decoy,CASP3,Decoy,0,-7.56831,-4.19,-2.64,-4.922472342472381
Cc1noc(C)c1CC(=O)N1C[C@H](C)C[C@@H](C)C1,C47339817_decoy,CASP3,Decoy,0,-5.72954,-5.35,-0.82,-4.600855574515329
C[C@]1(n2nc(C(F)F)cc2S)CCS(=O)(=O)C1,C61629208_decoy,CASP3,Decoy,0,-6.81248,-4.49,-0.89,-4.656264487590376
Cc1cc(C(=O)[C@@H](C)Cl)c(C)n1-c1cnoc1,C61685587_decoy,CASP3,Decoy,0,-5.93483,-4.11,-1.2,-3.918909825855106
N#C[C@@H]1CCC[C@@H]1N1C(=O)CC2(CCCCC2)C1=O,C61890009_decoy,CASP3,Decoy,0,-5.59247,-5.66,-0.97,-4.419070895688572
Cn1nnnc1C[C@H](Br)C(C)(C)C,C63045279_decoy,CASP3,Decoy,0,-6.03818,-3.99,-0.37,-5.004495178891021
CC1=CC(C)=NC(=O)[C@@H]1c1cc(C(F)(F)F)no1,C63172862_decoy,CASP3,Decoy,0,-5.17962,-5.11,-0.13,-2.944951451341788
C[C@H]1C=N/C(=N\C(=O)/C=C/c2ccccc2C#N)S1,C63182453_decoy,CASP3,Decoy,0,-5.89738,-5.37,-0.61,-5.6313848950237215
C[C@@H]1C[C@@H](C)CN(C(=O)Cn2cc(Cl)cn2)C1,C63457317_decoy,CASP3,Decoy,0,-5.66392,-5.35,-2.43,-4.914658675149546
CN(C)S(=O)(=O)N1CC2C[C@@H]3CC1C[C@H](C2)C3,C65974441_decoy,CASP3,Decoy,0,-6.72426,-4.54,-1.05,-4.338464854512085
C[C@H]1CN(Cn2cc(Br)cn2)C[C@H](C)O1,C66349241_decoy,CASP3,Decoy,0,-7.17327,-5.33,-2.43,-5.002451058984683
NC(=O)c1ccsc1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1,C07141435_decoy,CASP3,Decoy,0,-7.39932,-7.0,-3.39,-5.610003446267432
O=C(Cc1csc(NC(=O)NCc2ccccn2)n1)NC[C@@H]1CCCO1,C09650778_decoy,CASP3,Decoy,0,-7.82972,-5.39,-1.56,-5.563368446805
NS(=O)(=O)c1ccc(CNC(=O)c2ccc(Cn3cncn3)cc2)s1,C11370038_decoy,CASP3,Decoy,0,-8.70318,-5.5,-3.71,-4.582180403115704
O=C(Cc1csc(NC(=O)c2ccc(=O)[nH]c2)n1)NC[C@H]1CCCO1,C12440003_decoy,CASP3,Decoy,0,-8.1375,-6.08,-1.19,-6.03752626571258
CN(CC(=O)NNC(=O)c1cccc(O)c1)S(=O)(=O)c1cccs1,C12917598_decoy,CASP3,Decoy,0,-8.81645,-7.03,-1.45,-6.492530608911129
C[C@@H](OC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC(=O)NC(C)(C)C,C12948522_decoy,CASP3,Decoy,0,-7.12252,-7.53,-2.01,-5.918346722146177
Cc1c(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cnn1C,C13297093_decoy,CASP3,Decoy,0,-8.02354,-6.75,-0.76,-7.447316722033557
Cc1c(Cl)c(C(F)F)nn1[C@@H](C)C(=O)Nc1cnn(C)c1C(N)=O,C02778175_decoy,CASP3,Decoy,0,-7.17385,-5.59,-0.48,-6.625234325609562
Cc1cc(C)cc(C(=O)NCC(=O)OCC(=O)N2CCC(C(N)=O)CC2)c1,C22660891_decoy,CASP3,Decoy,0,-7.93617,-7.26,-2.58,-8.09881936294324
C[C@@H](Sc1nncn1C1CC1)C(=O)Nc1cccc(S(N)(=O)=O)c1,C24965214_decoy,CASP3,Decoy,0,-8.3206,-6.18,-2.92,-6.458450629624092
NS(=O)(=O)NC[C@H]1CCCN(S(=O)(=O)c2cnc(Cl)s2)C1,C38108939_decoy,CASP3,Decoy,0,-9.55603,-6.98,0.41,-13.859256326367078
O=CC[C@@H](NC=O)c1ccc(S(=O)(=O)Oc2ccccc2)c(O)c1O,C39496647_decoy,CASP3,Decoy,0,-7.86777,-6.37,-0.22,-7.132180986509026
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCCO2)c1,C43108436_decoy,CASP3,Decoy,0,-6.81636,-6.11,-0.45,-5.127867150206451
CC(C)n1cnnc1SCC(=O)NCc1ccc(S(N)(=O)=O)cc1,C09212846_decoy,CASP3,Decoy,0,-8.29779,-7.33,-2.64,-7.259320755218851
CNC(=O)C1CCN(C(=O)/C=C/c2ccc(OCC(N)=O)c(OC)c2)CC1,C45350825_decoy,CASP3,Decoy,0,-8.35128,-5.29,-1.01,-5.146144627746168
C[C@@]1(NNC(=O)NCCc2cnn(-c3ccccc3)c2)CCS(=O)(=O)C1,C45424359_decoy,CASP3,Decoy,0,-6.11528,-5.77,-0.23,-4.673330138083853
C[C@]1(NNC(=O)NCc2cccnc2OCC(F)(F)F)CCS(=O)(=O)C1,C45942027_decoy,CASP3,Decoy,0,-7.53204,-6.42,-0.88,-6.609836047003395
Cc1nccn1-c1cc(CNC(=O)NNC(=O)c2ccccc2F)ccn1,C46101936_decoy,CASP3,Decoy,0,-5.7268,-7.71,-1.22,-5.41012335310942
C[C@@H](CNC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)N(C)c1ccccc1,C46345218_decoy,CASP3,Decoy,0,-7.67838,-7.84,-1.44,-6.100619053169949
C#CCNC(=O)CNC(=O)C(=O)Nc1ccc(OC(F)F)c2ncccc12,C51808662_decoy,CASP3,Decoy,0,-7.07406,-5.38,-1.96,-5.560347110702064
CC[C@@H](CO)NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1,C57924020_decoy,CASP3,Decoy,0,-7.07973,-5.46,-1.36,-5.603804540375812
CC(C)(C)NC(=O)CNC(=O)CCNC1=NS(=O)(=O)c2ccccc21,C06986134_decoy,CASP3,Decoy,0,-6.12969,-5.69,-1.86,-6.767347376487376
CC[C@@H](C)NC(=O)CCNC(=O)c1cc(C2CC2)nc2c1c(=O)[nH]n2C,C58498336_decoy,CASP3,Decoy,0,-7.75147,-6.76,-1.2,-8.788187027056015
Cc1nc2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc2n1-c1ccccc1,C17806229_decoy,CASP3,Decoy,0,-6.56071,-6.11,-1.91,-5.199421209944127
CCNC(=O)[C@@H](C)NC(=O)NCCS(=O)(=O)N1CCc2ccccc21,C48094427_decoy,CASP3,Decoy,0,-7.21113,-7.31,-3.01,-7.288666033772055
COc1cc(C(=O)NNC(=S)NC[C@@H]2CCCO2)cc2c1OCCO2,C14843931_decoy,CASP3,Decoy,0,-7.47915,-5.5,-1.53,-5.763081952522745
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NCc2c(C)noc2C)c1,C63230745_decoy,CASP3,Decoy,0,-7.37246,-6.69,-1.96,-6.007133311071309
O=C(CNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)Nc1cn[nH]c1,C63533730_decoy,CASP3,Decoy,0,-6.81568,-7.17,-2.53,-6.298771644569416
CC(=O)C1=C(C)C(C(=O)OCC(=O)Nc2sccc2C(N)=O)=N[C@H]1C,C40017098_decoy,CASP3,Decoy,0,-8.14207,-6.46,-2.15,-6.056483962409537
Cc1ccc(N2CC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)C2=O)cc1C,C64749285_decoy,CASP3,Decoy,0,-7.55253,-6.97,-1.74,-6.51511689775777
O=C(Cc1csc(-c2ccccn2)n1)NNC(=O)NC[C@@H]1CCCO1,C65146942_decoy,CASP3,Decoy,0,-9.67113,-6.88,-1.37,-6.522212429350096
O=C(NC[C@@H]1CCCO1)NNC(=O)c1ccc(Cl)cc1N1CCCC1=O,C65147049_decoy,CASP3,Decoy,0,-7.21455,-6.4,-3.44,-5.796775112033087
COCCCNC(=O)NNC(=O)C[C@@H]1c2ccccc2CCN1C(C)=O,C65207140_decoy,CASP3,Decoy,0,-6.95066,-5.6,-2.67,-5.670843582480278
NC(=O)CC[C@H]1CCCN(C(=O)C(=O)Nc2cccc3c2OCCO3)C1,C66221904_decoy,CASP3,Decoy,0,-9.43425,-6.87,-1.99,-7.867946691065916
COc1cc(C)c(NC(=O)C(=O)N2CCC[C@@H](CCC(N)=O)C2)cc1OC,C66222175_decoy,CASP3,Decoy,0,-8.65511,-6.05,-0.97,-5.128672060303168
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(CC(N)=O)C1,C66449538_decoy,CASP3,Decoy,0,-8.48854,-6.21,-1.16,-9.189425591838123
Cc1cc2nc(C)c(CCC(=O)N[C@H]3CCCN(CC(N)=O)C3)c(C)n2n1,C66451438_decoy,CASP3,Decoy,0,-9.94142,-6.11,-1.56,-8.093662585809554
CC(=O)NCCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1,C66688523_decoy,CASP3,Decoy,0,-6.47362,-6.28,-2.29,-5.822810332556033
C[C@@H](NC(=O)C1CCOCC1)C(=O)NCc1nc(-c2cccs2)n[nH]1,C66840152_decoy,CASP3,Decoy,0,-8.5911,-7.57,-1.88,-7.305474414682181
C[C@@]1(NNC(=O)NCc2ccc(-n3ccnc3)cc2)CCS(=O)(=O)C1,C66986165_decoy,CASP3,Decoy,0,-7.74199,-6.8,-0.65,-6.458460028443412
CC(=O)Nc1ccc([N-]S(C)(=O)=O)c(C(=O)NC[C@H]2CC[NH+](C(C)C)C2)c1,C67043883_decoy,CASP3,Decoy,0,-8.55541,-5.87,-1.23,-6.932726409718804
CC(C)n1c(CCNC(=O)c2ccc3c(c2)NC(=O)CN3C)n[nH]c1=S,C67074729_decoy,CASP3,Decoy,0,-6.62613,-6.43,-2.27,-5.0057415243146455
CCn1c(CCNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)n[nH]c1=S,C67076900_decoy,CASP3,Decoy,0,-7.16991,-6.16,-3.8,-5.851942857928904
CCn1c(CCNC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)n[nH]c1=S,C67076902_decoy,CASP3,Decoy,0,-8.65184,-5.42,-1.11,-6.183774965097622
O=C(NCCc1n[nH]c(=S)n1C1CC1)c1ccc(-c2ccco2)[nH]c1=O,C67093534_decoy,CASP3,Decoy,0,-7.70731,-6.76,-1.45,-5.572268846997717
N#Cc1ccc(C(=O)NCC(=O)NCCc2n[nH]c(=S)n2C2CC2)cc1,C67119283_decoy,CASP3,Decoy,0,-6.76509,-6.08,-4.3,-3.20483815713287
Cc1ccc(C(=O)NCC(=O)N(C)CCc2ccccn2)cc1S(N)(=O)=O,C67194532_decoy,CASP3,Decoy,0,-8.20377,-7.5,-2.59,-7.538676554765963
CC(C)(C)CC(=O)N[C@H]1CN[C@H](C(=O)NCc2nnc3n2CCCCC3)C1,C67446882_decoy,CASP3,Decoy,0,-8.1374,-6.68,-3.24,-6.313430688676703
Cc1ccc(CNC(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)cn1,C67602878_decoy,CASP3,Decoy,0,-6.81645,-6.54,-0.97,-5.372451518767175
C[C@@H](NC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)c1nnc2n1CCC2,C67612155_decoy,CASP3,Decoy,0,-7.69203,-5.99,-1.61,-5.687149924209167
C[C@@H](CNC(=O)[C@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-])NC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-],C06794641_decoy,CASP3,Decoy,0,-7.99393,-7.08,-0.94,-8.819315006316343
CCOC(=O)c1ncn([C@@H]2O[C@H](COP(=O)([O-])[O-])[C@H]3OC(C)(C)O[C@@H]32)c1N,C12663436_decoy,CASP3,Decoy,0,-6.5806,-7.76,-0.5,-7.809542005780627
Cc1cccc(-n2c(SCC(=O)Nc3cc(C(=O)[O-])cc(C(=O)[O-])c3)nnc2N2CCOCC2)c1,C13194649_decoy,CASP3,Decoy,0,-7.94043,-8.18,-3.05,-6.850641014796367
Cc1ccc(-n2nnnc2SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)cc1C,C13233318_decoy,CASP3,Decoy,0,-7.40607,-7.19,-3.14,-6.534839182254036
Cc1cccc(-n2nnnc2SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1C,C13235275_decoy,CASP3,Decoy,0,-7.84954,-8.06,-1.73,-10.07567290231161
Cc1ccc(-c2nnc(SCC(=O)NCc3ccc(C(=O)[O-])cc3)n2CC(=O)[O-])cc1,C13235518_decoy,CASP3,Decoy,0,-7.92327,-6.52,-1.3,-5.804317570725559
C[C@H](NC(=O)c1ccc(Sc2nnc(-c3cccs3)n2[C@@H](C)C(=O)[O-])c([N+](=O)[O-])c1)C(=O)[O-],C13274280_decoy,CASP3,Decoy,0,-7.40722,-6.14,-3.73,-6.512187510083654
C[C@H](NC(=O)c1ccc(Sc2nc3cc(C(=O)[O-])ccc3c(=O)n2C)c([N+](=O)[O-])c1)C(=O)[O-],C13274399_decoy,CASP3,Decoy,0,-6.57624,-8.06,-1.88,-8.09228722340192
O=C([O-])CCn1c(Sc2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])nc2ccccc2c1=O,C13274457_decoy,CASP3,Decoy,0,-4.75595,-5.75,-0.86,-4.506541802016614
O=C(CSc1nnc(Cn2cncn2)o1)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13318405_decoy,CASP3,Decoy,0,-7.59896,-6.29,-1.87,-6.185816132806659
Cn1c(SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)nnc1C1CC1,C13318604_decoy,CASP3,Decoy,0,-8.00366,-7.04,-1.41,-7.00694267824228
O=C(CSc1nnc(C2CC2)n1C1CC1)Nc1cc(C(=O)[O-])ccc1C(=O)[O-],C13402516_decoy,CASP3,Decoy,0,-7.31177,-7.25,-1.15,-6.221750755670502
Cc1occc1-c1nnc(SCC(=O)Nc2cc(C(=O)[O-])ccc2C(=O)[O-])n1C,C13418081_decoy,CASP3,Decoy,0,-7.59677,-6.15,-1.23,-6.51004251700542
Cc1c(CCC(=O)N[C@@H](C)C(=O)[O-])c(=O)oc2c(C)c(OCc3nnn[n-]3)ccc12,C13555528_decoy,CASP3,Decoy,0,-6.23456,-8.48,-2.3,-6.9920109717593695
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)[O-])cc1C,C14097348_decoy,CASP3,Decoy,0,-8.04797,-7.77,-1.92,-7.637746312791136
CCOc1cc(C(=O)Nc2cc(C(=O)[O-])ccc2C)ccc1OCC(=O)[O-],C14169754_decoy,CASP3,Decoy,0,-7.85654,-7.21,-1.6,-10.591107513058104
CCOc1cc(/C=C2\SC(=S)N([C@H](CC(=O)[O-])C(=O)[O-])C2=O)ccc1O,C15223338_decoy,CASP3,Decoy,0,-8.16388,-6.3,-0.49,-6.855504922112301
C/C(=C\CNc1ncnc2c1ncn2[C@@H]1CCCCO1)COP(=O)([O-])[O-],C16953255_decoy,CASP3,Decoy,0,-6.92307,-6.08,-0.77,-5.571801941647105
CC(C)(CNC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-])CNC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-],C17098968_decoy,CASP3,Decoy,0,-7.27119,-7.5,-1.77,-8.515309362242078
O=[P@]([O-])(O)c1ccccc1NCCNc1ccccc1[P@@](=O)([O-])O,C19949919_decoy,CASP3,Decoy,0,-6.4223,-7.65,-1.28,-7.8048957839782735
O=C([O-])COc1ccccc1/C=N/n1c([S-])nnc1-c1cc(-c2ccccc2)n[nH]1,C18068972_decoy,CASP3,Decoy,0,-7.89133,-6.15,-1.11,-6.33438117813442
CS(=O)(=O)[N-]c1ccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3nccs3)cc2)cc1Cl,C22523187_decoy,CASP3,Decoy,0,-8.75622,-6.64,-1.12,-6.391370553411563
O=S(=O)([O-])c1ccc(N/N=C/C=N/Nc2ccc(S(=O)(=O)[O-])cc2)cc1,C33387219_decoy,CASP3,Decoy,0,-8.39788,-6.34,-0.28,-7.736342762677145
Cc1ccc(C2=N[C@H](NC(=O)CSc3nnc(CCC(=O)[O-])c([O-])n3)SC2)cc1,C39156646_decoy,CASP3,Decoy,0,-8.68985,-5.62,-1.58,-6.538284158458946
C[C@@H](Sc1nnc(CCC(=O)[O-])c([O-])n1)C(=O)NC(=O)NC(C)(C)C,C13015367_decoy,CASP3,Decoy,0,-8.75639,-7.08,-2.36,-5.959278566998483
[NH-]S(=O)(=O)c1ccc(CNC(=O)CSc2nnc(CCC(=O)[O-])c(O)n2)cc1,C13235740_decoy,CASP3,Decoy,0,-8.34559,-7.68,-1.38,-7.788595653397138
O=C([O-])CCc1nnc(SCC(=O)NNC(=O)C[C@@H]2CCS(=O)(=O)C2)nc1[O-],C13235872_decoy,CASP3,Decoy,0,-8.2978,-7.85,-2.52,-6.5778951984459
Cc1nc(SCC(=O)N[C@H]2CCS(=O)(=O)C2)nc([O-])c1CCC(=O)[O-],C13448367_decoy,CASP3,Decoy,0,-8.53856,-6.97,-4.63,-7.842692228771352
Cc1nc(SCC(=O)NC(=O)NC2CCCC2)nc([O-])c1CCC(=O)[O-],C13448421_decoy,CASP3,Decoy,0,-7.14608,-7.19,-1.5,-7.132784270133155
Cc1nc(SCC(=O)NC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)nc([O-])c1CCC(=O)[O-],C13449279_decoy,CASP3,Decoy,0,-7.44834,-6.78,-2.17,-6.348810152022796
Cc1nc(SCC(=O)NC(=O)N[C@@H]2CCCC[C@H]2C)nc([O-])c1CCC(=O)[O-],C13449298_decoy,CASP3,Decoy,0,-7.88806,-6.31,-2.37,-5.042594136637002
CCOC(=O)[C@H]1NC(C)=C(C(=O)CSc2nc(C)c(CCC(=O)[O-])c([O-])n2)[C@H]1C,C39693234_decoy,CASP3,Decoy,0,-7.19308,-6.75,-2.21,-5.795654097184897
Cc1ccc(NC(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)c([N+](=O)[O-])c1,C13092671_decoy,CASP3,Decoy,0,-6.31136,-6.19,-2.23,-4.968295987044743
COC(=O)[C@@H]1C2=C(CCCCC2)S[C@@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703827_decoy,CASP3,Decoy,0,-9.77105,-8.21,-3.19,-11.58617916671596
Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C13092774_decoy,CASP3,Decoy,0,-6.06389,-6.63,-1.24,-5.457621014476559
O=C([O-])CCc1nnc(SCC(=O)N[C@@H]2SC3=C(CCCC3)[C@@H]2C(=O)c2ccccc2)nc1[O-],C39704035_decoy,CASP3,Decoy,0,-7.50422,-6.24,-1.89,-5.864708971542767
C[C@@H]1C=C(C(=O)CSc2nnc(CCC(=O)[O-])c(O)n2)[C@@H](C)N1c1ccc(S([NH-])(=O)=O)cc1,C39704517_decoy,CASP3,Decoy,0,-9.2362,-8.11,-1.88,-7.384267805750568
CO[C@]1(NC(=O)[C@H](C(=O)[O-])c2ccc(O)cc2)C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CC[C@@H]21,C40724190_decoy,CASP3,Decoy,0,-9.04596,-7.63,-0.82,-7.898041902240112
COC(=O)c1c(NC(=O)CSc2nc(C)c(CCC(=O)[O-])c([O-])n2)sc2c1CCC2,C13448030_decoy,CASP3,Decoy,0,-7.92479,-7.37,-1.29,-7.419431523276319
Cc1nc(SCC(=O)NC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)nc([O-])c1CCC(=O)[O-],C46302357_decoy,CASP3,Decoy,0,-6.94807,-7.95,-2.47,-7.042211166153184
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c1,C13196883_decoy,CASP3,Decoy,0,-7.23995,-8.11,-2.64,-8.646361588069691
C=C(C/C=C/[C@@](O)(C(=O)[O-])[C@H](O)[C@@H](C)CC)CC/C([O-])=C1/C(=O)C[C@H](C)OC1=O,C13312160_decoy,CASP3,Decoy,0,-8.03918,-7.38,-1.27,-11.093769030032728
COc1cc(/C=C2/SC([N-]c3ccc(NC(C)=O)cc3)=NC2=O)ccc1O[C@@H](C)C(=O)[O-],C16914649_decoy,CASP3,Decoy,0,-8.61313,-7.67,-1.67,-7.655663161856413
COc1cc(/C=C2/SC([N-]c3ccc(O)cc3)=NC2=O)ccc1O[C@H](C)C(=O)[O-],C16914676_decoy,CASP3,Decoy,0,-6.57226,-6.97,-2.87,-6.047909211747327
CCOc1cc(/C=C2/SC([N-]c3ccc(NC(C)=O)cc3)=NC2=O)ccc1OCC(=O)[O-],C16916190_decoy,CASP3,Decoy,0,-7.98189,-7.5,-1.49,-7.987336947372171
O=C1N=C([N-]c2ccc(S(=O)(=O)[N-]c3nccs3)cc2)S[C@@H]1CCO,C39843647_decoy,CASP3,Decoy,0,-7.8717,-5.59,-2.28,-7.547406797497701
CSc1nsc(SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)n1,C59352889_decoy,CASP3,Decoy,0,-8.35363,-5.49,-0.74,-6.441352780195851
O=C([O-])/C=C/C(=O)Nc1cccc(C#C/C=C/c2cccc(NC(=O)/C=C/C(=O)[O-])c2)c1,C59383315_decoy,CASP3,Decoy,0,-8.08306,-7.91,-2.09,-8.654413706806473
NC(=O)c1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])cc1,C63182314_decoy,CASP3,Decoy,0,-8.26091,-6.45,-0.67,-6.353281902564209
CCNC(=O)Cn1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)n1,C67245179_decoy,CASP3,Decoy,0,-7.65911,-6.85,-0.64,-6.315016588617302
CCOC(=O)c1c(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)sc2c1CC[C@H](C)C2,C02520234_decoy,CASP3,Decoy,0,-8.09923,-6.6,-4.89,-6.572301915980037
CCOC(=O)c1sc(NC(=O)Cn2nc(C(=O)[O-])c3ccccc3c2=O)c(C(=O)OCC)c1C,C03371029_decoy,CASP3,Decoy,0,-7.96607,-6.2,-3.07,-7.535729163726911
COc1cc(C)cc2oc(=O)c(CC(=O)NCCCCCC(=O)N3CCC(C(=O)[O-])CC3)c(C)c12,C12885914_decoy,CASP3,Decoy,0,-5.97812,-7.89,-2.05,-5.595736467881963
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(CCCNC(C)=O)cc2)cs1,C13031555_decoy,CASP3,Decoy,0,-8.41703,-8.03,-1.08,-7.206670981462508
COC[C@@H](C)n1c(C)cc(C(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C[C@@H](C)O)c1C,C13051664_decoy,CASP3,Decoy,0,-8.17213,-7.87,-2.02,-7.176947874868688
Cc1ccc(NC(=O)CN(C)C(=O)[C@@H](C)Sc2nnc(-c3cccs3)n2CCC(=O)[O-])cc1,C13193207_decoy,CASP3,Decoy,0,-8.73847,-6.8,-2.53,-10.11579296891686
CCOc1cc2c(cc1CNC(=O)CSc1nnc(-c3cccs3)n1CC(=O)[O-])O[C@H](C)C2,C13220276_decoy,CASP3,Decoy,0,-9.50449,-7.13,-2.81,-9.989601782736184
CCOc1cc2c(cc1CNC(=O)CSc1nnc(-c3cccs3)n1CC(=O)[O-])O[C@@H](C)C2,C13220277_decoy,CASP3,Decoy,0,-8.7055,-6.43,-2.88,-6.94566894697481
CCOC(=O)c1c(NC(=O)CSc2nc3ccccc3c(=O)n2CCC(=O)[O-])sc(C)c1C,C13221137_decoy,CASP3,Decoy,0,-8.33535,-7.22,-1.62,-7.409337490111546
CCOC(=O)c1c(NC(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)sc(C)c1CC,C13221856_decoy,CASP3,Decoy,0,-7.93775,-7.15,-1.27,-6.304110688389882
CCOC(=O)c1c(NC(=O)CSc2nc3ccccc3c(=O)n2CC(=O)[O-])sc(C)c1CC,C13222813_decoy,CASP3,Decoy,0,-9.11278,-7.01,-1.58,-6.569641905425864
COCCCn1c(C)c(C)c(C#N)c1NC(=O)CSc1ncc(C(=O)[O-])n1-c1ccc(F)cc1,C13236981_decoy,CASP3,Decoy,0,-7.45576,-7.42,-2.64,-6.822877429531464
Cc1cccc(-c2nnc(SCC(=O)NCCc3ccc4c(c3)OCCO4)n2CCC(=O)[O-])c1,C13403716_decoy,CASP3,Decoy,0,-9.27339,-7.77,-2.36,-6.669265730690699
Cc1ccc2nc(NCc3ccco3)c(/C=C3\SC(=S)N(CCCCCC(=O)[O-])C3=O)c(=O)n2c1,C15230300_decoy,CASP3,Decoy,0,-9.38368,-5.79,-1.71,-6.562648908358874
COc1ccc(OCc2ccc(C(=O)N[C@H]3C(=O)N4C(C(=O)[O-])=C(COC(C)=O)CS[C@H]34)o2)cc1,C15947434_decoy,CASP3,Decoy,0,-8.95166,-7.17,-2.39,-5.680002720767689
COc1ccc(OCc2ccc(C(=O)N[C@@H]3C(=O)N4C(C(=O)[O-])=C(COC(C)=O)CS[C@H]34)o2)cc1,C15947436_decoy,CASP3,Decoy,0,-7.84116,-6.64,-0.44,-7.180291746886444
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@@H]2c2ccc(F)cc2)c1C,C08905484_decoy,CASP3,Decoy,0,-8.13223,-7.43,-2.0,-11.203588032705882
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@H]2c2ccc(C)cc2)c1C,C09008421_decoy,CASP3,Decoy,0,-9.23354,-7.9,-2.86,-8.18658859038362
COc1cc(OC)cc(C(=O)N(CCCNC(=O)c2nc([O-])c3ccccc3n2)Cc2ccccc2)c1,C22471791_decoy,CASP3,Decoy,0,-8.49963,-7.71,-1.05,-7.396661222594272
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2ccc(OC)cc2)c1C,C09282178_decoy,CASP3,Decoy,0,-8.01704,-6.03,-2.94,-6.121967732291235
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2cccc(OC)c2)c1C,C33515751_decoy,CASP3,Decoy,0,-8.70207,-5.66,-3.01,-6.638723761972472
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2cccc(OC)c2)c1C,C33515752_decoy,CASP3,Decoy,0,-8.18647,-7.39,-2.7,-8.528601754421409
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(Br)cc2)cc1,C09459130_decoy,CASP3,Decoy,0,-8.80294,-5.89,-2.01,-7.157658998464103
CSCC[C@H](NC(=O)CCC(=O)O[C@@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)[O-],C12878111_decoy,CASP3,Decoy,0,-8.64275,-6.68,-1.73,-5.771084138163029
CCOc1ccccc1CN1CCN(C(=S)Nc2ccc(S(=O)(=O)[N-]c3nccs3)cc2)CC1,C39968952_decoy,CASP3,Decoy,0,-10.5226,-6.62,-1.83,-7.309025107750702
CCOc1ccccc1[C@@H]1C(C(=O)c2ccc(Br)cc2)=C([O-])C(=O)N1CCOCCO,C40076940_decoy,CASP3,Decoy,0,-8.43559,-7.73,-1.9,-8.533016112942047
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(Br)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40077015_decoy,CASP3,Decoy,0,-8.63402,-6.01,-4.05,-7.205789753888474
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(Br)cc2)cc1C,C40085549_decoy,CASP3,Decoy,0,-8.87849,-6.29,-1.62,-8.071666983484992
COc1cc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc(OC)c1OC,C40093349_decoy,CASP3,Decoy,0,-7.91985,-6.27,-1.49,-6.767502600684622
COc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOCCO)c(OC)c1,C40095159_decoy,CASP3,Decoy,0,-8.54413,-5.49,-1.67,-7.441072576409874
COc1cccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOCCO)c1OC,C40095186_decoy,CASP3,Decoy,0,-8.73513,-7.6,-1.14,-8.998937415247797
COc1ccc(OC)c([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCOCCO)c1,C40095197_decoy,CASP3,Decoy,0,-7.60757,-6.44,-2.38,-6.921529281786702
COc1ccc(OC)c([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOCCO)c1,C40095198_decoy,CASP3,Decoy,0,-7.78712,-6.18,-3.05,-7.452574880083738
COc1ccc(OC)c([C@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCOCCO)c1,C40095200_decoy,CASP3,Decoy,0,-8.26899,-6.59,-1.17,-7.555730205722595
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCO)cc1OC,C40095437_decoy,CASP3,Decoy,0,-7.87864,-6.18,-1.73,-8.854288994428106
COc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1OC,C40096313_decoy,CASP3,Decoy,0,-8.64254,-6.36,-2.48,-7.145037418953547
COc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1OC,C40096314_decoy,CASP3,Decoy,0,-7.93732,-7.06,-1.59,-7.694758718560768
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1,C40096359_decoy,CASP3,Decoy,0,-7.88904,-5.57,-1.92,-6.62314153969426
COc1cccc2cc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@@H]3c3ccc(SC)cc3)oc12,C40097936_decoy,CASP3,Decoy,0,-7.15194,-5.46,-1.83,-5.650957469783214
COc1cccc2cc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@H]3c3ccc(SC)cc3)oc12,C40097938_decoy,CASP3,Decoy,0,-8.16293,-6.99,-1.97,-6.805819962223648
CN(C)S(=O)(=O)c1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(Cl)c2)cc1,C40110470_decoy,CASP3,Decoy,0,-9.33903,-7.16,-0.84,-7.354871468173754
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(NC(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)cc1,C41105288_decoy,CASP3,Decoy,0,-8.88294,-6.85,-1.13,-8.381785886202865
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1ccc(OC(C)=O)cc1,C33869036_decoy,CASP3,Decoy,0,-7.49282,-7.64,-2.12,-6.946399196811496
COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nc(C)c(CCC(=O)[O-])c(=O)[nH]3)c2C)cc1,C13448334_decoy,CASP3,Decoy,0,-7.842,-8.24,-2.08,-10.182198311517189
COc1cc(CNC(=O)CCn2c([S-])nnc2-c2cccc(C)c2)ccc1OCC(=O)N(C)C,C46841900_decoy,CASP3,Decoy,0,-11.245,-7.31,-2.78,-9.442459387181628
O=C([O-])CCCCCNC(=O)CCN1C(=O)/C(=C/c2cc(Br)ccc2O)SC1=S,C15038514_decoy,CASP3,Decoy,0,-9.22272,-6.47,-2.82,-6.447542454926364
CCO/C([O-])=C1\C(COCCN2C(=O)CNC2=O)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C29487564_decoy,CASP3,Decoy,0,-8.555,-7.6,-4.2,-8.11227030927566
CCO/C([O-])=C1\C(COCCN2C(=O)CNC2=O)=NC(C)=C(C(=O)OC)[C@@H]1c1ccccc1Cl,C29487561_decoy,CASP3,Decoy,0,-8.8758,-6.06,-2.38,-9.408597887377462
COc1ccc([C@@H]2CC(=O)C(/C=N/CCN3CCN(C(=S)Nc4ccccc4)CC3)=C([O-])C2)cc1OC,C13572153_decoy,CASP3,Decoy,0,-7.7495,-7.12,-2.61,-6.66212692025614
COc1cc(C(=O)NNC(=O)c2ccc(Cl)c([N-]S(C)(=O)=O)c2)ccc1OCCC(C)C,C62613448_decoy,CASP3,Decoy,0,-10.3009,-6.52,-1.55,-7.838232949310913
C[C@H](NC1=NC(=O)/C(=C/c2ccccc2-n2cccn2)S1)C(=O)[O-],C05720648_decoy,CASP3,Decoy,0,-7.73688,-6.01,-1.85,-5.563314311322237
Cc1ccc(N2/C(=N/C(=O)COCC(=O)[O-])S[C@@H]3CS(=O)(=O)C[C@H]32)cc1,C05325061_decoy,CASP3,Decoy,0,-6.23636,-6.34,-0.4,-5.131862553964769
CCN(C(C)=O)c1nc(/C=C2\SC(=S)N(CCC(=O)[O-])C2=O)cs1,C13269113_decoy,CASP3,Decoy,0,-7.57955,-5.63,-2.23,-6.15689078821324
O=C([O-])c1cccnc1SCC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1,C13317932_decoy,CASP3,Decoy,0,-7.49106,-6.08,-1.91,-5.941171898526905
CCN(C(=O)CSc1nc(CC(=O)[O-])cs1)[C@H]1CCS(=O)(=O)C1,C13415667_decoy,CASP3,Decoy,0,-8.45593,-5.34,-2.2,-9.095490817213296
COc1cc(/C=N/N=C2\S[C@H](CC(=O)[O-])C(=O)N2C)cc(OC)c1OC,C13464754_decoy,CASP3,Decoy,0,-8.7263,-5.07,-0.63,-7.6286745823628035
COc1cc(/C=C(\C#N)C(=O)N2CCOCC2)ccc1OCC(=O)[O-],C16196160_decoy,CASP3,Decoy,0,-6.86123,-6.43,-0.94,-5.981377097471701
CCS(=O)(=O)N1CCN(C(=O)c2ccn(CC(=O)[O-])n2)CC1,C20316489_decoy,CASP3,Decoy,0,-5.77167,-6.14,-0.92,-5.607595404026959
CCN(Cc1c(C)nn(CC)c1C)C(=O)c1ccn(CC(=O)[O-])n1,C20316499_decoy,CASP3,Decoy,0,-6.22885,-4.76,-1.03,-7.39763628990311
CCn1cc(CN(C)C(=O)c2ccn(CCC(=O)[O-])n2)c(C)n1,C20318210_decoy,CASP3,Decoy,0,-6.66752,-4.7,-1.3,-5.922956261716684
CCn1nc(C)c(CN(C)C(=O)[C@@H](C)n2cc(C(=O)[O-])cn2)c1C,C20327806_decoy,CASP3,Decoy,0,-5.55885,-5.0,-0.74,-4.838601557198848
O=C([O-])C[C@@H]1CCN(C(=O)c2ccno2)C[C@@H]1CCN1CCOCC1,C12481236_decoy,CASP3,Decoy,0,-7.0792,-5.32,-4.12,-5.561283750502862
C=CCN1/C(=N/C(=O)COCC(=O)[O-])S[C@@H]2CS(=O)(=O)C[C@H]21,C32504413_decoy,CASP3,Decoy,0,-7.28708,-5.71,-1.15,-5.817730510784987
O=C(/C=C/c1ccco1)C1=C([O-])C(=O)N(CCCn2ccnc2)[C@H]1c1ccccn1,C33544144_decoy,CASP3,Decoy,0,-8.17331,-6.13,-3.75,-6.430654959709817
Cc1oc(C)c(S(=O)(=O)N[C@@H](C)[C@H]2CCCO2)c1C(=O)[O-],C35734782_decoy,CASP3,Decoy,0,-6.01032,-5.32,-0.65,-4.581634115718445
CC[NH+]1CCC[C@@H]1C[N-]S(=O)(=O)N1CCC(C(=O)[O-])CC1,C37655876_decoy,CASP3,Decoy,0,-7.45853,-6.17,-1.0,-6.551296997554168
O=S(=O)(CCc1ccccn1)[N-]c1ncc(C#CCO)s1,C37661755_decoy,CASP3,Decoy,0,-8.17406,-6.06,-1.94,-4.651393131372389
CS(=O)(=O)CCn1c(SCC(=O)[O-])nc2ccsc2c1=O,C37750942_decoy,CASP3,Decoy,0,-7.17009,-4.58,-1.34,-6.472468616560064
CCn1c([O-])c(C(=O)C[C@@H]2NCCc3ccccc32)c(=O)n(CC)c1=S,C20227692_decoy,CASP3,Decoy,0,-8.82968,-6.62,-0.56,-6.206792637891538
O=C(CS[C@H]1CCS(=O)(=O)C1)NC1CCC(C(=O)[O-])CC1,C37561443_decoy,CASP3,Decoy,0,-8.00881,-5.59,-0.76,-6.776924865634061
O=C1C[C@H](c2ccco2)CC([O-])=C1/C=N/CCN1CCNCC1,C22919768_decoy,CASP3,Decoy,0,-7.34985,-5.02,-0.21,-5.071320478715292
CC(C)S(=O)(=O)c1ccc([C@H](CC=O)NC=O)c([O-])c1F,C39496676_decoy,CASP3,Decoy,0,-6.16382,-5.81,-3.27,-5.532581977476295
O=C([O-])Cc1csc(SCC(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)n1,C13416546_decoy,CASP3,Decoy,0,-8.83686,-7.13,-1.72,-7.1655163143300005
CC(C)Cc1nnc([N-]S(=O)(=O)c2ccc(N3C(=O)CCC3=O)cc2)s1,C40176786_decoy,CASP3,Decoy,0,-8.09075,-5.87,-0.34,-5.795724631647961
CCN(CC(C)C)C(=O)N(CC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C40564537_decoy,CASP3,Decoy,0,-5.71807,-5.36,-2.85,-6.302665028905546
CCC(CC)N(C)C(=O)N(CC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C40580914_decoy,CASP3,Decoy,0,-4.52174,-6.16,-0.16,-6.813452293670336
O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)[O-])cn1,C41114958_decoy,CASP3,Decoy,0,-7.69163,-5.63,-0.6,-6.941448592536977
C[C@@](Sc1ncn[nH]1)(C(=O)[O-])c1ccc(S(C)(=O)=O)cc1,C41976873_decoy,CASP3,Decoy,0,-7.03371,-6.02,-0.88,-6.772042168610483
CN(C(=O)CC1(CC(=O)[O-])CCCC1)[C@@H]1CCS(=O)(=O)C1,C48372263_decoy,CASP3,Decoy,0,-6.61949,-5.62,-0.17,-5.347883586301803
COc1ccc(OC/C([O-])=N/S(=O)(=O)c2cnn(C)c2)cc1,C48646655_decoy,CASP3,Decoy,0,-6.43388,-6.78,-0.95,-5.372938236046669
C=C(Br)CNC(=O)/C([O-])=N/c1nnc(C(F)F)s1,C49301704_decoy,CASP3,Decoy,0,-6.91494,-6.0,-0.52,-4.814189896251521
CCC1=C(c2ccc(C)cc2)S(=O)(=O)N=C1N[C@H](C)C(=O)[O-],C49454332_decoy,CASP3,Decoy,0,-7.26443,-7.5,-0.43,-10.151364113798577
CCS(=O)(=O)C/C([O-])=N/S(=O)(=O)c1cc(C)sc1C,C49501917_decoy,CASP3,Decoy,0,-7.80907,-4.53,-1.28,-4.231871590636531
O=C([O-])CSc1nnc(C2CC2)n1C[C@@H]1CCS(=O)(=O)C1,C50602727_decoy,CASP3,Decoy,0,-7.63392,-5.34,0.24,-6.545579554915921
O=C([O-])CCC1CCN(C(=O)C[C@H]2CCS(=O)(=O)C2)CC1,C50922754_decoy,CASP3,Decoy,0,-6.93271,-5.21,-1.04,-7.455138112574073
Cc1c(C(=O)OC(C)C)sc2ncnc(N[C@@H](C)C(=O)[O-])c12,C57738184_decoy,CASP3,Decoy,0,-6.51931,-5.39,-0.12,-5.263409598898616
CCN(C[C@@H](C)C(=O)[O-])C(=O)CS[C@@H]1CCS(=O)(=O)C1,C61215784_decoy,CASP3,Decoy,0,-7.16439,-5.9,-0.61,-5.930790746959725
CC(C)(C)OC(=O)N1CC[C@](CCS(C)(=O)=O)(C(=O)[O-])C1,C62878527_decoy,CASP3,Decoy,0,-6.83544,-4.81,-1.91,-4.430064874193032
O=C([O-])CN(C(=O)NCCC(F)(F)F)[C@@H]1CCS(=O)(=O)C1,C63101697_decoy,CASP3,Decoy,0,-6.99942,-5.79,-0.94,-6.222406791823115
CS(=O)(=O)CCS(=O)(=O)N1[C@@H](C(=O)[O-])C[C@H]2CCCC[C@@H]21,C63142379_decoy,CASP3,Decoy,0,-7.65476,-5.18,-2.22,-4.905328286147607
C/C(=N/O)c1cccc([N-]S(=O)(=O)CCS(C)(=O)=O)c1,C63143247_decoy,CASP3,Decoy,0,-5.83642,-5.74,-1.67,-4.929671915241473
Cc1cc([N-]S(=O)(=O)CCS(C)(=O)=O)ccc1C#CCO,C63143918_decoy,CASP3,Decoy,0,-7.15294,-4.68,-0.9,-4.8741047571959335
CS(=O)(=O)CCS(=O)(=O)[N-]c1ccc(C#CCCO)cc1,C63143936_decoy,CASP3,Decoy,0,-7.55164,-5.01,-0.51,-4.655754757866189
CCC1CCC(NS(=O)(=O)C[C@H]2CCCO2)(C(=O)[O-])CC1,C63155449_decoy,CASP3,Decoy,0,-7.47568,-4.17,-1.1,-5.234236562081264
C[C@H]1C=N[C@H](NC(=O)Cc2csc([N-]S(C)(=O)=O)n2)S1,C39979380_decoy,CASP3,Decoy,0,-8.17742,-6.01,-0.65,-5.196799596413795
CCOC(=O)C1=C(C)N=C(C)/C(=C(\[O-])OCC)[C@H]1C(=O)O[C@H]1CCOC1=O,C25193719_decoy,CASP3,Decoy,0,-7.36773,-6.79,-0.77,-7.508200688180389
CCOC(=O)Cc1csc(N2C(=O)C[C@H](SCC(=O)[O-])C2=O)n1,C16900876_decoy,CASP3,Decoy,0,-7.71588,-5.58,-0.74,-5.395699888816422
CN(C)S(=O)(=O)/N=C(\[O-])c1ccn(-c2ccc([N+](=O)[O-])cc2)n1,C65654296_decoy,CASP3,Decoy,0,-7.56076,-6.84,-1.9,-5.948638021363867
COCCOCCC/C([O-])=N/S(=O)(=O)c1ccc(C#N)cc1,C66002472_decoy,CASP3,Decoy,0,-6.49086,-4.45,-2.23,-4.984461747037821
Cn1cnc(S(=O)(=O)[N-]c2c(-c3nc(C4CC4)no3)cnn2C)c1,C66254308_decoy,CASP3,Decoy,0,-6.59958,-5.18,-1.12,-4.96848867840596
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1OC,C03329507_decoy,CASP3,Decoy,0,-7.82214,-7.07,-0.67,-6.545394939714643
Cn1cc(CN(CCS(=O)(=O)N2CCCCCC2)C(=O)/C=C/C(=O)[O-])cn1,C08992276_decoy,CASP3,Decoy,0,-7.90725,-6.47,-0.78,-7.07014043031134
O=C([O-])CNC(=O)Cn1cc(C(F)(F)F)cc(Cl)c1=O,C12881628_decoy,CASP3,Decoy,0,-6.84075,-5.77,-0.23,-8.426315331460179
Cn1c(SCc2occc2C(=O)[O-])nnc1[C@@H]1CCS(=O)(=O)C1,C13405503_decoy,CASP3,Decoy,0,-6.5118,-6.52,-1.17,-7.3123259277495745
CCn1ccc(CN(C)C(=O)c2ccn(CCC(=O)[O-])n2)n1,C20318102_decoy,CASP3,Decoy,0,-5.8137,-6.47,-0.6,-8.990440903665853
Cc1nn(C)c(C)c1CN(C)C(=O)c1cnn(CC(=O)[O-])c1,C20323361_decoy,CASP3,Decoy,0,-6.19136,-6.02,-1.11,-6.05261014187999
CCn1cc(CN(C)C(=O)c2cnn(CC(=O)[O-])c2)c(C)n1,C20323366_decoy,CASP3,Decoy,0,-5.47927,-4.82,-0.9,-4.846785564156711
CCS(=O)(=O)N1CCN(C(=O)c2cnn(CC(=O)[O-])c2)CC1,C20323391_decoy,CASP3,Decoy,0,-6.2882,-5.31,-0.64,-6.971920914357054
O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1CCS(=O)(=O)[O-],C27533524_decoy,CASP3,Decoy,0,-8.58977,-6.0,-0.32,-6.002137373029066
C=CCN1/C(=N/C(=O)COCC(=O)[O-])S[C@@H]2CS(=O)(=O)C[C@@H]21,C32504411_decoy,CASP3,Decoy,0,-6.88005,-5.3,-0.75,-5.225309153438758
CCN(C(=O)CS[C@H](C)C(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C36965240_decoy,CASP3,Decoy,0,-6.69841,-4.46,-0.28,-6.515957313462542
CC(C)(C)C(=O)NCCCC(=O)N1CSC[C@H]1C(=O)[O-],C36979368_decoy,CASP3,Decoy,0,-7.11387,-6.25,-1.35,-6.70421780840953
Cc1ccc(/C=C/C(=O)N[C@H](CCS(C)(=O)=O)C(=O)[O-])s1,C37453424_decoy,CASP3,Decoy,0,-6.7985,-5.87,-0.46,-5.45832490874129
CSc1ncc(Cl)c(C(=O)N[C@](C)(C(=O)[O-])C2CC2)n1,C37456921_decoy,CASP3,Decoy,0,-9.1772,-5.8,-0.52,-7.614930355224136
C[C@@]12CCC(=O)N1[C@H](C(=O)N(CCC(=O)[O-])C1CC1)CS2,C37582930_decoy,CASP3,Decoy,0,-5.86807,-5.89,0.01,-6.573004812417173
O=C([O-])CN(c1ccc([N+](=O)[O-])cn1)[C@@H]1CCS(=O)(=O)C1,C37592806_decoy,CASP3,Decoy,0,-6.49446,-5.52,0.39,-4.573855286754537
N#CCCN(CCC#N)S(=O)(=O)N1CCC[C@H](C(=O)[O-])C1,C37656514_decoy,CASP3,Decoy,0,-6.96691,-5.68,-0.68,-9.501867452456231
CC(C)N(CCC#N)S(=O)(=O)N1CCC[C@H](C(=O)[O-])C1,C37656851_decoy,CASP3,Decoy,0,-6.77013,-5.41,-0.84,-5.459536621051468
CCc1cccc(C)c1N(C(=O)CS(=O)(=O)[O-])[C@@H](C)COC,C13827768_decoy,CASP3,Decoy,0,-7.42777,-6.64,-1.44,-11.689720816457523
CC(=O)Nc1ccc(/C=C/C(=O)C2=C(C)[C@@H](C(=O)[O-])N=C2C)cc1,C39700854_decoy,CASP3,Decoy,0,-6.55981,-7.12,-0.59,-5.935748278941545
CCN(C(=O)N(CC(=O)[O-])[C@H]1CCS(=O)(=O)C1)C1CC1,C40560904_decoy,CASP3,Decoy,0,-4.74354,-6.69,-0.9,-6.662819808687031
CC[C@H](C)N(CC)C(=O)N(CC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C40565043_decoy,CASP3,Decoy,0,-5.65512,-5.17,0.14,-5.656758934547994
CCCCN(C(=O)COCC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C41063450_decoy,CASP3,Decoy,0,-5.81755,-4.79,-1.46,-5.390746786724758
CCCC[C@]1(C)NC(=O)N(C2(C(=O)[O-])CCSCC2)C1=O,C41914618_decoy,CASP3,Decoy,0,-6.35527,-6.4,-0.56,-6.232447422042027
CN(Cc1cc(/C=C/C(=O)[O-])cs1)C(=O)[C@@H]1CCC(=O)N1,C42401630_decoy,CASP3,Decoy,0,-6.68068,-4.98,-1.86,-5.979646400109441
CO[C@@H]1C[C@H](C(=O)[O-])N(C(=O)N(CC(F)(F)F)C2CC2)C1,C42794670_decoy,CASP3,Decoy,0,-6.01194,-4.69,-0.76,-5.465366261620942
CCOC(=O)CN(C(=O)N1CCO[C@H](C(=O)[O-])C1)C(C)C,C43707209_decoy,CASP3,Decoy,0,-4.84533,-4.88,-1.52,-5.205719271047889
CCOC(=O)CN(C(=O)N1CCO[C@@H](C(=O)[O-])C1)C(C)C,C43707211_decoy,CASP3,Decoy,0,-4.20679,-5.28,0.08,-5.109826197730975
CC[C@@H](C(=O)[O-])N(C)C(=O)c1cc(-c2csc(C)n2)c[nH]1,C44612857_decoy,CASP3,Decoy,0,-5.39176,-6.31,-0.03,-5.001228432598258
CC[C@H](C(=O)[O-])N(C)C(=O)CS[C@@H]1CCS(=O)(=O)C1,C44613113_decoy,CASP3,Decoy,0,-6.19864,-4.32,-0.78,-5.952646454527162
Cc1ccnc2nc(/C([O-])=N/S(=O)(=O)N(C)Cc3ccccc3)nn12,C48676927_decoy,CASP3,Decoy,0,-8.63462,-7.26,-1.92,-7.871040874753837
COCCN(CCOC)C(=O)N1C[C@H](OC)C[C@@H]1C(=O)[O-],C48895714_decoy,CASP3,Decoy,0,-4.24565,-4.11,-0.23,-4.712417606142812
COCCN(C)C(=O)N(CC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C48924977_decoy,CASP3,Decoy,0,-4.00252,-5.3,0.05,-4.063438715212469
COC(=O)Cn1cc([N-]S(=O)(=O)c2cn(C)c(C)n2)cn1,C50254689_decoy,CASP3,Decoy,0,-6.1645,-5.03,-0.35,-5.571862489819448
CC(C)N(CC(=O)[O-])S(=O)(=O)C1CCS(=O)(=O)CC1,C50351142_decoy,CASP3,Decoy,0,-6.53883,-5.52,-0.71,-6.01751013387788
CCOC(=O)C1CCN(S(=O)(=O)N(C)[C@H](C)C(=O)[O-])CC1,C54053877_decoy,CASP3,Decoy,0,-6.21331,-5.32,-1.56,-5.5303736161735095
CN(Cc1csc(/C=C/C(=O)[O-])c1)C(=O)[C@@H]1COCCO1,C55305793_decoy,CASP3,Decoy,0,-7.80592,-5.26,-0.75,-6.272845735236978
CCO/C([O-])=C(/C(=O)CSc1nncn1C)c1nc(C)cs1,C32778338_decoy,CASP3,Decoy,0,-8.16668,-6.21,-1.25,-8.116985793117474
CCCOc1cc(C=O)cc2c1OCC(=O)N2[C@@H](C)C(=O)[O-],C57918110_decoy,CASP3,Decoy,0,-6.72751,-5.18,-1.26,-5.255043456871137
Cn1cc(S(=O)(=O)[N-]c2ccccc2Cn2cncn2)cn1,C55686597_decoy,CASP3,Decoy,0,-6.34226,-6.01,-1.56,-5.9976461721939565
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1cnc2sccn2c1=O,C61215440_decoy,CASP3,Decoy,0,-6.04907,-4.51,-0.23,-4.979739152684247
CCCS(=O)(=O)N1CCN(C(=O)C[C@@H](C)CC(=O)[O-])CC1,C61836642_decoy,CASP3,Decoy,0,-6.0148,-5.66,-0.67,-5.326917213017324
CS[C@@H]1C(C(=O)c2ccncc2)=C(CC(=O)[O-])C(=O)N1C,C62716237_decoy,CASP3,Decoy,0,-6.49497,-6.62,-1.21,-9.98487752767458
CS(=O)(=O)c1ccc([S@@+]([O-])Cc2occc2C(=O)[O-])cc1,C63131602_decoy,CASP3,Decoy,0,-5.9128,-5.46,-2.33,-4.978969068670975
Cc1ccc(N(CC(=O)[O-])S(=O)(=O)CCS(C)(=O)=O)cc1,C63142536_decoy,CASP3,Decoy,0,-6.35119,-5.29,-1.26,-4.272581645611286
C[C@@H](OC[C@@H]1CCCCO1)/C([O-])=N/S(=O)(=O)c1cn(C)c(=O)n(C)c1=O,C64100270_decoy,CASP3,Decoy,0,-6.90397,-5.91,-0.74,-5.291839106167512
COc1cc(/C([O-])=N/S(=O)(=O)N(C)C)c([N+](=O)[O-])cc1OC,C52767792_decoy,CASP3,Decoy,0,-5.57142,-4.57,-0.68,-4.196117194445792
O=S(=O)(/N=C(\[O-])CSc1nnnn1C1CC1)N1CCCCC1,C52794922_decoy,CASP3,Decoy,0,-8.05839,-6.72,-1.85,-6.95745345363971
CC(C)Cc1nnc(N2C(=O)C[C@@H](SCCC(=O)[O-])C2=O)s1,C16900724_decoy,CASP3,Decoy,0,-7.41962,-4.84,-0.87,-5.730815161289385
CCS(=O)(=O)[N-]c1ccccc1C(=O)N1CCN(C(=O)c2ccoc2)CC1,C65843213_decoy,CASP3,Decoy,0,-8.16946,-6.01,-1.16,-6.518280011893821
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccccc2CO)cc1,C00318687_decoy,CASP3,Decoy,0,-4.71812,-5.91,-0.84,-4.750356132172328
CNNC1=NS(=O)(=O)c2cc(C(=O)OC)c(Cl)cc2S1,C01638036_decoy,CASP3,Decoy,0,-8.57521,-4.72,-0.83,-5.878225886168808
CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(Cl)nc1,C03470609_decoy,CASP3,Decoy,0,-5.95123,-5.23,-0.69,-4.369421823233699
Cc1cc(-c2nnc(CSc3nnc(N)s3)o2)c(C)o1,C07128702_decoy,CASP3,Decoy,0,-7.09853,-5.28,-1.35,-4.976779180891378
Cc1noc(C)c1S(=O)(=O)NCC(=O)NC1CCCCC1,C07918549_decoy,CASP3,Decoy,0,-6.89885,-5.24,-2.45,-4.11715431275579
C[C@@H]1Oc2ccc(-c3csc(NS(C)(=O)=O)n3)cc2NC1=O,C11857408_decoy,CASP3,Decoy,0,-7.24855,-5.03,-1.69,-4.096572745468683
C[C@@H]1CCc2c(sc3ncn4c(=O)n(CCC(N)=O)nc4c23)C1,C12145254_decoy,CASP3,Decoy,0,-8.95986,-5.27,-0.18,-5.324393716154985
Cc1cc(Nc2cccc(NS(=O)(=O)N(C)C)c2)ncn1,C12226602_decoy,CASP3,Decoy,0,-6.23665,-6.91,-1.75,-6.207790044839014
O=C(Nc1nccs1)c1c[nH]nc1-c1ccc2c(c1)OCCO2,C12507373_decoy,CASP3,Decoy,0,-7.70066,-5.64,-2.61,-6.131325659171798
CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc[nH]3)C2=O)cc1,C17029124_decoy,CASP3,Decoy,0,-6.28455,-7.48,-0.91,-5.267102149762848
COc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc[nH]3)C2=O)cc1,C17160916_decoy,CASP3,Decoy,0,-6.07232,-5.39,-0.13,-4.109802047992301
Cc1nnc(NCCO)c2c1nnn2Cc1ccccc1Cl,C21169996_decoy,CASP3,Decoy,0,-7.4548,-6.39,-1.66,-4.946969421480142
CCc1nnc(CSc2nnc(-c3ccc(F)cc3)n2N)o1,C29872652_decoy,CASP3,Decoy,0,-6.71218,-6.05,-1.02,-4.625197104752004
CCOC(=O)NNC(=O)c1sc(-c2ccc(C)o2)nc1C,C31223677_decoy,CASP3,Decoy,0,-7.79224,-7.18,-0.16,-7.427807962145392
Cc1c(Cl)cc(S(=O)(=O)N[C@H](C)CO)cc1[N+](=O)[O-],C35611183_decoy,CASP3,Decoy,0,-6.29162,-5.19,-0.63,-4.4294297875916255
CC1(C)CNC(=O)c2sc(NC(=O)CN3CCOCC3)nc2C1,C20059518_decoy,CASP3,Decoy,0,-7.72505,-5.87,-1.44,-5.341398895624511
CCCC1=C2[C@H](c3cccnc3)C(C(=O)OC)=C(N)O[C@@H]2N=N1,C39940558_decoy,CASP3,Decoy,0,-5.74791,-5.24,-0.45,-5.148376445321175
O=C(NCc1cc[nH]n1)c1ccc(Br)c([N+](=O)[O-])c1,C41016152_decoy,CASP3,Decoy,0,-6.48548,-5.27,-0.49,-5.047732706395376
Cc1ccc2c(c1)NC(=O)[C@](C)(C(=O)N[C@H](C)c1cnn(C)c1)O2,C41547490_decoy,CASP3,Decoy,0,-5.71116,-6.75,-1.48,-6.132141475050212
Cc1cc(C)n(-c2nnc(SCc3cccc(C#N)c3)n2N)n1,C43872827_decoy,CASP3,Decoy,0,-7.28839,-6.43,-0.45,-5.036419929705501
C[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(-n3cncn3)nc2)C1,C44968726_decoy,CASP3,Decoy,0,-7.07012,-5.45,-0.82,-5.029723760567477
O=C(OCC(=O)N1CCNC1=O)c1[nH]c2ccccc2c1Cl,C46767400_decoy,CASP3,Decoy,0,-8.18921,-6.43,-0.34,-7.418848640159207
Cc1c([C@@H](C)NC(=O)N(C)CC(=O)NC(C)(C)C)cnn1C,C47007581_decoy,CASP3,Decoy,0,-6.00682,-5.26,-1.98,-5.98002685480172
Cc1cc(NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)[nH]n1,C47232168_decoy,CASP3,Decoy,0,-7.14489,-6.7,-0.99,-4.775036389596745
Cc1n[nH]c(-c2ccccc2NC(=O)/C=C/c2cnn(C)c2)n1,C47264808_decoy,CASP3,Decoy,0,-7.07438,-5.33,-2.96,-4.891933494435282
C=C(Br)CNC(=O)Nc1cccc(-n2cnnn2)c1,C49283934_decoy,CASP3,Decoy,0,-7.22331,-4.43,0.2,-4.520638776829383
Cc1cc([N-]S(=O)(=O)CC2CC[NH2+]CC2)ccc1[N+](=O)[O-],C43571942_decoy,CASP3,Decoy,0,-5.66228,-6.23,-1.73,-4.380826826415117
CN(C[C@@H]1CCCO1)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1,C50708276_decoy,CASP3,Decoy,0,-5.64982,-5.6,-0.58,-5.155029401573738
O=C(NCCNc1ncccn1)c1c(Cl)nc2ccccn12,C52776070_decoy,CASP3,Decoy,0,-6.54565,-5.12,-1.99,-5.755985147462595
Cn1c(NCc2ccc(Cl)cc2)nc2c1c(=O)[nH]c(=O)n2C,C53548190_decoy,CASP3,Decoy,0,-7.04906,-5.67,-2.09,-6.143730233521049
Nc1nccnc1C(=O)OCc1csc(-c2ccccn2)n1,C11339066_decoy,CASP3,Decoy,0,-7.15993,-5.7,-0.38,-5.920917407056769
CC(C)(C)c1csc(SCC(=O)Nn2cn[nH]c2=O)n1,C33737390_decoy,CASP3,Decoy,0,-7.67284,-7.01,-0.93,-7.824326627817197
CN1C(=O)N(CC(=O)NC2CCC(O)CC2)C(=O)C12CCCCC2,C60636624_decoy,CASP3,Decoy,0,-6.62594,-6.28,-1.78,-4.960008932941917
CCC[C@]1(C)NC(=O)N(CC(=O)NC2(C#N)CCCC2)C1=O,C60707797_decoy,CASP3,Decoy,0,-6.03696,-6.52,0.02,-5.640530000701027
CC(C)Cc1c(C#N)nnn1-c1ccc(S(N)(=O)=O)cc1,C62244953_decoy,CASP3,Decoy,0,-7.78895,-7.26,-0.88,-12.313865948914414
COC(=O)CC1=NN=C2OC(N)=C(C#N)[C@H]([C@H]3C=CCCC3)[C@H]12,C04010282_decoy,CASP3,Decoy,0,-7.12409,-5.56,-1.0,-5.733851215488481
CCOC(=O)C1=C(CN2C[C@H](C)OC[C@@H]2C)NC(=O)N[C@@H]1C,C27642606_decoy,CASP3,Decoy,0,-6.33578,-5.23,-1.69,-5.967409031477955
CN(CCO)c1ccc(NC(=O)c2ccc3c(c2)OCO3)nc1,C64449795_decoy,CASP3,Decoy,0,-7.08942,-7.02,-2.44,-6.50589071227957
CC(C)[C@H]1NN[C@H]2CN(C(=O)[C@@H]3C=C(C4CC4)N=N3)CCN21,C65289125_decoy,CASP3,Decoy,0,-6.14186,-6.58,-0.33,-4.4233716985236775
CC(C)[C@@H]1NN[C@@H]2CN(C(=O)[C@@H]3C=C(C4CC4)N=N3)CCN21,C65289126_decoy,CASP3,Decoy,0,-5.86091,-5.56,-1.22,-3.9047984915701854
O=C(NC[C@@H]1CCCO1)Nc1nnc(-c2ccccn2)s1,C47788927_decoy,CASP3,Decoy,0,-7.54437,-6.82,-1.0,-5.787139073105385
Cn1ncc2c(NCCNc3ccc4ccccc4n3)ncnc21,C65562585_decoy,CASP3,Decoy,0,-6.73317,-5.95,-1.96,-4.792443514867545
COc1ccc(Cl)cc1N1C[C@H](C(=O)Nc2cc[nH]n2)CC1=O,C66052167_decoy,CASP3,Decoy,0,-6.81998,-6.07,-1.58,-4.829509655895016
Cc1ccccc1N(CC(=O)Nc1cc[nH]n1)S(C)(=O)=O,C66457456_decoy,CASP3,Decoy,0,-5.66677,-4.73,-0.29,-4.821947920825972
CCCC(=O)N[C@@H]1CCC[NH+](Cc2cc([O-])n3nccc3n2)C1,C66497698_decoy,CASP3,Decoy,0,-6.66541,-5.11,-1.22,-5.539298631513872
O=C(CCC1CCCCC1)NNC(=O)c1ccc2nncn2c1,C66555417_decoy,CASP3,Decoy,0,-7.35629,-6.31,-0.71,-5.916952140011651
COCC(C)(C)NC(=O)CN1C(=O)NC2(CCCCC2)C1=O,C66744468_decoy,CASP3,Decoy,0,-6.17775,-5.37,-0.94,-5.507347798950151
Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N[C@@H](C#N)CC(C)C,C67044476_decoy,CASP3,Decoy,0,-7.32222,-5.67,-0.53,-6.035447858816313
Cc1occc1C(=O)NC1CCN(C(=O)NCc2ccoc2)CC1,C67065412_decoy,CASP3,Decoy,0,-6.35802,-5.8,-1.32,-5.033624245391363
CC(=O)NCCNC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2,C67359063_decoy,CASP3,Decoy,0,-6.14869,-7.52,-1.81,-6.536390360760766
CSCC[C@@H](NC(=O)C1(NC(=O)OC(C)(C)C)CCCCC1)C(=O)[O-],C04023199_decoy,CASP3,Decoy,0,-7.09754,-5.24,-1.93,-6.036815440549028
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O[C@H](C)C(=O)[O-])c(OC)c1,C04196357_decoy,CASP3,Decoy,0,-6.12565,-6.53,-1.63,-6.3576656979323785
Cc1ccc(C(=O)NCC(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)cc1,C02532133_decoy,CASP3,Decoy,0,-7.34076,-5.69,-0.75,-6.721530640490334
CCNC(=O)NC(=O)CSc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13033768_decoy,CASP3,Decoy,0,-8.01535,-6.58,-1.2,-5.895468766610113
C[C@H](O)Cn1c(SCC(=O)NC[C@@H]2CCCO2)nc2cc(C(=O)[O-])ccc2c1=O,C13051275_decoy,CASP3,Decoy,0,-9.06058,-6.39,-0.48,-7.116012361065204
CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13198272_decoy,CASP3,Decoy,0,-7.84444,-7.97,-1.23,-8.1166108196555
CCNC(=O)CNC(=O)CSc1nc2ccccc2c(=O)n1[C@H](C)C(=O)[O-],C13233629_decoy,CASP3,Decoy,0,-6.11881,-6.54,-0.99,-9.61285202400346
COc1ccccc1N(CCC(N)=O)C(=O)CSc1nc(C)cc(C)c1C(=O)[O-],C13245302_decoy,CASP3,Decoy,0,-6.94064,-6.42,-2.33,-6.3363438127657306
COc1cc(C(=O)NNC(=O)CC2(C(=O)[O-])CCCC2)cc(OC)c1OC,C13250855_decoy,CASP3,Decoy,0,-7.32667,-5.64,-0.94,-5.808937177883029
CC(=O)NCCNC(=O)CSc1nnc(-c2ccc(C)cc2)n1CCC(=O)[O-],C13444132_decoy,CASP3,Decoy,0,-7.96817,-6.34,-1.58,-6.437515269025049
CCOc1cc(/C=C2\SC(=O)N(CC(=O)NCCCCCC(=O)[O-])C2=O)ccc1O,C15050322_decoy,CASP3,Decoy,0,-8.5465,-6.78,-1.38,-9.803867782100076
CSCC[C@@H](NC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccco1)C(=O)[O-],C15746145_decoy,CASP3,Decoy,0,-8.06867,-5.27,-1.83,-7.24009262595302
CC[C@H]1CCc2c(sc(NC(=O)COCC(=O)[O-])c2C(=O)NC2CC2)C1,C17077765_decoy,CASP3,Decoy,0,-7.71701,-5.03,-1.01,-5.965011797847403
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccc(O)c1)c1cccs1,C09374929_decoy,CASP3,Decoy,0,-8.90146,-6.4,-0.81,-7.618108348280893
C=CCNC(=O)Cc1cc([O-])nc(SCC(=O)NCC(=O)OCC)n1,C22629004_decoy,CASP3,Decoy,0,-9.01927,-6.32,-1.75,-6.808035403135516
CCOC(=O)CNC(=O)CSc1nc([O-])cc(CC(=O)NC2CC2)n1,C23145267_decoy,CASP3,Decoy,0,-8.93209,-5.29,-1.96,-6.650570718014045
CC(C)CCCCC(=O)O[C@H]1O[C@H](CO)[C@@H](O)[C@@H]2OC[C@@H](C(=O)[O-])CO[C@@H]12,C31160850_decoy,CASP3,Decoy,0,-7.54085,-5.98,-1.62,-6.0901911731177805
CC(C)[C@@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13045604_decoy,CASP3,Decoy,0,-6.93531,-6.1,-0.53,-6.3363024623256425
CC(C)[C@@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13051628_decoy,CASP3,Decoy,0,-7.13875,-6.71,-1.83,-6.24455920664556
C=CCN1C(=O)C([O-])=C(C(=O)c2sc(C)nc2C)[C@H]1c1ccc(OCC(N)=O)cc1,C40028690_decoy,CASP3,Decoy,0,-8.97332,-6.09,-2.18,-7.924670063332591
CC(C)CC(=O)NC(=S)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1,C40141818_decoy,CASP3,Decoy,0,-7.16318,-5.93,-1.79,-5.477362288166751
O=C([O-])CCCCCNC(=O)CN1C(=O)/C(=C/c2cccc(O)c2)SC1=S,C15036666_decoy,CASP3,Decoy,0,-8.80654,-6.77,-0.85,-7.574285334587849
CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)NCCC(=O)[O-])C2=O)ccc1O,C15047856_decoy,CASP3,Decoy,0,-7.85163,-7.19,-0.96,-6.8115204051571565
O=C([O-])CCCCCNC(=O)CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O,C15050307_decoy,CASP3,Decoy,0,-6.78009,-6.62,-1.83,-7.651916759052949
CCCc1nnc([S-])n1CC(=O)NCCNc1ncccc1C(F)(F)F,C47919287_decoy,CASP3,Decoy,0,-7.84112,-6.33,-1.01,-8.472694256915792
CCCCS(=O)(=O)/N=C([O-])/C=C/c1ccc(OCC(N)=O)c(OC)c1,C48553402_decoy,CASP3,Decoy,0,-8.85292,-5.67,-1.36,-7.074089479317711
CCCCS(=O)(=O)/N=C(\[O-])CCc1c(C)nc2c(C(N)=O)ncn2c1C,C48553669_decoy,CASP3,Decoy,0,-7.93848,-6.04,-1.7,-6.532521199157658
COCCCN/C([O-])=C(\C#N)C(=O)CCNC(=O)c1ccc(F)cc1Cl,C49104616_decoy,CASP3,Decoy,0,-6.82311,-6.45,-2.79,-8.53076821840427
COc1cc(/C=C/C([O-])=C(\C#N)C(=O)c2ccco2)ccc1OCC(N)=O,C49200568_decoy,CASP3,Decoy,0,-8.00741,-5.31,-0.83,-5.591414646660788
COCc1nnc(/N=C(\[O-])CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)s1,C49543765_decoy,CASP3,Decoy,0,-7.52922,-6.59,-0.87,-6.105338101180866
CCOC(=O)c1ccc(N/C([O-])=C(\C#N)C(=O)CCCNC(=O)C2CC2)cc1,C50978249_decoy,CASP3,Decoy,0,-7.48828,-6.87,-1.17,-6.054861156119108
CCCCN/C([O-])=C(\C#N)C(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O,C51009925_decoy,CASP3,Decoy,0,-7.09984,-6.29,-1.9,-7.689775078504255
COCCCOc1ccccc1[N-]S(=O)(=O)c1cc(C(N)=O)n(C)c1,C57120889_decoy,CASP3,Decoy,0,-9.32232,-5.76,-0.8,-7.4029701643123325
CCCS(=O)(=O)[N-]c1cccc(C(=O)N(CC(N)=O)C2CCCC2)c1,C58396425_decoy,CASP3,Decoy,0,-7.62327,-4.88,-0.73,-5.407667136189389
O=C(CSc1nnc(NC(=O)c2ccccc2C(=O)[O-])s1)NC[C@@H]1CCCO1,C59449133_decoy,CASP3,Decoy,0,-8.84492,-7.09,-2.16,-6.511632637779851
O=C(CCn1c([S-])nnc1-c1ccc(F)cc1)NCCNC(=O)C1CC1,C60953468_decoy,CASP3,Decoy,0,-10.1305,-5.96,-0.05,-8.094153857963176
CC(C)Oc1ccc([N-]S(=O)(=O)CC(=O)NNC(=O)c2ccoc2)cc1,C61483554_decoy,CASP3,Decoy,0,-7.68978,-7.59,-3.35,-8.334558112791788
Cc1ccc([N-]S(=O)(=O)C[C@H](C)C(=O)NCC(=O)Nc2cc(C)on2)cc1,C62279871_decoy,CASP3,Decoy,0,-6.78814,-7.43,-2.4,-5.959976511545222
CCCCNC(=O)CN1CCN(c2ccc(C(=O)[O-])cc2NS(C)(=O)=O)CC1,C33253264_decoy,CASP3,Decoy,0,-8.15004,-6.8,-2.49,-7.008115008187191
COCCNC(=S)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1,C13865655_decoy,CASP3,Decoy,0,-7.81294,-5.11,-3.1,-5.916152034229121
CC(C)OCCOCc1cccc([N-]S(=O)(=O)c2cc(C(N)=O)n(C)c2)c1,C65832827_decoy,CASP3,Decoy,0,-7.00358,-6.06,-1.5,-7.773463099702933
CCOCCOc1ccc(S(=O)(=O)[N-]c2nc(CC(N)=O)cs2)cc1,C66250655_decoy,CASP3,Decoy,0,-9.45652,-6.09,-1.39,-6.184545669899655
CCOCCCN/C([O-])=C(\C#N)C(=O)c1ccc(N2CCNC2=O)c(C)c1,C66505664_decoy,CASP3,Decoy,0,-7.43459,-6.58,-0.86,-5.8034470783148535
CC(C)CCC(=O)NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)[O-])CC2=O)cc1,C66589562_decoy,CASP3,Decoy,0,-6.92993,-7.81,-0.93,-7.786027168325273
CCOC(=O)C1=C(C(C)=O)[C@@H](c2ccc(OCCC(=O)[O-])cc2)NC(=S)N1,C67029319_decoy,CASP3,Decoy,0,-7.46184,-4.75,-0.87,-6.105072881648928
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(O[C@H](C)C(=O)[O-])c1,C67029470_decoy,CASP3,Decoy,0,-7.18853,-5.6,-1.2,-6.218413374912865
CCCS(=O)(=O)[N-]c1cccc(C(=O)NCCc2n[nH]c(=S)n2CC)c1,C67076698_decoy,CASP3,Decoy,0,-7.87968,-6.29,-1.63,-6.914108827646887
CC(C)CCC(=O)NCC(=O)N[C@H](C)c1cccc([N-]S(C)(=O)=O)c1,C67152336_decoy,CASP3,Decoy,0,-8.64277,-6.23,-2.04,-7.022592714625271
C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)c1cccc([N-]S(C)(=O)=O)c1,C67163678_decoy,CASP3,Decoy,0,-7.6398,-7.33,-1.86,-6.693493212290502
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccn(CC(=O)NCC)n1,C67345072_decoy,CASP3,Decoy,0,-7.08188,-6.85,-3.04,-6.343380371102545
O=C([O-])CCNC(=O)C[C@H]1S/C(=N/N=C/C=C/c2ccccc2)NC1=O,C04304712_decoy,CASP3,Decoy,0,-6.55332,-5.59,-1.22,-4.328298993583756
CCOc1cc([C@H]2NC(=S)NC(C)=C2C(=O)OC)ccc1OCC(=O)[O-],C04950499_decoy,CASP3,Decoy,0,-6.76767,-6.21,-0.89,-6.856479308879917
CCn1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])[C@H]3C=C[C@@H]2C3)c(C(=O)NCCOC)n1,C06490192_decoy,CASP3,Decoy,0,-7.25868,-7.11,-2.83,-7.063236970096768
C=CCN1C(=O)[C@H](CC(=O)NCCC(=O)[O-])S/C1=N\c1ccc(O)cc1,C06855993_decoy,CASP3,Decoy,0,-8.33506,-6.51,-0.89,-7.592986911751779
Cc1cccc(-c2nnc(SCC(=O)NC(=O)NCC(F)(F)F)n2CC(=O)[O-])c1,C13019933_decoy,CASP3,Decoy,0,-7.11931,-6.42,-2.33,-6.791180462630511
CC[C@@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13045548_decoy,CASP3,Decoy,0,-7.33643,-6.83,-1.42,-6.598015653356452
CC[C@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13045549_decoy,CASP3,Decoy,0,-7.14746,-6.31,-0.73,-6.261975033119329
C[C@@](C#N)(NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)C1CC1,C13045954_decoy,CASP3,Decoy,0,-8.02784,-7.59,-1.4,-7.279762839755576
COC[C@@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13051546_decoy,CASP3,Decoy,0,-8.25628,-5.45,-2.16,-6.481423974045899
CCCc1nnc(S[C@H](C)C(=O)NC(=O)NC2CCCCC2)n1CC(=O)[O-],C13202857_decoy,CASP3,Decoy,0,-6.92142,-5.42,-2.93,-6.078629518226301
C=CCNC(=O)NC(=O)CSc1nnc(-c2cccs2)n1CC(=O)[O-],C13203336_decoy,CASP3,Decoy,0,-8.03404,-5.24,-2.32,-6.113042961613869
CNC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccs3)n2CC(=O)[O-])cc1,C13220245_decoy,CASP3,Decoy,0,-7.96274,-6.49,-1.47,-6.802201429880074
CCNC(=O)CNC(=O)CSc1nc2ccccc2c(=O)n1[C@@H](C)C(=O)[O-],C13233627_decoy,CASP3,Decoy,0,-8.30409,-6.28,-1.18,-7.21920226684438
O=C(NCCOc1ccc(Cl)cc1)N[C@@H](CC(=O)N1CCOCC1)C(=O)[O-],C13242742_decoy,CASP3,Decoy,0,-8.3313,-7.23,-1.63,-7.923157777787261
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1,C13347309_decoy,CASP3,Decoy,0,-7.38356,-7.43,-0.61,-6.421156413189889
CCOc1ccc(/C=C(/NC(=O)c2ccc(C)cc2)C(=O)N[C@@H](C)C(=O)[O-])cc1,C16675731_decoy,CASP3,Decoy,0,-9.07466,-7.32,-1.53,-7.481912551054923
CCn1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])[C@@H]3C=C[C@H]2C3)c(C(=O)NCCOC)n1,C17076946_decoy,CASP3,Decoy,0,-7.68204,-4.84,-1.3,-5.788060841553122
CC(C)c1ccc(-c2nc(CC(=O)NCC(=O)NCC(=O)[O-])cs2)cc1,C20731499_decoy,CASP3,Decoy,0,-6.80417,-7.48,-3.93,-6.848734790542393
CCOC(=O)CNC(=O)CSc1nc([O-])cc(CC(=O)NCc2cccs2)n1,C22629404_decoy,CASP3,Decoy,0,-10.1841,-6.87,-1.55,-7.142778166595524
CC(C)CCCCC(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]2OC[C@@H](C(=O)[O-])CO[C@@H]12,C31160847_decoy,CASP3,Decoy,0,-7.84004,-6.03,-1.59,-5.35133353271595
C=CCn1c([S-])nnc1-c1sc(NC(=O)CCNC(=O)OCC)nc1C,C31275724_decoy,CASP3,Decoy,0,-9.63492,-6.6,-1.66,-10.398234448441436
CSCC[C@@H](NC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccccc1)C(=O)[O-],C02099951_decoy,CASP3,Decoy,0,-8.62978,-7.28,-2.05,-8.334644323441958
CCOc1ccc([C@@H]2C(C#N)=C(SCC(N)=O)N=C([O-])[C@H]2C(=O)OC)cc1,C08970626_decoy,CASP3,Decoy,0,-8.04058,-6.11,-1.88,-7.685156487189808
CCOC(=O)[C@H]1C([O-])=NC(SCC(N)=O)=C(C#N)[C@H]1c1ccccc1OCC,C02310498_decoy,CASP3,Decoy,0,-9.51072,-5.99,-1.69,-8.492054991027535
Cc1cc(CNC(=S)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)nn1C,C02853022_decoy,CASP3,Decoy,0,-7.54196,-6.06,-3.43,-5.683479854522722
COc1ccc(/C=C2\SC(=S)N([C@@H](CCC(N)=O)C(=O)[O-])C2=O)c(OC)c1,C39862107_decoy,CASP3,Decoy,0,-9.87518,-6.56,-1.12,-6.874158016503989
CC(=O)Nc1ccc(OC(C)=O)cc1NC(=O)CC1(CC(=O)[O-])CCCC1,C39899416_decoy,CASP3,Decoy,0,-6.7182,-6.33,-0.96,-5.89549782743038
Cc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc(O)c2)o1,C40075494_decoy,CASP3,Decoy,0,-7.33186,-5.84,-3.39,-6.221035834905118
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(O)cc2)cc1C,C40085084_decoy,CASP3,Decoy,0,-7.7508,-5.88,-0.93,-5.889300765045268
CCCNC(=O)NCCc1nc2cc(C(=O)[O-])ccc2n1CCN1CCOCC1,C40389241_decoy,CASP3,Decoy,0,-8.51012,-6.12,-0.13,-7.452524432909961
O=C(CSc1nnc(-c2ccco2)o1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13415699_decoy,CASP3,Decoy,0,-7.90156,-8.07,-0.63,-8.277350748931985
CCOc1cc(/C=C2\SC(=S)N(CCC(=O)NCCC(=O)[O-])C2=O)ccc1O,C15038340_decoy,CASP3,Decoy,0,-8.80107,-6.31,-1.92,-8.339816026857992
O=C([O-])CCCNC(=O)CCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S,C15038624_decoy,CASP3,Decoy,0,-6.88597,-7.55,-1.17,-6.44701693370105
O=C([O-])CNC(=O)CCCCCN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S,C15044668_decoy,CASP3,Decoy,0,-8.27126,-7.0,-0.88,-6.80448701473294
CCCCCCN/C([O-])=C(\C#N)C(=O)CS[C@@H](C)C(=O)Nc1cc(C)on1,C49225098_decoy,CASP3,Decoy,0,-8.61438,-5.46,-1.61,-6.419975474100704
CCOC(=O)NCC/C([O-])=C(\C#N)C(=O)Nc1ccc(C(=O)N(C)C)cc1,C51474496_decoy,CASP3,Decoy,0,-5.88046,-5.88,-1.49,-5.31637885816872
CCCS(=O)(=O)[N-]c1ccccc1C(=O)NCCNc1ncccc1C#N,C58275781_decoy,CASP3,Decoy,0,-7.72438,-6.33,-2.05,-6.190480277725108
CCOc1ccc(C(=O)NN/C=C2\C(=O)N(CCOC)C(=S)N=C2[O-])cc1,C60863309_decoy,CASP3,Decoy,0,-8.58957,-6.44,-0.88,-6.114496258985887
CC(C)(C)OC(=O)NCCNC(=O)c1ccc(Cl)c([N-]S(C)(=O)=O)c1,C61432629_decoy,CASP3,Decoy,0,-7.56296,-5.78,-1.84,-6.107657677098401
Cc1n[nH]c(C)c1S(=O)(=O)NCCCc1ccc([N-]S(C)(=O)=O)cc1,C62107761_decoy,CASP3,Decoy,0,-7.37911,-6.69,-2.51,-5.904969700736665
CCCCCN1C(=O)c2ccccc2N[C@@H]1SC/C([O-])=N/c1ncn[nH]1,C63763388_decoy,CASP3,Decoy,0,-8.53832,-7.2,-1.98,-9.308932496239333
CCS(=O)(=O)NCCCNC(=O)Cn1c([S-])nnc1-c1ccc(C)cc1,C51461965_decoy,CASP3,Decoy,0,-9.61694,-4.82,-1.25,-7.101130932197907
CCCS(=O)(=O)[N-]c1ccc(NC(=O)Nc2cc(C)nn2CCC#N)cc1,C65828387_decoy,CASP3,Decoy,0,-6.56008,-5.37,-1.52,-4.844332455236298
COC(=O)CCOc1ccc(S(=O)(=O)[N-]c2nc(CC(N)=O)cs2)cc1,C66250644_decoy,CASP3,Decoy,0,-9.77887,-5.12,-3.55,-7.993285583004221
COC(=O)c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OCC(N)=O)cc1C,C66582639_decoy,CASP3,Decoy,0,-8.53005,-6.88,-0.27,-7.102859742804163
CCOC(=O)C1=C(C(C)=O)[C@@H](c2cccc(O[C@@H](C)C(=O)[O-])c2)NC(=S)N1,C67028567_decoy,CASP3,Decoy,0,-7.22881,-5.62,-1.58,-5.702438465877297
CCOC(=O)C1=C(C(C)=O)[C@H](c2ccc(OCCC(=O)[O-])cc2)NC(=S)N1,C67029318_decoy,CASP3,Decoy,0,-7.82958,-4.88,-1.63,-6.770771971276196
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(O[C@@H](C)C(=O)[O-])c1,C67029469_decoy,CASP3,Decoy,0,-6.53402,-6.72,-1.17,-7.31184215506298
CCCc1nnc([S-])n1CC(=O)NCc1cccc(C(=O)NC(C)C)c1,C67190304_decoy,CASP3,Decoy,0,-8.43151,-6.51,-2.55,-6.490127646380963
CCNC(=O)Cn1ccc(NC(=O)c2ccccc2[N-]S(=O)(=O)CC)n1,C67344583_decoy,CASP3,Decoy,0,-6.79407,-4.95,-2.12,-5.669501360047433
CCCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)[O-])cc1,C02805920_decoy,CASP3,Decoy,0,-7.28272,-5.98,-1.1,-6.313492522550964
CCC[C@@H](C)COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc([O-])c([N+](=O)[O-])c1,C04065742_decoy,CASP3,Decoy,0,-7.29521,-6.29,-1.94,-8.070747430038288
CC(C)(C)c1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NCCC(=O)[O-])cc1,C02905861_decoy,CASP3,Decoy,0,-8.16786,-7.14,-0.91,-10.29681799668874
O=C([O-])Cn1c(O)c(/N=N/C(=O)CCCNc2ccc(Cl)cc2)c2ccccc21,C06229836_decoy,CASP3,Decoy,0,-7.33685,-7.28,-1.49,-7.433920072821834
COc1ccccc1N(CCC(N)=O)C(=O)COc1c(Cl)cc(C(=O)[O-])cc1Cl,C13043814_decoy,CASP3,Decoy,0,-9.11383,-7.44,-3.0,-8.031912361545348
CCCCn1c(S[C@H](C)C(=O)NC(=O)NC(C)C)nc2cc(C(=O)[O-])ccc2c1=O,C13044618_decoy,CASP3,Decoy,0,-8.14738,-7.01,-1.9,-8.25068171540072
CCOc1ccc(-c2nnc(SCc3nc4cc(C(=O)[O-])ccc4n3CC)n2N)cc1,C13220532_decoy,CASP3,Decoy,0,-8.05299,-7.25,-2.5,-7.998612074733013
CC[C@@H](C)NC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC(C)C,C13266023_decoy,CASP3,Decoy,0,-8.44106,-6.93,-0.69,-8.113329063389338
CC[C@H](C)NC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC(C)C,C13266026_decoy,CASP3,Decoy,0,-7.80449,-5.26,-1.22,-6.68474369070527
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(/C=C/C(=O)[O-])ccc1OC,C13278832_decoy,CASP3,Decoy,0,-7.88804,-6.61,-2.15,-5.737512129487195
O=C(NCCNC(=O)c1nc([O-])c2ccccc2n1)c1cccc(OCc2ccccc2)c1,C22470686_decoy,CASP3,Decoy,0,-6.53045,-8.03,-2.16,-6.487517890143406
Cc1ccc(OCCn2c(S[C@@H](C(=O)[O-])C(C)C)nc3c(N)ncnc32)cc1,C22611543_decoy,CASP3,Decoy,0,-7.91053,-6.34,-1.1,-7.010803957521682
Cc1ccc(OCCn2c(S[C@H](C(=O)[O-])C(C)C)nc3c(N)ncnc32)cc1,C22611545_decoy,CASP3,Decoy,0,-7.19474,-6.47,-2.3,-6.4248464804093
CC(C)[C@@H](Sc1nc2c(N)ncnc2n1CCOc1ccc(Cl)cc1)C(=O)[O-],C22611547_decoy,CASP3,Decoy,0,-8.48823,-8.26,-1.81,-8.436358950805335
CC(=O)Nc1ccc(S(=O)(=O)NC[C@@H]2C=C(C)[C@H](CC(=O)[O-])C[C@H]2C(C)C)cc1,C30882153_decoy,CASP3,Decoy,0,-8.16054,-6.75,-1.97,-7.840844042265729
COc1c([C@H](CC(C)C)OC)ccc(Oc2c(O)cc(C)cc2CO)c1C(=O)[O-],C31159005_decoy,CASP3,Decoy,0,-6.51423,-5.9,-1.55,-6.004130984182676
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2sc(-c3ccccc3)cc2C(N)=O)cc1,C33048541_decoy,CASP3,Decoy,0,-7.58286,-5.8,-3.44,-6.673541091476482
C[C@@H](NC(=S)Nc1ccccc1F)c1nc2cc(C(=O)[O-])ccc2n1Cc1ccco1,C35620995_decoy,CASP3,Decoy,0,-7.99234,-8.14,-0.92,-7.532570417996737
CCCCc1nnc(NC(=O)CSc2nc([O-])c(Cc3ccccc3)c(=O)[nH]2)s1,C13545203_decoy,CASP3,Decoy,0,-9.00942,-8.06,-1.87,-9.795502028643112
CCCCc1nnc(NC(=O)CSc2nc([O-])c(-c3ccccc3)c(=O)[nH]2)s1,C13544912_decoy,CASP3,Decoy,0,-8.43792,-7.69,-0.53,-6.984232741087156
C[C@H](O)Cn1c(SCC(=O)NCC2CCCCC2)nc2cc(C(=O)[O-])ccc2c1=O,C13051242_decoy,CASP3,Decoy,0,-7.7619,-6.25,-0.82,-7.4838878567356035
C[C@@H](O)Cn1c(SCC(=O)NCC2CCCCC2)nc2cc(C(=O)[O-])ccc2c1=O,C13051241_decoy,CASP3,Decoy,0,-7.39273,-6.87,-2.45,-7.742981748351433
CCOC(=O)c1ccc(NC(=O)[C@H](C)Sc2nc([O-])c(CC)c(=O)[nH]2)cc1,C01122128_decoy,CASP3,Decoy,0,-7.55274,-6.48,-1.63,-6.452183796002593
C=CCOc1cccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCO)c1,C39898088_decoy,CASP3,Decoy,0,-8.55264,-8.46,-1.71,-8.121729811323458
O=C([O-])c1ccc2c(=O)[nH]c(CSc3nnc(NCCc4ccccc4)s3)nc2c1,C13238762_decoy,CASP3,Decoy,0,-7.71804,-6.98,-2.9,-6.748526277167314
CCC[C@@H]1CCC(NC(=O)CCc2nc(-c3ccc([O-])c[nH+]3)no2)=C(C(=O)[O-])C1,C49035323_decoy,CASP3,Decoy,0,-6.7782,-7.72,-3.32,-7.800722263660796
Cc1ncccc1[N-]/C(=N\C#N)N[C@H](NC(=O)Cc1ccc(Cl)cc1)C(C)(C)C,C40951606_decoy,CASP3,Decoy,0,-7.70144,-5.9,-0.87,-6.416782042038705
CCCCN(C)c1ccc(NS(=O)(=O)c2cc(C)ccc2NC(C)=O)c(C(=O)[O-])c1,C33007402_decoy,CASP3,Decoy,0,-7.49544,-6.74,-4.05,-6.679895379281688
CCOC(=O)[C@]1(C(F)(F)F)N=C(/N=C(\N)[N-]c2ccccc2)OC(c2ccccc2)=N1,C20069551_decoy,CASP3,Decoy,0,-6.76627,-7.78,-4.57,-6.474864344333983
C[C@H](NC(=O)CCn1c([S-])nnc1-c1cccs1)c1ccc(NC(=O)C2CC2)cc1,C31398350_decoy,CASP3,Decoy,0,-10.0585,-6.66,-1.35,-7.201330689416172
COc1ccc(/C=C(/NC(=O)c2ccc(C(C)(C)C)cc2)C(=O)NCCC(=O)[O-])cc1,C06305236_decoy,CASP3,Decoy,0,-7.82099,-7.28,-1.82,-7.314992501456802
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(/N=C/c2c(C)[nH]c3ccccc23)cc1,C59466851_decoy,CASP3,Decoy,0,-7.54021,-8.05,-1.57,-7.083254209500344
COC(C[N-]/C(=N\C(=O)Nc1ccc(Cl)c(Cl)c1)Nc1nc(C)cc(C)n1)OC,C14155980_decoy,CASP3,Decoy,0,-8.2466,-7.14,-1.4,-7.002007470391254
O=C([O-])c1ccc(CNC(=S)NC(=O)c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1,C20153060_decoy,CASP3,Decoy,0,-7.1773,-6.52,-0.69,-6.045531812118277
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1cccc(Nc2nc(C)cs2)c1,C60059889_decoy,CASP3,Decoy,0,-7.34432,-7.9,-2.41,-8.048151324827943
CCCCCCC(=O)NN/C(C)=C1\C(=O)N=C([O-])N(C2CCCCC2)C1=O,C16971687_decoy,CASP3,Decoy,0,-8.39703,-7.59,-0.48,-7.292505774471016
COc1ccc(CNc2nc3nc(CNc4cc(Cl)ccc4OC)cc([O-])n3n2)cc1,C64580070_decoy,CASP3,Decoy,0,-10.0975,-8.36,-1.03,-9.3969809379714
CCCCC(=O)Nc1ccc(N2CCN(CC(=O)NC(C)(C)C)CC2)cc1C(=O)[O-],C64589771_decoy,CASP3,Decoy,0,-8.53937,-6.8,-3.74,-7.015281350611209
COC(=O)Cc1cc(=O)[nH]c(N/C(=N/C(=O)c2ccccc2)[N-]c2ccccc2C)n1,C18085129_decoy1,CASP3,Decoy,0,-7.19447,-6.54,,-6.169350216396959
Cc1cc(C)nc(/N=C(/N=C(\[O-])Cc2ccccc2)NCCc2c[nH]c3ccccc23)n1,C18141645_decoy,CASP3,Decoy,0,-7.2192,-8.79,-3.64,-6.256210488808157
CCN(CC)c1ccc(C(=O)NCc2ccccc2[N-]S(C)(=O)=O)c(O)c1,C53809749_decoy,CASP3,Decoy,0,-8.94376,-6.92,-1.97,-6.361849465001339
COc1ccc(NCc2cc([O-])n3nc(NCc4ccc(C)cc4)nc3n2)c(OC)c1,C65322926_decoy,CASP3,Decoy,0,-9.99507,-8.6,-1.2,-15.683758217053091
CCOc1ccc(NCc2cc([O-])n3nc(NCc4ccc(C)cc4)nc3n2)cc1,C65322938_decoy,CASP3,Decoy,0,-9.5855,-8.81,-1.12,-15.201991668576383
COc1ccc(CNc2nc3nc(CNc4cccc(Cl)c4)cc([O-])n3n2)cc1OC,C65323134_decoy,CASP3,Decoy,0,-10.6832,-8.59,-2.23,-9.179441987680963
COc1ccc(CNc2nc3nc(CNc4ccccc4C)cc([O-])n3n2)cc1OC,C65323142_decoy,CASP3,Decoy,0,-9.46713,-7.97,-2.13,-6.480400369085295
CCc1ccc(CNc2nc3nc(CNc4ccccc4OC)cc([O-])n3n2)cc1,C65323171_decoy,CASP3,Decoy,0,-9.46873,-7.94,-1.65,-6.339349977915343
CCOc1ccc(CNc2nc3nc(CNc4ccc(C)cc4)cc([O-])n3n2)cc1,C65323197_decoy,CASP3,Decoy,0,-10.0383,-8.64,-1.5,-15.805715445199889
O=C([O-])CCC/C=C\C[C@@H]1[C@@H](/C=C/C2(COc3ccccc3)OCCO2)[C@@H](O)C[C@@H]1O,C66331777_decoy,CASP3,Decoy,0,-7.71523,-6.98,-1.31,-7.032502828329971
N[C@@](CC(=O)[O-])(C(=O)OCC1c2ccccc2-c2ccccc21)c1cccc([N+](=O)[O-])c1,C66349336_decoy,CASP3,Decoy,0,-7.22468,-7.14,-0.88,-6.1254153857736044
CS(=O)(=O)[N-]c1ccc(/C=C/C(=O)NNC(=O)CCC2CCCCC2)cc1,C66782930_decoy,CASP3,Decoy,0,-7.63837,-6.99,-0.86,-7.18346583316084
COc1ccc(/C=C/C(=O)NCC(=O)N/N=C/c2ccc(C(=O)[O-])cc2)cc1,C01922316_decoy,CASP3,Decoy,0,-7.91277,-6.46,-1.48,-5.650572376406387
CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)CNc2ccc(C)cc2)c1[O-],C04739456_decoy,CASP3,Decoy,0,-6.15505,-7.18,-1.03,-5.342221664415107
Cc1cc2oc(O)c(CC(=O)NCCCCCC(=O)[O-])c(C)c-2c(=O)c1,C06075955_decoy,CASP3,Decoy,0,-7.18646,-6.88,-0.54,-6.170761433339306
CC[C@H](C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCC1CCC(C(=O)[O-])CC1,C04084046_decoy,CASP3,Decoy,0,-7.30514,-7.09,-3.8,-7.162944874970604
Cc1cc(C)c(NCC(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)c(C)c1,C06955168_decoy,CASP3,Decoy,0,-5.9655,-6.53,-2.96,-5.499088293913674
CC[C@H](C)Oc1ccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2[O-])cc1,C10121904_decoy,CASP3,Decoy,0,-7.41547,-6.35,-1.01,-4.81923851653952
CCCNc1nnc(SCC(=O)Nc2cc(C(=O)[O-])ccc2C)s1,C13035985_decoy,CASP3,Decoy,0,-7.83558,-5.52,-1.69,-5.678079536543026
CCC(C)(C)C1CCC(Nc2ccc(C(=O)N[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])CC1,C13037492_decoy,CASP3,Decoy,0,-6.86701,-6.08,-1.05,-5.729554177201717
CCC(C)(C)C1CCC(Nc2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])CC1,C13212729_decoy,CASP3,Decoy,0,-7.20616,-6.51,-1.24,-6.376640085462352
O=C(CSc1nnc(NCc2ccco2)s1)Nc1cc(C(=O)[O-])ccc1Cl,C13220791_decoy,CASP3,Decoy,0,-7.95214,-6.44,-1.25,-5.650314793779474
Cc1cccc(-c2nnc(SCc3ccc(C(N)=O)cc3)n2CCC(=O)[O-])c1,C13246115_decoy,CASP3,Decoy,0,-8.27631,-7.9,-0.98,-7.651987160114314
Cc1cc(C(=O)[O-])cc(S(=O)(=O)NCCC/C(=N/O)c2cccs2)c1C,C13248700_decoy,CASP3,Decoy,0,-8.46583,-7.1,-1.16,-7.06552947132728
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CC2(C(=O)[O-])CCCCCC2)cc1,C13255416_decoy,CASP3,Decoy,0,-6.95137,-5.52,-3.36,-5.668449699324548
CCCNc1nnc(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)s1,C13404227_decoy,CASP3,Decoy,0,-8.10643,-6.79,-0.84,-6.873132196478983
CCNc1nnc(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)s1,C13405896_decoy,CASP3,Decoy,0,-7.59787,-6.61,-0.73,-6.300777831164884
CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2[C@@H](C(=O)[O-])[C@@H]3C=C[C@H]2C3)cc1,C15894619_decoy,CASP3,Decoy,0,-7.52313,-7.43,-1.15,-7.217948266797603
CCCCCCC(=O)NN/C=C1\C(=O)N(c2ccc(C)c(C)c2)C(=O)N=C1[O-],C09331014_decoy,CASP3,Decoy,0,-8.94495,-7.12,-1.29,-7.357602839268203
CCCCCCC(=O)NN/C=C1\C(=O)N(c2ccccc2Cl)C(=O)N=C1[O-],C09087120_decoy,CASP3,Decoy,0,-9.23561,-6.07,-0.8,-7.822768582391588
CCCCCCC(=O)NN/C=C1/C(=O)N(c2ccccc2C)C(=S)N=C1[O-],C09108877_decoy,CASP3,Decoy,0,-6.32213,-7.13,-1.29,-7.5961328146253395
C=COCCSc1n[nH]c(N/N=C/c2cc(Cl)cc(Cl)c2[O-])n1,C21079654_decoy,CASP3,Decoy,0,-7.9582,-6.29,-1.7,-6.254492222603056
CCCNC(=O)CCc1c(C)nc2nc(NCc3ccc(Cl)cc3)nn2c1[O-],C21804021_decoy,CASP3,Decoy,0,-8.4421,-7.22,-2.05,-6.413439413366392
CCCNC(=O)CCc1c(C)nc2nc(NCc3ccc(C)cc3)nn2c1[O-],C21804156_decoy,CASP3,Decoy,0,-7.77378,-7.22,-0.88,-9.258456259004404
O=C(CSc1nc([O-])cc(CC(=O)NC2CC2)n1)Nc1ccc(C(F)(F)F)cc1,C22628697_decoy,CASP3,Decoy,0,-8.3285,-5.16,-1.26,-5.900986487138551
CCC(CC)(CC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)C(=O)[O-],C11266794_decoy,CASP3,Decoy,0,-7.66677,-4.96,-0.78,-5.3365779714511
COc1ccc([N-]/C(CSC(N)=O)=N\S(=O)(=O)c2ccc(Cl)cc2)cc1,C27491047_decoy,CASP3,Decoy,0,-8.62857,-6.41,-1.92,-8.88423932811299
CC1=C[C@@H](CNC(=O)CCC(=O)[O-])[C@H](C(C)C)C[C@H]1CC(=O)NCc1cccnc1,C30881350_decoy,CASP3,Decoy,0,-7.79539,-8.19,-1.5,-11.573502464501273
CCCCCC(=O)NNC(=O)c1c([O-])n(CCC)c2ccccc2c1=O,C06471775_decoy,CASP3,Decoy,0,-7.86297,-6.92,-1.12,-6.973881628486703
CCCCNC(=O)[C@H](c1cccc(O)c1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530067_decoy,CASP3,Decoy,0,-6.87209,-6.42,-5.01,-6.425568892286979
CCCCNC(=O)[C@@H](c1ccc(O)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530076_decoy,CASP3,Decoy,0,-7.02139,-7.24,-1.79,-7.18017553890373
CCCCNC(=O)[C@@H](c1ccccc1O)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530144_decoy,CASP3,Decoy,0,-6.34468,-5.25,-2.11,-4.890444860230804
CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])cc1,C05597160_decoy,CASP3,Decoy,0,-7.59227,-7.85,-0.96,-10.682580046509546
CCO[C@@H]1CN(c2cc(-c3ccccc3O)ccc2[N-]S(=O)(=O)OCC)CCN1,C39482549_decoy,CASP3,Decoy,0,-6.57591,-6.84,-1.27,-5.950517351609476
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N[C@@H]2c2ccc(O)c(OCC)c2)cc1C,C40123872_decoy,CASP3,Decoy,0,-8.31212,-7.26,-1.85,-7.484947491326704
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N[C@@H]2c2ccc(O)c(OC)c2)cc1C,C40124032_decoy,CASP3,Decoy,0,-7.71349,-7.71,-2.88,-7.252241653998305
COCCOCCNC(=O)Nc1cc(Br)ccc1C(=O)[O-],C44728658_decoy,CASP3,Decoy,0,-7.15305,-4.42,-1.92,-5.928642733973747
CCc1cccc2c(C(=O)CSc3nc(C)c(CCC(=O)[O-])c(=O)[nH]3)c[nH]c12,C13448400_decoy,CASP3,Decoy,0,-6.2305,-7.42,-1.5,-6.997902515641037
CCc1ccc(N/C([O-])=C(\C#N)C(=O)CCNC(=O)OC(C)(C)C)cc1,C50837590_decoy,CASP3,Decoy,0,-8.03607,-5.45,-1.61,-5.5498126906258
CCCCN/C([O-])=C(\C#N)C(=O)c1ccc(NC(=O)c2ccco2)s1,C51008893_decoy,CASP3,Decoy,0,-7.51984,-5.74,-3.37,-6.845119567644665
CCOC(=O)NCC/C([O-])=C(\C#N)C(=O)Nc1ccccc1C(F)(F)F,C51403809_decoy,CASP3,Decoy,0,-7.07555,-6.75,-1.45,-7.057134784774911
COc1ccc(CCNC(=O)/C(C#N)=C(\[O-])CCCNC(=O)C(C)(C)C)cc1,C51594982_decoy,CASP3,Decoy,0,-7.95726,-7.19,-1.52,-6.385042081690269
CCc1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2NCCO)s1,C55582488_decoy,CASP3,Decoy,0,-6.05075,-5.33,-0.9,-4.666134164887064
COc1ccc(NCc2cc([O-])n3nc(NCc4cccs4)nc3n2)c(OC)c1,C46020371_decoy,CASP3,Decoy,0,-8.4179,-6.37,-0.97,-5.186090495172471
COc1c(Cl)cc(C(=O)[O-])cc1NC(=S)NC(=O)COc1ccc(C)cc1,C20153642_decoy,CASP3,Decoy,0,-7.93866,-6.69,-1.7,-6.687363244778616
CCS(=O)(=O)[N-]c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1C,C59886968_decoy,CASP3,Decoy,0,-6.38291,-5.67,-1.91,-6.026388177759943
COC(=O)Cc1cc(=O)nc(N/C(=N/C(=O)c2ccccc2)[N-]c2ccccc2C)[nH]1,C18085129_decoy2,CASP3,Decoy,0,-8.78946,-5.81,,-6.951707034968915
CC(C)CNC(=O)CN1CCN(c2ccc(NC(=O)C(C)C)c(C(=O)[O-])c2)CC1,C64589724_decoy,CASP3,Decoy,0,-8.99879,-7.09,-0.68,-7.043172002369723
CCCCNC(=O)CN1CCN(c2ccc(NC(=O)C3CC3)c(C(=O)[O-])c2)CC1,C64590146_decoy,CASP3,Decoy,0,-8.79425,-6.68,-1.47,-6.842715870989707
CCCS(=O)(=O)[N-]c1cccc(NC(=O)CCNc2ncccn2)c1C,C64901130_decoy,CASP3,Decoy,0,-6.90195,-6.5,-3.35,-5.659418084478468
C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc(O[C@H](C)C(=O)[O-])c1,C67028783_decoy,CASP3,Decoy,0,-9.18598,-5.43,-2.51,-5.618742633310903
CC1=C(C(=O)OCC(C)C)[C@@H](c2cccc(O[C@H](C)C(=O)[O-])c2)NC(=S)N1,C67029139_decoy,CASP3,Decoy,0,-9.10583,-7.61,-1.2,-8.58176696903005
COc1cc(C(=O)N/N=C/c2ccc(OC)c(OC)c2C(=O)[O-])cc(OC)c1OC,C02278513_decoy,CASP3,Decoy,0,-7.36487,-6.11,-1.21,-6.420211505232179
CCC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(OC)c(OC)c2)SC1=S)C(=O)[O-],C08870125_decoy,CASP3,Decoy,0,-5.96769,-4.82,-1.2,-5.730743237910135
COc1ccc(-c2nnc(SCC(=O)N(C)CC(=O)NC3CC3)n2CC(=O)[O-])cc1,C13035644_decoy,CASP3,Decoy,0,-6.57984,-6.28,-1.21,-5.367872800031846
COCCCn1c(SCC(=O)Nc2sccc2C#N)nc2cc(C(=O)[O-])ccc2c1=O,C13047646_decoy,CASP3,Decoy,0,-8.94347,-6.36,-2.54,-6.817228600138027
CCCc1nnc(SCC(=O)Nc2ccc(C(=O)N(C)C)cc2)n1CC(=O)[O-],C13202985_decoy,CASP3,Decoy,0,-7.77715,-6.78,-0.94,-5.885795302229225
COC(=O)CCNC(=O)CSc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-],C13220629_decoy,CASP3,Decoy,0,-7.08106,-5.2,-1.89,-5.686204113053567
CCNC(=O)CN(CC)C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-],C13232024_decoy,CASP3,Decoy,0,-6.81477,-6.77,-1.37,-6.665683278150213
CCNC(=O)CN(CC)C(=O)CSc1nc2ccccc2c(=O)n1[C@@H](C)C(=O)[O-],C13233619_decoy,CASP3,Decoy,0,-7.51112,-6.17,-0.57,-8.267767711815639
C=CCn1c(SCC(=O)NCc2ccc(C(=O)[O-])cc2)nnc1-c1ccncc1,C13348098_decoy,CASP3,Decoy,0,-6.2216,-7.64,-2.61,-6.100944052614876
COCCCn1c(S[C@@H](C)C(=O)NC[C@H]2CCCO2)nc2cc(C(=O)[O-])ccc2c1=O,C13446891_decoy,CASP3,Decoy,0,-9.11207,-7.09,-0.97,-7.240669645756236
COCCn1c(C)cc(C(=O)CSc2nc(C)c(CCC(=O)[O-])c(=O)[nH]2)c1C,C13448305_decoy,CASP3,Decoy,0,-6.96815,-7.1,-4.87,-7.213859943444643
O=C([O-])Cn1c(CCCCc2[nH+]c3ccccc3n2CC(=O)[O-])nc2ccccc21,C19737349_decoy,CASP3,Decoy,0,-5.05343,-7.73,-1.71,-6.854712488291801
CCOc1ccccc1[C@H]1C(C#N)=C(SCC(=O)OC)NC([O-])=C1C(=O)OC,C19879933_decoy,CASP3,Decoy,0,-7.63737,-5.64,-2.07,-6.620627501840097
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1,C09463191_decoy,CASP3,Decoy,0,-8.70494,-7.38,-0.78,-12.1378130411945
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1,C09425030_decoy,CASP3,Decoy,0,-8.27289,-5.15,-0.01,-5.969505868570435
CCOc1ccc(CCNC(=O)CCn2cc(C(=O)[O-])cn2)cc1OCC,C20328692_decoy,CASP3,Decoy,0,-6.76365,-6.18,-1.27,-6.165292758391547
COCCCn1c([O-])nnc1S[C@@H](C)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1,C24307648_decoy,CASP3,Decoy,0,-5.8501,-7.16,-1.85,-9.369508368154408
COCCCn1c([O-])nnc1S[C@H](C)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1,C24307654_decoy,CASP3,Decoy,0,-5.34399,-7.01,-1.09,-5.913252675805948
COC(=O)CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1,C24348195_decoy,CASP3,Decoy,0,-6.10205,-5.92,-1.85,-4.578043945476627
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1,C33507682_decoy,CASP3,Decoy,0,-7.0021,-7.27,-1.18,-6.877475539278597
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1,C33683324_decoy,CASP3,Decoy,0,-7.7195,-7.45,-1.16,-7.242044422235202
CCC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S)C(=O)[O-],C34112136_decoy,CASP3,Decoy,0,-6.75914,-6.01,-1.08,-7.025031237088138
O=C(COC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1)NC[C@H]1CCCO1,C06131863_decoy,CASP3,Decoy,0,-9.89608,-6.41,-2.74,-6.874666901680621
COc1ccc(CCNC(=O)CC[N-]C2=NC(Cl)=N[C@H]3N=CN=C23)cc1OC,C39232801_decoy,CASP3,Decoy,0,-8.93875,-6.53,-1.84,-8.567930409375654
COC[C@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC(C)C,C13231904_decoy,CASP3,Decoy,0,-8.51411,-6.21,-1.62,-7.041689418858637
CCOc1ccc([C@H]2NN=C(SCC(=O)[C@H]3C=CC=N3)N2CCC(=O)[O-])cc1,C39646911_decoy,CASP3,Decoy,0,-7.36289,-7.05,-0.99,-7.457661541007097
C[C@@H]1C(C(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)=C[C@H](C)[NH+]1Cc1ccco1,C39704118_decoy,CASP3,Decoy,0,-7.39029,-7.46,-2.07,-6.749982300121614
COc1cc(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)cc([N+](=O)[O-])c1O,C13343200_decoy,CASP3,Decoy,0,-9.09778,-7.66,-0.59,-8.187055856923976
COc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)c1,C40100213_decoy,CASP3,Decoy,0,-6.82778,-6.61,-3.32,-6.305041174163017
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cccc([N+](=O)[O-])c2)c1,C40102186_decoy,CASP3,Decoy,0,-7.07943,-6.51,-2.11,-6.123142092735258
C[C@H](NC(=O)CCCCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)C(=O)[O-],C47152294_decoy,CASP3,Decoy,0,-7.4745,-6.43,-1.39,-6.010495702728862
C[C@@H](NC(=O)CCCCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)C(=O)[O-],C47152295_decoy,CASP3,Decoy,0,-7.9921,-6.28,-0.91,-7.045483126336333
CCCCS(=O)(=O)/N=C(\[O-])c1cc(OC)c(OC)cc1NC(=O)[C@@H]1C[C@H]1C,C48552522_decoy,CASP3,Decoy,0,-7.42169,-5.57,-1.83,-6.681237901801682
CCCCS(=O)(=O)/N=C(\[O-])c1cc(OC)c(OC)cc1NC(=O)[C@H]1C[C@H]1C,C48552525_decoy,CASP3,Decoy,0,-8.61373,-6.55,-1.95,-9.443450917944173
CCOCCCN/C([O-])=C(\C#N)C(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1,C48972093_decoy,CASP3,Decoy,0,-7.77159,-6.49,-1.77,-6.144484003745426
CCOC(=O)c1ccc(N/C([O-])=C(\C#N)C(=O)CN(C)C(=O)c2ccco2)cc1,C50978049_decoy,CASP3,Decoy,0,-7.58874,-7.08,-1.46,-5.762175990213658
COCCOc1ccc(CNC(=O)c2cc(F)ccc2[N-]S(C)(=O)=O)cn1,C58333345_decoy,CASP3,Decoy,0,-8.90782,-6.14,-3.16,-6.9900948688847295
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(C(=O)OC)cc2)cc1,C15920091_decoy,CASP3,Decoy,0,-6.47673,-7.05,-2.0,-6.336113044870683
CCOc1cc(/C=N/Nc2nc(C)cc(COC)c2C#N)ccc1OCC(=O)[O-],C59641366_decoy,CASP3,Decoy,0,-6.94876,-6.89,-2.37,-6.583934445361349
COc1ccc(S(=O)(=O)Oc2cccc(/C=N/NC3=NC(=O)[C@@H](CC(=O)[O-])S3)c2)cc1,C16115818_decoy,CASP3,Decoy,0,-9.9201,-8.21,-1.42,-7.863424122654849
COc1cc(C(=O)NCCS(=O)(=O)[N-]c2cc(C)on2)cc(OC)c1OC,C41237733_decoy,CASP3,Decoy,0,-6.97566,-5.39,-2.34,-6.375286007287981
CCn1nc(C)c(CCN(C)c2[nH+]cc([N-]S(=O)(=O)CC)cc2C(=O)[O-])c1C,C35397861_decoy,CASP3,Decoy,0,-7.07972,-6.37,-1.81,-6.697333753005207
CCOC(=O)C1=C(C)N=C(C)/C(=C(/[O-])OCC)[C@H]1C(=O)OCC(=O)NC(C)C,C17526604_decoy,CASP3,Decoy,0,-7.44778,-6.25,-3.6,-7.280898665421912
CCn1cc(S(=O)(=O)[N-]c2ccc(C(=O)NCCC(=O)OC)cc2)cn1,C66578872_decoy,CASP3,Decoy,0,-6.75785,-6.45,-1.42,-5.507115358336415
COCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cccc(O[C@H](C)C(=O)[O-])c1,C67027933_decoy,CASP3,Decoy,0,-7.06771,-6.66,-1.63,-6.266828789086603
CCOC(=O)C1=C(C)N(CCCCC(=O)[O-])C(=O)N[C@H]1c1csnn1,C67029747_decoy,CASP3,Decoy,0,-5.28066,-5.76,-0.71,-5.798641181949531
COCCOC(=O)C1=C(C)N(CCCCC(=O)[O-])C(=O)N[C@H]1c1csnn1,C67029812_decoy,CASP3,Decoy,0,-6.56237,-6.18,-2.21,-6.6633699670407465
CCNC(=O)Cn1ccc([N-]S(=O)(=O)c2ccc(OCCOC)cc2)n1,C67244927_decoy,CASP3,Decoy,0,-6.57973,-5.65,-0.55,-5.031136861388453
CC(C)OCCCN/C([O-])=C(\C#N)C(=O)Cc1csc(-c2cnccn2)n1,C67601225_decoy,CASP3,Decoy,0,-7.91495,-6.4,-1.7,-7.234086397586472
CCOC(=O)c1n[nH]cc1-c1c(-c2ccccc2)ncn1CCCc1nnn[n-]1,C67604671_decoy,CASP3,Decoy,0,-8.05734,-7.89,-1.37,-8.748600560238465
CCCCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)NCC3CCC(C(=O)[O-])CC3)ccc12,C02117402_decoy,CASP3,Decoy,0,-7.04579,-7.73,-2.6,-6.632377348418621
CCCn1c(SCC(=O)NCc2ccc(C(=O)[O-])cc2)nnc1-c1ccc(Cl)cc1,C03448059_decoy,CASP3,Decoy,0,-6.99198,-7.91,-1.55,-6.248650338431314
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccccc3C(C)C)n2CCC(=O)[O-])cc1,C13018690_decoy,CASP3,Decoy,0,-8.54637,-7.36,-1.74,-13.478041433561348
CCCCSc1nnc(SCC(=O)Nc2cc(C(=O)[O-])ccc2C)s1,C13094350_decoy,CASP3,Decoy,0,-8.24603,-5.76,-0.48,-6.1577780948714365
CCCOc1c(Cl)cc(/C=C/C(=O)NCc2ccc(C(=O)[O-])cc2)cc1OCC,C13166425_decoy,CASP3,Decoy,0,-8.58002,-6.31,-2.11,-6.890550657080273
CC[C@@H](C)c1ccc(NC(=O)CSc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])cc1,C13204735_decoy,CASP3,Decoy,0,-7.48167,-7.63,-1.23,-5.988696648403147
Cc1ccc(-c2nnc(SCC(=O)N[C@H](C)c3ccc(C(C)C)cc3)n2CC(=O)[O-])cc1,C13205922_decoy,CASP3,Decoy,0,-6.68151,-7.93,-2.97,-6.1394980007438
Cc1cccc(-c2nnc(SCC(=O)N[C@H](C)c3ccc(C(C)C)cc3)n2CC(=O)[O-])c1,C13206203_decoy,CASP3,Decoy,0,-7.09594,-8.09,-2.41,-8.58984854355551
O=C([O-])/C=C/c1ccc(NCCSc2ncc(C(F)(F)F)cc2Cl)c([N+](=O)[O-])c1,C13212337_decoy,CASP3,Decoy,0,-7.15379,-6.5,-2.08,-5.905141319493767
C=CCn1c(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)nnc1-c1ccc(Cl)cc1,C13395940_decoy,CASP3,Decoy,0,-7.63297,-6.53,-1.97,-7.4762773382523475
CCCCOc1c(Cl)cc(C(=O)NCCc2ccc(C(=O)[O-])cc2)cc1OC,C13442246_decoy,CASP3,Decoy,0,-8.5034,-7.01,-0.94,-6.767750196934705
COCCOc1cc(NC(=O)c2ccc(-c3ccc(Cl)cc3)s2)c(C(=O)[O-])cc1OC,C13451305_decoy,CASP3,Decoy,0,-9.00343,-7.14,-1.32,-6.984697148821401
CCOCCCNC(=O)c1cc2ccccc2cc1[N-]S(=O)(=O)c1cccs1,C22507881_decoy,CASP3,Decoy,0,-6.9581,-6.31,-1.83,-6.601701241727983
CCCCOc1ccc(Cc2nnc([S-])n2NS(=O)(=O)c2ccc(C)cc2)cc1,C26953361_decoy,CASP3,Decoy,0,-8.30682,-6.02,-1.79,-7.924520609923511
CCCC[C@H](C(=O)[O-])c1cs/c(=N\C(=O)c2cccc(COc3ccccc3)n2)[nH]1,C28459612_decoy,CASP3,Decoy,0,-8.44504,-7.46,-1.93,-6.375382898450752
CCc1cc([O-])nc(SCC(=O)Nc2ccc(C(=O)OCC(C)C)cc2)n1,C32522300_decoy,CASP3,Decoy,0,-8.95012,-6.55,-1.17,-6.192542846420689
C=CCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCC)[C@H](c3cccc(OC)c3)N12,C34922811_decoy,CASP3,Decoy,0,-7.68005,-5.34,-2.28,-6.171028553931587
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@H]1c1ccccc1,C35692729_decoy,CASP3,Decoy,0,-9.08799,-6.98,-1.37,-7.508009097416549
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@@H]1c1cccc(Cl)c1,C35694262_decoy,CASP3,Decoy,0,-8.37731,-5.9,-0.72,-6.551311880308509
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@H]1c1cccc(Cl)c1,C35696371_decoy,CASP3,Decoy,0,-7.35603,-6.03,-2.04,-6.420714443416573
CCC1=C(C(=O)OC)[C@@H](c2cccc(C)c2)N2C(/C=C(\[O-])NCCOC)=CSC2=N1,C35696697_decoy,CASP3,Decoy,0,-7.43573,-6.12,-1.18,-6.654348461447541
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC)N2[C@H]1c1ccc(OC)cc1,C35697030_decoy,CASP3,Decoy,0,-8.10114,-5.02,-2.04,-5.919778018714582
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccccc1,C35697143_decoy,CASP3,Decoy,0,-9.06192,-6.69,-1.71,-7.725078219380699
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@@H]1c1ccccc1,C35697145_decoy,CASP3,Decoy,0,-8.47275,-7.22,-2.98,-7.161711618689169
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@@H]1c1ccccc1C,C36050135_decoy,CASP3,Decoy,0,-7.7822,-5.17,-3.24,-6.190695891254027
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@H]1c1ccc(Cl)cc1,C36052675_decoy,CASP3,Decoy,0,-8.20527,-4.71,-3.28,-5.924513551546424
CCC1=C(C(=O)OC)[C@H](c2ccccc2C)N2C(/C=C(\[O-])NCCOC)=CSC2=N1,C36052775_decoy,CASP3,Decoy,0,-8.27128,-4.57,-1.74,-6.0108960840661405
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@H]1c1ccccc1,C36053087_decoy,CASP3,Decoy,0,-8.83031,-7.06,-2.75,-7.478911979719716
CCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@H](c3ccc(C)cc3C)N12,C36061182_decoy,CASP3,Decoy,0,-8.08768,-5.48,-1.36,-6.824739545497428
CCCc1c(OCCCCOc2ccc(CC(=O)[O-])cc2)ccc(C(C)=O)c1O,C36400962_decoy,CASP3,Decoy,0,-7.00516,-6.5,-3.93,-8.078757533961417
CCC[C@@H](C)NC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(OCC)cc2)c1,C36674971_decoy,CASP3,Decoy,0,-7.90712,-7.24,-2.08,-6.908747684307486
COc1ccc(CN(Cc2ccc(C(=O)[O-])cc2)C(=S)Nc2cc(C)cc(C)c2)cc1OC,C03036472_decoy,CASP3,Decoy,0,-7.37487,-7.31,-2.0,-7.249039720412323
CC(C)Cn1c(S[C@@H](C)C(=O)NCCC2=CCCCC2)nc2cc(C(=O)[O-])ccc2c1=O,C13049075_decoy,CASP3,Decoy,0,-9.01516,-6.43,-1.21,-6.632239331902524
CCCc1cc([O-])nc(SCC(=O)N[C@H]2S[C@H]3CCCCC3=C2C(=O)OCC)n1,C39724643_decoy,CASP3,Decoy,0,-8.171,-6.1,-2.24,-6.491706776228609
O=C([O-])c1ccc(OC[C@@H](O)Cn2c(CCc3ccccc3)nc3ccccc32)cc1,C39988711_decoy,CASP3,Decoy,0,-7.063,-7.86,-0.78,-6.369469315746716
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCCO)cc1,C40047054_decoy,CASP3,Decoy,0,-8.60254,-5.48,-1.37,-8.596504747045797
C=CCOc1cccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCCO)c1,C40047574_decoy,CASP3,Decoy,0,-8.31052,-6.38,-1.57,-5.911765905596413
CCCCOc1ccccc1[C@@H]1C(C(=O)c2cccs2)=C([O-])C(=O)N1CCO,C40067473_decoy,CASP3,Decoy,0,-8.10397,-5.25,-2.54,-6.93294449942023
CCCCCCOc1ccc([C@H]2NC(=O)C([O-])=C2C(=O)c2ccc(OC)cc2)cc1,C40117747_decoy,CASP3,Decoy,0,-8.77338,-5.08,-3.65,-6.149151708235257
COC(=O)c1ccc(COc2ccc(/C=C/C(=O)c3c(C)[nH]c(C(=O)[O-])c3C)cc2)cc1,C13078131_decoy,CASP3,Decoy,0,-8.2874,-6.83,-1.52,-5.533004252217249
CCCCCOc1ccc(/C([O-])=C(/C#N)C(=O)NCCCOC(C)C)cc1,C49220400_decoy,CASP3,Decoy,0,-7.07166,-6.4,-1.66,-6.157235333252865
CCOc1ccc2c(c1)C=C(/C([O-])=C(\C#N)C(=O)NCCCOC(C)C)CO2,C49223307_decoy,CASP3,Decoy,0,-7.6672,-6.27,-1.85,-6.763397590044624
CCCCCCN/C([O-])=C(\C#N)C(=O)c1ccc(S(=O)(=O)C(C)C)cc1,C49229912_decoy,CASP3,Decoy,0,-6.492,-5.85,-1.49,-5.222779662849851
CCc1ccc(N/C([O-])=C(\C#N)C(=O)CCc2c(C)nn(CC(C)C)c2C)cc1,C50836595_decoy,CASP3,Decoy,0,-7.23875,-7.47,-1.38,-6.485772810564401
CCCCc1ccc(N/C([O-])=C(\C#N)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C50839647_decoy,CASP3,Decoy,0,-6.74384,-7.19,-1.22,-6.524717246528016
CCCCOc1c(Cl)cc(/C([O-])=C(/C#N)C(=O)NC(C)C)cc1OCC,C50985658_decoy,CASP3,Decoy,0,-8.05822,-4.89,-1.61,-6.123459094260796
CCCCOc1ccc(/C=C/C([O-])=C(\C#N)C(=O)NC2CCCC2)cc1OCC,C51652610_decoy,CASP3,Decoy,0,-8.33438,-5.97,-0.56,-8.96142433035496
CCCCCCOc1ccc(/C=C(\C(=O)OC)c2cc([O-])[nH]c(=S)n2)cc1,C07738603_decoy,CASP3,Decoy,0,-8.98537,-5.49,-0.64,-8.241192903732282
CCCC[C@H](CC)CNC(=O)Cn1c([S-])nnc1-c1ccc(OC)cc1,C29708507_decoy,CASP3,Decoy,0,-9.07025,-5.26,-1.26,-7.049351991306674
C=CCO/C([O-])=C1/C(C)=Nc2nc(SCCCC)[nH]c(=O)c2[C@@H]1c1cccc(OC)c1,C12588808_decoy,CASP3,Decoy,0,-8.76169,-6.42,-1.48,-6.711307158455158
C=CCc1cc(/C=C2/NC(=O)N(CCC)C2=O)cc(OCC)c1OCc1ccc(C(=O)[O-])cc1,C09907497_decoy,CASP3,Decoy,0,-8.41609,-6.37,-2.59,-8.69471643339477
CCOC(=O)c1c(NC(=O)CSc2ncc(C(=O)[O-])n2-c2ccccc2)sc(CC)c1C,C13089999_decoy,CASP3,Decoy,0,-7.53563,-6.77,-1.73,-5.929796945810803
CCOc1ccc(-c2nnc(SCC(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)n2CCC(=O)[O-])cc1,C13193487_decoy,CASP3,Decoy,0,-9.64388,-5.92,-4.14,-7.121280102018214
CCOc1ccc(-c2nnc(SCC(=O)Nc3cc(C)ccc3C)n2CCC(=O)[O-])cc1,C13193604_decoy,CASP3,Decoy,0,-7.13638,-6.7,-0.68,-5.56321325097021
CCOc1ccc(-c2nnc(SCC(=O)NCC34CC5CC(CC(C5)C3)C4)n2CC(=O)[O-])cc1,C13195998_decoy,CASP3,Decoy,0,-8.05237,-8.26,-4.67,-6.926331951435175
Cc1ccccc1[C@@H](C)NC(=O)CSc1nc2ccccc2c(=O)n1CCCCCC(=O)[O-],C13223827_decoy,CASP3,Decoy,0,-7.68039,-7.02,-1.74,-7.814321164690583
O=C([O-])/C=C/c1ccc(NC(=O)CSc2nnc(Cc3ccccc3)n2Cc2ccco2)cc1,C13409343_decoy,CASP3,Decoy,0,-8.89924,-7.62,-0.76,-6.151683762067536
COCCn1c(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)nnc1-c1ccc(Cl)cc1,C13414040_decoy,CASP3,Decoy,0,-7.8589,-6.0,-0.74,-8.312725410308927
Cc1nc(SCC(=O)c2cc(C)n(CCC3=CCCCC3)c2C)[nH]c(=O)c1CCC(=O)[O-],C13448355_decoy,CASP3,Decoy,0,-9.09829,-7.53,-3.85,-7.477161688635321
COCCOc1cc(NS(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)c(C(=O)[O-])cc1OC,C13453646_decoy,CASP3,Decoy,0,-7.55766,-5.18,-1.0,-5.861017304993045
COCCN(CC(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1cc(C(=O)[O-])cs1,C13454413_decoy,CASP3,Decoy,0,-8.56031,-5.57,-1.82,-6.581243820751798
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(Cl)cc2Cl)cc1,C09436963_decoy,CASP3,Decoy,0,-8.85718,-6.45,-1.68,-7.276795786855611
CCOc1cc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOC)ccc1O,C09356653_decoy,CASP3,Decoy,0,-7.09137,-6.46,-1.62,-6.693721235101086
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@@H]1c1ccc(O)cc1,C09272835_decoy,CASP3,Decoy,0,-8.42834,-6.38,-1.39,-7.093294912819654
CCOC(=O)CSC(=S)Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1,C26949772_decoy,CASP3,Decoy,0,-10.4802,-5.66,-5.15,-6.744684013777066
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@@H]1c1ccccc1,C35692519_decoy,CASP3,Decoy,0,-8.66692,-5.37,-2.52,-8.09398282876362
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1cccs1,C35695895_decoy,CASP3,Decoy,0,-10.3016,-6.37,-2.8,-8.000651001364439
COc1ccc2c(c1)c([C@H](C(=O)[O-])N1CC[NH+](C/C=C/c3ccccc3)CC1)cn2CCC(=O)[O-],C36369824_decoy,CASP3,Decoy,0,-7.0254,-6.32,-2.22,-6.207355961830357
CCCCCCNC(=O)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1,C36661270_decoy,CASP3,Decoy,0,-6.78192,-7.16,-1.65,-6.224708841778829
C=CCc1cc(/C=C2/NC(=O)N(CC)C2=O)cc(OCC)c1OCc1ccc(C(=O)[O-])cc1,C08451894_decoy,CASP3,Decoy,0,-7.39667,-6.9,-0.9,-6.3578586132892765
CO[C@@H]1[C@H](OC(=O)/C=C/C=C/C=C/C=C/C(=O)[O-])CC[C@@](C)(O)[C@@H]1[C@@]1(C)O[C@H]1CC=C(C)C,C38664924_decoy,CASP3,Decoy,0,-8.88535,-6.07,-1.75,-5.771766977212034
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCC)c(C)c2)[C@H]1c1ccc(O)c(OCC)c1,C40027270_decoy,CASP3,Decoy,0,-8.10015,-5.57,-1.4,-6.352496596290524
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC=C)[C@@H]2c2ccc(O)c(OCC)c2)cc1C,C40027434_decoy,CASP3,Decoy,0,-7.91617,-5.48,-2.39,-6.609576491457353
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@H]1c1ccc(O)c(OC)c1,C40027596_decoy,CASP3,Decoy,0,-8.47666,-7.25,-2.15,-7.238295884611643
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@H]1c1ccc(O)c(OCC)c1,C40027758_decoy,CASP3,Decoy,0,-8.20608,-6.39,-1.74,-7.079876056608367
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCCO)cc1OCC,C40047047_decoy,CASP3,Decoy,0,-8.44001,-6.34,-3.02,-8.37814056683205
CCOc1cc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCCO)ccc1OCCC(C)C,C40047340_decoy,CASP3,Decoy,0,-6.82792,-6.02,-2.15,-6.453228650876505
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40076348_decoy,CASP3,Decoy,0,-8.30037,-5.93,-3.22,-6.81485100612232
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40076432_decoy,CASP3,Decoy,0,-8.3108,-7.54,-1.33,-8.857504428076558
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(C)C)cc2)cc1,C40077980_decoy,CASP3,Decoy,0,-9.1005,-6.55,-2.09,-8.403318308661976
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OC)cc2)c(C)c1,C40081339_decoy,CASP3,Decoy,0,-7.59056,-6.5,-2.11,-7.345883263847146
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(C)C)cc2)cc1C,C40085157_decoy,CASP3,Decoy,0,-8.14965,-7.6,-1.51,-11.963860745814618
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cccc(OCCC(C)C)c2)cc1C,C40085297_decoy,CASP3,Decoy,0,-8.27505,-6.61,-2.1,-8.13679578780984
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40085299_decoy,CASP3,Decoy,0,-7.44302,-7.29,-2.13,-10.10003826593799
CCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40093357_decoy,CASP3,Decoy,0,-8.1228,-7.42,-2.64,-10.998101567463433
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40093464_decoy,CASP3,Decoy,0,-7.21502,-5.27,-4.71,-5.828670540893978
C=CCOc1ccccc1[C@@H]1C(C(=O)c2ccc(OC(C)C)c(C)c2)=C([O-])C(=O)N1CCO,C40093493_decoy,CASP3,Decoy,0,-8.06512,-7.32,-2.22,-7.675623804940865
COc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)c(OC)c1,C40094056_decoy,CASP3,Decoy,0,-7.93848,-5.83,-1.17,-7.310013742791542
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCO)cc1,C40095448_decoy,CASP3,Decoy,0,-8.34861,-6.97,-2.38,-9.9067702418873
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCO)cc1,C40095451_decoy,CASP3,Decoy,0,-8.46002,-6.88,-1.38,-6.980640050247907
CCOc1ccccc1[C@@H]1C(C(=O)c2cc3ccccc3o2)=C([O-])C(=O)N1CCOCCO,C40097093_decoy,CASP3,Decoy,0,-7.66588,-7.76,-1.27,-8.52467830538796
COc1cccc2cc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@@H]3/C=C/c3ccccc3)oc12,C40097943_decoy,CASP3,Decoy,0,-7.70646,-8.24,-1.03,-7.759083883830379
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc3ccccc23)cc1,C40099400_decoy,CASP3,Decoy,0,-8.37198,-6.74,-2.33,-7.485243030313015
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N[C@@H]2c2cc(OC)c(OC)c(OC)c2)cc1C,C40124038_decoy,CASP3,Decoy,0,-7.61231,-6.73,-1.0,-7.832515072746796
CCc1cccc2c(C(=O)CSc3nc4cc(C(=O)[O-])ccc4c(=O)n3CCCOC)c[nH]c12,C13047796_decoy,CASP3,Decoy,0,-7.40191,-6.96,-2.6,-6.926025109444858
COC(=O)CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)cc1,C46698133_decoy,CASP3,Decoy,0,-7.97498,-7.5,-3.95,-7.227753531257028
CCCCN/C([O-])=C(\C#N)C(=O)/C=C/c1cc(Cl)c(OC(C)C)c(OC)c1,C51010056_decoy,CASP3,Decoy,0,-7.98539,-6.19,-1.85,-6.078282496555514
CCCCN/C([O-])=C(\C#N)C(=O)/C=C\c1ccccc1OCc1csc(C)n1,C51010874_decoy,CASP3,Decoy,0,-8.42117,-7.03,-1.66,-8.841131667399843
[H]/N=C(C)\C(C(C)=O)=C(/[O-])COC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OCC)cc2)c1C,C58450124_decoy,CASP3,Decoy,0,-9.15534,-7.62,-1.05,-10.348908157423937
COCCCNC(=O)c1cccnc1Oc1cccc([N-]S(=O)(=O)c2ccc(Cl)s2)c1,C65059878_decoy,CASP3,Decoy,0,-9.16414,-6.22,-1.42,-6.789805224946553
CC1(C)S[C@H]2[C@H]([NH2+]Cn3nnc4ccccc43)C(=O)N2[C@H]1C(=O)[O-],C05304241_decoy,CASP3,Decoy,0,-6.80153,-7.37,-0.94,-6.799400926293969
N#C/C(=C/N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)C(N)=O,C01637387_decoy,CASP3,Decoy,0,-6.32853,-5.13,-0.94,-5.058116853815034
N#C/C(=C\N1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S)C(N)=O,C08665224_decoy,CASP3,Decoy,0,-6.90364,-5.9,-0.04,-5.118250751149256
O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1nnc(C2CC2)s1,C16694445_decoy,CASP3,Decoy,0,-8.00046,-7.04,-0.18,-5.772606884736074
O=C1N[C@@H]2[C@@H]3N1CN(CCO)CN3C(=O)N2C1CCCCC1,C12363190_decoy,CASP3,Decoy,0,-5.74034,-5.46,-1.25,-4.644490912714096
CN1CCN(C(=O)CCNc2nc(Cl)nc3[nH]cnc23)CC1,C20647864_decoy,CASP3,Decoy,0,-6.65722,-4.87,-1.14,-5.161646135828655
CCNC(=O)c1cc2n(n1)C[C@](C)(C(=O)NC1CCCCC1)N(C)C2=O,C21874986_decoy,CASP3,Decoy,0,-7.09533,-7.02,-0.83,-6.486381272216593
Cc1nnc(Sc2ccc3nnc(C(F)(F)F)n3n2)n1N,C22195636_decoy,CASP3,Decoy,0,-6.71522,-5.35,-0.45,-4.211960881067414
CN(C)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cn1,C28843777_decoy,CASP3,Decoy,0,-6.11612,-5.25,-1.19,-4.778466847303371
CNC(=O)NC(=O)[C@H](C)Sc1nnnn1C1CCCCC1,C09255607_decoy,CASP3,Decoy,0,-6.85323,-7.27,-0.92,-7.068232234267282
Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1c(C)n[nH]c1C,C35132930_decoy,CASP3,Decoy,0,-5.1814,-5.39,-2.34,-4.846744424641295
O=C1N[C@H]2[C@@H]3N1CN(CCO)CN3C(=O)N2C1CCCCC1,C12363189_decoy,CASP3,Decoy,0,-6.6673,-5.16,-0.84,-4.619555444041756
Cc1ccc/c(=N/S(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]1,C37326229_decoy,CASP3,Decoy,0,-6.32481,-7.55,-0.92,-7.310780649373637
CC1(C)[C@@]2(C(=O)NNc3ccc([N+](=O)[O-])cc3)CC[C@]1(C)C(=O)O2,C04994559_decoy,CASP3,Decoy,0,-5.48713,-7.69,-1.72,-5.832733133735924
C[C@H]1C(C(=O)N2CCCc3ncccc32)=CNN1c1ccc(=O)[nH]n1,C38796612_decoy,CASP3,Decoy,0,-5.60161,-6.95,-0.63,-6.5042595510044
Oc1ccc(/C=N/N2C(=S)N=N[C@H]2[C@@H]2N=NC3=C2CCC3)cc1O,C38984049_decoy,CASP3,Decoy,0,-7.17001,-7.29,-0.56,-6.3660571092906615
COc1ccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)c(OC)c1OC,C39022447_decoy,CASP3,Decoy,0,-6.30683,-5.43,-0.67,-4.913645090165715
COCC1=C2[C@@H](c3ccc4c(c3)OCO4)C(C#N)=C(N)O[C@@H]2N=N1,C39206144_decoy,CASP3,Decoy,0,-7.27083,-5.94,-0.47,-6.507105613285948
CCOn1c2c(c3ncc(O)cc3c1=O)N[C@@H](OC)CC2=O,C39449778_decoy,CASP3,Decoy,0,-7.36954,-7.47,-1.28,-8.174469718159603
C[C@@H]1[NH+]=c2ccccc2=C1/C=C\c1nc([O-])c([N+](=O)[O-])c(=O)[nH]1,C39715481_decoy,CASP3,Decoy,0,-6.49833,-7.72,-0.31,-6.110493904049049
O=[N+]([O-])c1cc(Cl)ccc1[N-]S(=O)(=O)N1CC[NH2+]CC1,C40860838_decoy,CASP3,Decoy,0,-6.59594,-5.56,-1.1,-4.874294674433404
COC(=O)CNC(=O)N1CCc2[nH]cnc2[C@H]1c1ccccn1,C44577629_decoy,CASP3,Decoy,0,-6.28473,-5.44,-0.68,-5.23953848852704
CNc1ccc(C(=O)Nc2nc3c(s2)CN(C)CC3)cc1[N+](=O)[O-],C45574867_decoy,CASP3,Decoy,0,-6.84169,-5.66,-1.62,-5.239335187464129
Cc1nnc(NC(=O)c2csc(Nc3ncccn3)n2)s1,C49032211_decoy,CASP3,Decoy,0,-7.4722,-5.36,-0.41,-5.603631660601646
CC(=O)[C@@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@H](C#N)C(=O)N[C@@]1(C)O,C04860766_decoy,CASP3,Decoy,0,-4.79816,-6.31,-1.54,-5.329373872650216
O=C1NCCC[C@@H]1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl,C50397674_decoy,CASP3,Decoy,0,-6.76383,-5.26,-0.36,-4.920717167162098
CNc1nc2sccn2c1S(=O)(=O)Nc1cc(C)nn1C,C50649549_decoy,CASP3,Decoy,0,-6.90207,-5.33,-1.75,-6.807149541699431
Cn1cc(CNC(=O)Nc2cc(N3CCOC3=O)ccc2F)cn1,C54512627_decoy,CASP3,Decoy,0,-7.52279,-6.62,-2.05,-6.429185396128844
CC1=C(C(=O)N2CCN(C)CC2)[C@@H](c2ccccc2O)n2ncnc2N1,C54672249_decoy,CASP3,Decoy,0,-6.31562,-6.53,-0.73,-4.961911703950848
Cc1nsc(NC(=O)N2CCc3nc[nH]c3[C@@H]2c2ccccn2)n1,C55120361_decoy,CASP3,Decoy,0,-7.15502,-5.41,-2.43,-5.763863461260482
Cc1noc([C@@H]2CCCCN2C(=O)CSc2nnc(N)s2)n1,C55307764_decoy,CASP3,Decoy,0,-7.21829,-5.33,-3.15,-3.904057723686352
O=C(N=c1[nH]c2ccccc2[nH]1)c1ccc(-n2cnnn2)cc1,C06610608_decoy,CASP3,Decoy,0,-5.70115,-5.56,-0.93,-4.43171863493315
Cc1csc(N2CCCN(Cc3nc(N)nc(N(C)C)n3)CC2)n1,C58218369_decoy,CASP3,Decoy,0,-7.69666,-6.38,-1.1,-4.89579928245288
CCn1/c(=N/C(=O)c2cc(S(=O)(=O)NC)cn2C)[nH]c2ccccc21,C21592768_decoy,CASP3,Decoy,0,-8.0945,-6.63,-1.28,-6.561928322349953
CC1=CC(=O)C(=C2C=CNc3nc([NH+]4CCCC4)nc([O-])c32)C(=O)O1,C19973924_decoy,CASP3,Decoy,0,-7.29019,-6.22,-0.59,-4.646084969475777
Cc1n[nH]c(N/N=C/c2c(-c3ccccc3)nc3sccn23)nc1=O,C19633218_decoy,CASP3,Decoy,0,-8.93007,-6.46,-2.36,-6.071829302672822
Cc1cc(NC(=O)c2ccc(C(=O)Nc3cc(C)nn3C)s2)n(C)n1,C47088624_decoy,CASP3,Decoy,0,-8.39821,-6.74,-1.03,-9.50863926495476
COC(=O)c1sc(NC(=O)[C@]2(C)Oc3ccccc3N=C2O)nc1C,C36360889_decoy,CASP3,Decoy,0,-9.15692,-5.73,-2.02,-5.552579239135657
CC1=C2[C@H](c3cccs3)CC(=O)N[C@@H]2N(C2=NC=NC3=NC=N[C@@H]32)N1,C38581260_decoy,CASP3,Decoy,0,-8.24139,-6.66,-0.63,-6.95577654733097
C[C@H](C(=O)NC(=O)NC1CCCC1)N1CCN(c2cnccn2)CC1,C27634505_decoy,CASP3,Decoy,0,-8.14892,-5.91,-0.27,-5.7543731214440985
Cc1coc2cc3c(cc12)[C@H](C)[C@@H](CC(=O)/N=c1/[nH]cn[nH]1)C(=O)O3,C39276011_decoy,CASP3,Decoy,0,-6.54939,-5.68,-0.87,-4.584693657596285
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCCNC2=O)cc1C,C65265053_decoy,CASP3,Decoy,0,-6.53113,-5.73,-0.86,-4.470207484398591
CNC(=O)C1=C2[C@H](c3cccc4nsnc34)CC(=O)N[C@@H]2N=N1,C65374217_decoy,CASP3,Decoy,0,-7.61483,-5.16,-0.49,-4.677252216041244
O=C1C[C@H](c2ccc(-n3cncn3)cc2)c2cc3[nH]c(=O)oc3cc2N1,C65528210_decoy,CASP3,Decoy,0,-7.33923,-5.86,-2.58,-5.35901437001298
Cc1ccccc1-n1nc(C(=O)NNC(=O)c2cnccn2)c2c1CCC2,C65581993_decoy,CASP3,Decoy,0,-7.52693,-7.8,-1.17,-6.33471176882061
COc1ccnc(N2CCN(C(=O)c3cc(C(N)=O)cs3)CC2)n1,C54098171_decoy,CASP3,Decoy,0,-7.62818,-6.87,-0.6,-5.501377173886145
O=C(C=C1CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1,C65769213_decoy,CASP3,Decoy,0,-5.91728,-5.89,-1.0,-4.794986128179185
CN1CC(=O)Nc2cc(C(=O)/N=c3\[nH]nc4ccccn34)ccc21,C65791225_decoy,CASP3,Decoy,0,-7.32598,-6.12,-1.41,-5.161103687738842
O=C1NCCCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])s1,C66327742_decoy,CASP3,Decoy,0,-7.00952,-6.36,-1.14,-5.840845380804192
Cc1noc([C@H]2CCCN(C(=O)NNC(=O)CC3CCCCC3)C2)n1,C67103538_decoy,CASP3,Decoy,0,-7.69168,-6.37,-1.05,-7.254943614338607
Cc1c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cnn1C,C02759590_decoy,CASP3,Decoy,0,-7.23792,-5.73,-0.91,-4.939102235099591
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cnn(C)c1C,C06527549_decoy,CASP3,Decoy,0,-6.13382,-4.38,-0.47,-4.546523042957023
Cc1cccn2c(=O)c(C(=O)NCC(C)C)c(O)nc12,C09830105_decoy,CASP3,Decoy,0,-6.06039,-6.32,-1.43,-7.161110383069273
Cc1nc(-c2ccccc2)cc(-n2ncc(C#N)c2N)n1,C11568503_decoy,CASP3,Decoy,0,-5.54239,-6.37,-1.81,-5.077495855652672
CC1=C/C(=N\NC(=O)C(=O)N/N=C2\C=C(C)CC2)CC1,C06674508_decoy,CASP3,Decoy,0,-5.98656,-7.5,-2.24,-8.045870834519818
COCc1cc(C)nc2sc(-c3nnc(C)o3)c(N)c12,C06659366_decoy,CASP3,Decoy,0,-7.92108,-4.93,-0.91,-4.596573372215315
Cc1ccc(N2C[C@@H](NC(=O)Nc3ccncc3)CC2=O)cc1,C04272585_decoy,CASP3,Decoy,0,-6.15137,-5.18,-1.11,-4.996897714039852
Cn1c(=O)cc(N/N=C/c2ccc(Cl)cc2)[nH]c1=O,C13844612_decoy,CASP3,Decoy,0,-5.83592,-5.16,-0.46,-4.456516779938604
Cn1cc(C(=O)NNC(=O)c2cc3c(s2)CCC3)cn1,C17446022_decoy,CASP3,Decoy,0,-6.86352,-4.86,-1.64,-3.9120238940618814
O=S(=O)(Nc1nnc[nH]1)c1ccc(Br)cc1,C18193951_decoy,CASP3,Decoy,0,-6.24629,-4.89,0.26,-4.597462039287326
O=c1nc(N/N=C/c2ccc(Cl)cc2Cl)cn[nH]1,C12341024_decoy,CASP3,Decoy,0,-7.87148,-7.98,-0.59,-12.043303830450528
NC(=S)c1ccnc(N2CCN(c3ncccn3)CC2)c1,C19805671_decoy,CASP3,Decoy,0,-6.05003,-5.08,0.04,-3.833868304133656
CC[C@H]1[C@H]2CN(C(C)=O)CC=C2C(C#N)=C(N)C1(C#N)C#N,C00804161_decoy,CASP3,Decoy,0,-6.12972,-5.28,-0.96,-4.793396419700402
O=C(N/N=C\c1ccc(Br)cc1)c1nc[nH]n1,C34744330_decoy,CASP3,Decoy,0,-6.80957,-4.87,-0.82,-4.28195554462488
O=C([O-])[C@H]1CCCN(C(=O)N[C@H]2C[NH+]3CCC2CC3)C1,C36724506_decoy,CASP3,Decoy,0,-6.89022,-5.83,-0.82,-5.477603657870811
Cc1n[nH]c(C)c1NS(=O)(=O)c1cccnc1Cl,C36736493_decoy,CASP3,Decoy,0,-5.74174,-4.83,-3.35,-4.813352615341677
c1cncc(-c2cc(-c3cc(-c4cccnc4)[nH]n3)n[nH]2)c1,C03954616_decoy,CASP3,Decoy,0,-5.96055,-5.75,0.23,-5.116357714884711
Cc1cc(N2CCc3c(N)cccc3C2)n2ncnc2n1,C38032964_decoy,CASP3,Decoy,0,-6.41183,-6.34,0.21,-4.085345501318635
COc1cc2c(cc1OC)[C@H](C1=C(C)N=N[C@H]1O)NCC2,C39029765_decoy,CASP3,Decoy,0,-6.08633,-5.36,-1.25,-5.832978334430786
C[C@H](c1ncn[nH]1)N1CNc2cccc(C(F)(F)F)c2C1=O,C39454770_decoy,CASP3,Decoy,0,-6.42733,-5.85,-1.16,-5.42350362521708
CCN(CC)C(=O)N1CCN(C(=O)c2sccc2N)CC1,C40329390_decoy,CASP3,Decoy,0,-5.92242,-5.15,-1.19,-5.447525584011801
C[C@@H](C(N)=O)n1nnc(-c2ccc(Br)cc2)n1,C40460846_decoy,CASP3,Decoy,0,-6.56432,-5.63,-0.25,-3.7994935443528624
NC(=O)[C@H]1CCCCN1c1nc2sccn2c1C=O,C42405190_decoy,CASP3,Decoy,0,-7.499,-4.6,-1.72,-5.533122832054112
C[C@H]1CC[C@H](C(N)=O)CN1c1nc2ccccn2c1C=O,C42429386_decoy,CASP3,Decoy,0,-8.09737,-5.91,-0.88,-5.745586302941176
Cc1nc(NC(=O)N[C@@H](C)c2cnn(C)c2C)sc1C,C43549455_decoy,CASP3,Decoy,0,-6.60813,-5.06,-2.28,-4.40913880375624
C[NH+]1CCC(CNC(=O)N2CCC[C@H](C(=O)[O-])C2)CC1,C44527161_decoy,CASP3,Decoy,0,-5.6542,-5.22,-0.34,-4.563249274056353
CC(=O)NNC(=O)/C=C/c1c(Cl)nc2ccccn12,C45826802_decoy,CASP3,Decoy,0,-6.43016,-5.3,-0.34,-5.141573874168842
C[C@@H]1C[C@H](C)CN(C(=O)c2ccc(S(N)(=O)=O)o2)C1,C47932462_decoy,CASP3,Decoy,0,-8.31473,-7.55,-0.2,-12.671847157587496
Cc1cc([C@H](C)NC(=O)Nc2nc(C)c(C)o2)c(C)o1,C49396071_decoy,CASP3,Decoy,0,-6.65721,-5.89,-1.54,-5.630526299616228
Cc1nc(NC(=O)N[C@H](C)C(=O)N2CCCC2)sc1C,C49516704_decoy,CASP3,Decoy,0,-7.04887,-5.44,-1.04,-4.556606571260961
COc1ccc([C@@H]2SCC(=O)Nc3c2cnn3C)cc1O,C49544666_decoy,CASP3,Decoy,0,-7.50724,-5.05,-0.67,-5.617355451321929
O=C([O-])C1CCN(C(=O)N[C@@H]2CC[NH+]3CCCC[C@@H]23)CC1,C49571066_decoy,CASP3,Decoy,0,-6.4628,-5.88,-0.96,-5.077422451931266
O=C([O-])[C@@H]1CCCN(C(=O)N[C@@H]2CC[NH+]3CCC[C@H]23)C1,C49571504_decoy,CASP3,Decoy,0,-6.38682,-5.38,-0.06,-4.899446623161348
C[C@@H]1C[C@@H](C)CN(C(=O)c2cc(N)ccc2[N+](=O)[O-])C1,C50699584_decoy,CASP3,Decoy,0,-5.58785,-5.09,-1.09,-4.79498505926563
CN(C(=O)c1cc(N)c(F)cc1[N+](=O)[O-])[C@@H]1CCSC1,C50701660_decoy,CASP3,Decoy,0,-7.09678,-4.62,-1.31,-5.764351969326508
Nc1cc(C(=O)N2C[C@@H]3CC[C@H]2C3)c([N+](=O)[O-])cc1F,C50708452_decoy,CASP3,Decoy,0,-4.82479,-5.47,-0.34,-4.706831013370177
Nc1ncccc1CN1C=Nc2ccccc2S1(=O)=O,C52733899_decoy,CASP3,Decoy,0,-5.6638,-5.48,-0.92,-3.3903246052293308
CN(C)NC(=O)C1(C)C[C@@]2(C)C[C@@](C)(C1)C(=O)NC2=O,C08534635_decoy,CASP3,Decoy,0,-5.7535,-5.06,-2.82,-4.930333126573769
Nc1nc(Cl)cc(N2CCC[C@H](C3OCCO3)C2)n1,C60362960_decoy,CASP3,Decoy,0,-7.11017,-4.85,-2.27,-4.521821476819158
Nc1c(Cl)ncnc1N1CCN(c2nccs2)CC1,C60837048_decoy,CASP3,Decoy,0,-6.93589,-4.58,-1.37,-4.731144533790966
C[C@@H]1CCC[C@@H](NC(=O)N2CCC[NH+](CC(=O)[O-])CC2)C1,C61145673_decoy,CASP3,Decoy,0,-6.18432,-6.4,-0.22,-5.311851124344873
Nc1cc(F)c(F)cc1-c1nnnn1C[C@@H]1CCOC1,C61147829_decoy,CASP3,Decoy,0,-7.87742,-5.34,-0.1,-5.61878978346077
CCn1cc(-c2csc(-c3cnc(C)nc3N)n2)cn1,C62329637_decoy,CASP3,Decoy,0,-6.84564,-5.04,-0.65,-4.925326087155503
Nc1cccc(-n2nncc2-c2ccc3c(c2)OCCO3)c1,C62428831_decoy,CASP3,Decoy,0,-6.82565,-6.66,-0.74,-5.542273160762504
C[NH+]1CCC(CNC(=O)N2CCC(C)(C(=O)[O-])CC2)CC1,C62843832_decoy,CASP3,Decoy,0,-6.10475,-4.83,-1.6,-4.358698892454638
C[NH+]1CCC(NC(=O)N2CCC[C@@](C)(C(=O)[O-])C2)CC1,C62873756_decoy,CASP3,Decoy,0,-5.37171,-4.44,-1.04,-4.225834691340334
CC[C@]1(C(=O)[O-])CCCN(C(=O)N[C@@H]2CC[NH+](C)C2)C1,C62875034_decoy,CASP3,Decoy,0,-5.90825,-4.5,-0.69,-4.581214269975385
CN1N=C(C(C)(C)C)[C@@H]2[C@H]1NC(=O)C[C@H]2c1ncc[nH]1,C65386318_decoy,CASP3,Decoy,0,-6.87105,-5.46,-2.28,-5.206023402526095
O=C1NCCCC2=N[C@@H]([C@H]3N=NC4=C3CCCCC4)N[C@@H]12,C65490829_decoy,CASP3,Decoy,0,-6.96172,-5.91,-0.58,-3.44748577839149
Cc1cc(C)nc(NNC(=O)c2cc(Cl)ccn2)n1,C21127539_decoy,CASP3,Decoy,0,-7.10087,-5.71,-2.26,-5.743405580008452
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)NCC(=O)[O-],C08771640_decoy,CASP3,Decoy,0,-10.5925,-7.82,-2.59,-7.809228604221745
COc1ccc(/C=C2/SC(=S)N(CCC(=O)N[C@@H](CCC(N)=O)C(=O)[O-])C2=O)cc1,C08870111_decoy,CASP3,Decoy,0,-5.81677,-6.12,-1.43,-5.651365828225923
COc1ccc(/C=C2/SC(=S)N(CCC(=O)N[C@H](CCC(N)=O)C(=O)[O-])C2=O)cc1OC,C08870141_decoy,CASP3,Decoy,0,-8.93465,-5.43,-0.99,-6.508760028398519
CC(=O)[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CCC(N)=O)C(=O)[O-])CC[C@]4(C)[C@@H]3CC[C@@]21C,C12296533_decoy,CASP3,Decoy,0,-10.1952,-8.32,-1.12,-7.864792248581857
CSCC[C@H](NC(=O)CO/N=C1/C=C2CC[C@@H]3[C@@H](CC[C@@]4(C)[C@H]3CC[C@]4(O)C(C)=O)[C@@]2(C)CC1)C(=O)[O-],C12296800_decoy,CASP3,Decoy,0,-8.69986,-6.34,-1.21,-6.161518439094818
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N1CCC(C(=O)N2C[C@@H](O)C[C@H]2C(=O)[O-])CC1,C12863656_decoy,CASP3,Decoy,0,-8.95662,-8.61,-2.89,-8.168075870560727
C/C(=N\NC(=S)Nc1ccccc1F)c1ccc(S(=O)(=O)N[C@@H](C)C(=O)[O-])cc1,C13013254_decoy,CASP3,Decoy,0,-8.62681,-6.91,-1.67,-6.88645350308944
C/C(=N\NC(=S)Nc1ccc(F)cc1F)c1ccc(S(=O)(=O)N[C@@H](C)C(=O)[O-])cc1,C13013296_decoy,CASP3,Decoy,0,-8.5395,-7.05,-2.07,-6.281496936659012
Cc1ccc(-c2nnc(SCC(=O)NNC(=O)C[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13035766_decoy,CASP3,Decoy,0,-7.95294,-7.75,-1.57,-9.24378436772459
Cc1ccc(-c2nnc(SCC(=O)NNC(=O)C[C@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13035767_decoy,CASP3,Decoy,0,-6.42179,-8.33,-0.92,-8.937529987672615
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2cccs2)n1CCC(=O)[O-],C13192427_decoy,CASP3,Decoy,0,-9.33954,-6.06,-0.89,-6.947011659348459
COc1ccc(OC[C@@H](O)Cn2c(SCC(=O)[O-])nc3c2c(=O)[nH]c(=O)n3C)cc1,C13230684_decoy,CASP3,Decoy,0,-8.82539,-6.19,-2.08,-6.724769364064144
Cc1ccc(NC(=O)CN(C)C(=O)CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1,C13234916_decoy,CASP3,Decoy,0,-6.91554,-8.13,-1.94,-6.777757191995762
CN(CC(=O)Nc1ccc(Cl)cc1)C(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13236235_decoy,CASP3,Decoy,0,-8.02659,-8.87,-3.84,-6.865351246151658
CN(CC(=O)Nc1ccc(Cl)cc1)C(=O)CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13236238_decoy,CASP3,Decoy,0,-7.13612,-7.95,-3.09,-6.336331659600869
CCc1ccc(CN(C)C(=O)CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1,C13236582_decoy,CASP3,Decoy,0,-6.33282,-7.7,-1.48,-6.522088360650743
CN(CC(=O)NC(C)(C)C)C(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13237725_decoy,CASP3,Decoy,0,-7.34679,-8.12,-1.8,-6.4186909405274335
CC(C)CN(C(=O)CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13237756_decoy,CASP3,Decoy,0,-8.81992,-7.99,-2.77,-8.120919886007234
O=C(CNC(=O)N[C@H](CC(=O)N1CCOCC1)C(=O)[O-])N[C@H](c1ccc(F)cc1)c1cccs1,C13243961_decoy,CASP3,Decoy,0,-8.38933,-7.92,-0.33,-6.542134533617538
CCOC(=O)N1CCC(NC(=O)CNC(=O)N[C@@H](CC(=O)N2CCCC2)C(=O)[O-])CC1,C13245722_decoy,CASP3,Decoy,0,-6.45356,-6.2,-1.12,-5.291012821282336
CCOC(=O)N1CCC(NC(=O)CNC(=O)N[C@H](CC(=O)N2CCCC2)C(=O)[O-])CC1,C13245725_decoy,CASP3,Decoy,0,-8.06061,-7.77,-1.25,-7.292313645246327
O=C(NCC(=O)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1)N[C@H](CC(=O)N1CCCC1)C(=O)[O-],C13245873_decoy,CASP3,Decoy,0,-7.67964,-8.21,-2.76,-7.677933187442905
O=C(NCC(=O)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1)N[C@@H](CC(=O)N1CCCC1)C(=O)[O-],C13245875_decoy,CASP3,Decoy,0,-7.86339,-7.57,-2.52,-7.318113812952911
O=C(NCC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)N[C@H](CC(=O)N1CCCC1)C(=O)[O-],C13245877_decoy,CASP3,Decoy,0,-8.17866,-7.3,-1.02,-6.655875427948003
O=C(NCC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)N[C@@H](CC(=O)N1CCCC1)C(=O)[O-],C13245880_decoy,CASP3,Decoy,0,-8.53306,-7.58,-2.83,-7.749383643770071
COc1ccc(NS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)cc1S(N)(=O)=O,C13344590_decoy,CASP3,Decoy,0,-8.87746,-8.37,-2.1,-9.194192394842592
CC(C)[C@H](S)C(=O)NC1(C(=O)N[C@H](Cc2ccc(-c3cccc(N)c3)nc2)C(=O)[O-])CCCC1,C13859928_decoy,CASP3,Decoy,0,-7.97768,-7.95,-3.59,-7.0469761469239245
COC(=O)/C(=N\O)[C@@H](C(=O)OC)C(=O)C(=O)Nc1c(Cl)cc(C)cc1S(=O)(=O)[O-],C16957752_decoy,CASP3,Decoy,0,-8.57177,-6.18,-1.4,-7.449386642589451
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O)C(=O)OC2,C22064311_decoy,CASP3,Decoy,0,-7.40173,-8.23,-0.98,-5.592098707987932
Cc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc(OCC(N)=O)cc2)o1,C16735233_decoy,CASP3,Decoy,0,-8.71906,-7.6,-3.76,-7.478464894638975
COc1cc(C(=O)[O-])c(CNC(=O)CSc2nc(N)nc3[nH]cnc23)c(OC)c1OC,C30953816_decoy,CASP3,Decoy,0,-6.55653,-6.32,-2.0,-5.994366239506315
COc1ccc(/C=C2\SC(=S)N(CCC(=O)N[C@@H](CCC(N)=O)C(=O)[O-])C2=O)cc1,C35656006_decoy,CASP3,Decoy,0,-9.06167,-6.02,-1.15,-6.918228652877684
COc1ccc(/C=C2\SC(=S)N(CCC(=O)N[C@H](CCC(N)=O)C(=O)[O-])C2=O)cc1,C35656007_decoy,CASP3,Decoy,0,-7.25737,-7.45,-0.73,-11.03478783261936
COc1ccc(/C=C2\SC(=S)N(CCC(=O)N[C@H](CCC(N)=O)C(=O)[O-])C2=O)cc1OC,C35656021_decoy,CASP3,Decoy,0,-8.80579,-6.67,-0.77,-8.04750571070062
CC(=O)[C@@]1(O)CC[C@@H]2[C@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CCC(N)=O)C(=O)[O-])CC[C@]4(C)[C@H]3CC[C@@]21C,C36369740_decoy,CASP3,Decoy,0,-9.60508,-8.62,-2.34,-8.548801392865213
CSCC[C@H](NC(=O)CO/N=C1/C=C2CC[C@H]3[C@@H](CC[C@@]4(C)[C@@H]3CC[C@]4(O)C(C)=O)[C@@]2(C)CC1)C(=O)[O-],C36369750_decoy,CASP3,Decoy,0,-9.79884,-7.86,-2.83,-7.242354856587092
C=C1CS[C@H]([C@H](C=O)NC(=O)/C(=N/OC(C)(C)C(=O)[O-])c2csc(N)n2)[NH+]=C1C(=O)[O-],C12503723_decoy,CASP3,Decoy,0,-7.77631,-7.12,-0.38,-7.197315318380722
C=C1CS[C@H]([C@@H](C=O)NC(=O)/C(=N/OC(C)(C)C(=O)[O-])c2csc(N)n2)[NH+]=C1C(=O)[O-],C12503724_decoy,CASP3,Decoy,0,-7.1421,-7.04,-1.65,-7.246987138142126
CS(=O)(=O)[C@H]1NN[C@@H](CCCCCNS(=O)(=O)c2ccc3nc([O-])oc3c2)O1,C38794031_decoy,CASP3,Decoy,0,-9.37724,-5.11,-1.29,-6.53709951040972
CCOc1ccc([C@H]2NN=C(CNC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)[O-])O2)cc1,C39679821_decoy,CASP3,Decoy,0,-6.63174,-7.39,-1.55,-5.612008755335639
CCOc1ccc([C@@H]2NN=C(CNC(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)[O-])O2)cc1,C39679822_decoy,CASP3,Decoy,0,-9.03013,-8.1,-1.88,-8.923922619076752
CN(CC1=CNN(c2ccccc2)C1)C(=O)CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39679837_decoy,CASP3,Decoy,0,-7.67346,-7.27,-2.66,-7.417732990529949
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)OC2,C39937322_decoy,CASP3,Decoy,0,-6.90038,-9.05,-2.38,-6.423965248215397
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)OC2,C39937323_decoy,CASP3,Decoy,0,-5.86914,-9.02,-2.59,-6.517341590348064
CSCC[C@@H](NC(N)=O)C(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(C)nc(C)n2)cc1,C41105290_decoy,CASP3,Decoy,0,-9.11999,-6.78,-4.09,-7.752652655299208
COc1ccccc1[C@@H]1[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C(=O)N(CCCSC)C(=O)[C@H]21,C43218393_decoy,CASP3,Decoy,0,-7.58529,-5.48,-1.17,-6.241340607581384
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)C(=O)OC2,C44963894_decoy,CASP3,Decoy,0,-6.19546,-8.35,-2.8,-5.573687550795277
CN1C(=O)C(C(=O)C[C@H](NC(CO)(CO)CO)c2cccs2)=C([O-])[C@@H]2C=CC=C[C@@H]21,C35614467_decoy,CASP3,Decoy,0,-10.1058,-7.01,-0.82,-8.888582783571966
CCOC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@H]1c1cc(OC)c(OC)c(OC)c1,C59293956_decoy,CASP3,Decoy,0,-7.43352,-5.51,-2.13,-5.167394357644936
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O)C(=O)OC2,C65747913_decoy,CASP3,Decoy,0,-6.29043,-8.9,-2.36,-7.048847081979351
COc1ccc(-n2nnc3c(N4CCN(C(=O)/C=C\c5ccc(OC)c(OC)c5)CC4)ncnc32)cc1,C09850217_decoy,CASP3,Decoy,0,-8.3769,-7.45,-1.72,-6.400596543154082
COCCCn1cc(C(=O)N2CCN(c3ccccc3OC)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C10062856_decoy,CASP3,Decoy,0,-7.02742,-7.38,-1.3,-6.848839435997565
CCOc1ccc(-n2nnc3c(N4CCN(C(=O)/C=C\c5ccc([N+](=O)[O-])cc5)CC4)ncnc32)cc1,C10256457_decoy,CASP3,Decoy,0,-8.05575,-6.58,-1.52,-6.432765856074321
Cn1c(=O)[nH]c(=O)c2c1nc(N1CCN(c3ccccc3F)CC1)n2CCCSc1ccc(F)cc1,C10249004_decoy,CASP3,Decoy,0,-10.1121,-8.82,-2.98,-11.14771209602067
COc1ccc(CCN2CCn3c2nc2c3c(=O)n(Cc3cccc([N+](=O)[O-])c3)c(=O)n2C)cc1OC,C10251975_decoy,CASP3,Decoy,0,-7.95518,-8.5,-2.66,-5.918983028172849
Cc1ccc(N2C[C@H](C(=O)NCCS(=O)(=O)N3CCN(c4ccccc4F)CC3)CC2=O)cc1C,C10069824_decoy,CASP3,Decoy,0,-8.34348,-8.23,-1.64,-6.687882910790355
CS(=O)(=O)c1cccc2sc(N(Cc3ccco3)C(=O)CCS(=O)(=O)c3ccccc3)nc12,C10827763_decoy,CASP3,Decoy,0,-9.30367,-8.25,-2.95,-11.320179911308706
CS(=O)(=O)c1cccc2sc(N(C[C@H]3CCCO3)C(=O)CCCS(=O)(=O)c3ccccc3)nc12,C10830151_decoy,CASP3,Decoy,0,-9.80234,-7.5,-5.04,-7.471149503891556
COc1cc(/C=C\C(=O)N2CCN(c3ncnc4c3nnn4-c3ccc(C)cc3)CC2)cc(OC)c1OC,C12310218_decoy,CASP3,Decoy,0,-9.0958,-8.13,-0.91,-9.213166417534476
COc1ccc2cnn(-c3nc4c(c(=O)n(C)c(=O)n4C)n3CCCc3ccccc3)c(=O)c2c1OC,C12531198_decoy,CASP3,Decoy,0,-7.38506,-7.33,-2.36,-6.092666066762579
C/C(=N/NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(Br)cc1)c1cccnc1,C16712249_decoy,CASP3,Decoy,0,-7.82115,-6.62,-2.01,-6.772306663619864
CCCOc1ccc(CN(C(=O)c2nc(S(C)(=O)=O)ncc2Cl)[C@@H]2CCS(=O)(=O)C2)cc1,C16752846_decoy,CASP3,Decoy,0,-8.62122,-7.47,-2.16,-7.750460055619815
CCn1c(SCC(=O)Nc2ccc(Br)cc2)nnc1[C@H]1CCCN(S(C)(=O)=O)C1,C20214492_decoy,CASP3,Decoy,0,-9.09531,-7.75,-2.28,-6.833042611479791
CCn1c(SCC(=O)Nc2nc3ccccc3s2)nnc1[C@H]1CCCN1C(=O)c1cccc(C)c1,C20333725_decoy,CASP3,Decoy,0,-10.7461,-8.29,-2.48,-9.46330222438344
C[C@@H]1CCc2c(sc3nc(SCC(=O)N(CCC#N)CCC#N)n(C[C@@H]4CCCO4)c(=O)c23)C1,C22559303_decoy,CASP3,Decoy,0,-9.80228,-5.54,-2.55,-7.132990854759139
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)OCc3noc(-c4ccsc4)n3)c12,C23006763_decoy,CASP3,Decoy,0,-8.63995,-8.35,-1.76,-6.622268407493549
O=C(CN1C(=O)[C@H]2CN(Cc3ccc(Cl)s3)CCN2C1=O)NCc1ccc(C(F)(F)F)nc1,C24901562_decoy,CASP3,Decoy,0,-8.81782,-6.2,-4.16,-6.953878076058493
[H]/N=C1C(=C\c2cc(Cl)c(OCCOc3ccccc3Cl)c(OC)c2)/C(=O)N=C2SC(C)=NN2/1,C32109358_decoy,CASP3,Decoy,0,-9.06516,-6.67,-2.79,-6.591765473186637
[H]/N=C1C(=C/c2cc(C)n(-c3cc(Cl)c(OC)cc3OC)c2C)/C(=O)N=C2SC(CCCC)=NN2/1,C33622775_decoy,CASP3,Decoy,0,-8.9666,-6.87,-2.65,-6.732823106928466
O=C(Nc1cccc(Cl)c1)N1CCO[C@H](CN(CCN2CCOCC2)C(=O)c2ccc(F)cc2)C1,C34692201_decoy,CASP3,Decoy,0,-9.36477,-6.95,-4.11,-7.723324225207028
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,C34792902_decoy,CASP3,Decoy,0,-9.74517,-8.39,-1.09,-8.10387671544733
Cc1nc(C)c(C(=O)OCC(C)C)c(C(=O)N2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@@H](C)C2)n1,C35174173_decoy,CASP3,Decoy,0,-6.89275,-7.49,-0.67,-6.210217394223634
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(S(=O)(=O)c2cccc3cccnc23)[C@H](C)C1,C35175835_decoy,CASP3,Decoy,0,-8.61722,-6.71,-2.63,-6.24155991728959
COc1ccc(C(=O)N2[C@H](C(=O)NCc3ccc4c(c3)OCO4)CS[C@H]2c2cccs2)cc1OC,C35192588_decoy,CASP3,Decoy,0,-7.99293,-6.36,-3.76,-6.8565223843419805
Cc1ccsc1CN(Cc1ccc2c(c1)OCO2)C(=O)CN(CCN1CCOCC1)C(=O)c1ccco1,C35405170_decoy,CASP3,Decoy,0,-8.70022,-6.37,-4.38,-7.291802845566075
O=C(NCCCN1CCOCC1)[C@H]1Cc2cc(C(F)(F)F)ccc2N2CCN(c3cnccn3)C[C@@H]12,C35556134_decoy,CASP3,Decoy,0,-9.74577,-7.43,-1.77,-7.371405060621359
COc1ccc(OC)c([C@@H]2CN(C(=O)c3ccc(F)cc3)C[C@H]2C(=O)NCc2ccc3c(c2)OCO3)c1,C35672140_decoy,CASP3,Decoy,0,-7.80673,-8.24,-1.96,-7.416277335413076
COc1ccc(OC)c([C@H]2CN(C(=O)c3ccc(F)cc3)C[C@H]2C(=O)NCc2ccc3c(c2)OCO3)c1,C35672142_decoy,CASP3,Decoy,0,-6.61941,-7.14,-4.39,-6.150014201309827
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccc3c(c2)OCO3)N(C)C(=O)c2ccc(Cl)cc2)cc1,C36528033_decoy,CASP3,Decoy,0,-8.7006,-8.27,-2.8,-7.49566367892628
CO[C@H]1O[C@H]2CO[C@H](c3ccccc3)O[C@H]2[C@H](OC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1OS(C)(=O)=O,C37246220_decoy,CASP3,Decoy,0,-7.19556,-8.13,-1.32,-8.555256863339332
O=C(c1cnc2ccccc2n1)N1CCO[C@@H](CN(CCN2CCOCC2)C(=O)c2ccccc2F)C1,C34686228_decoy,CASP3,Decoy,0,-9.75623,-7.45,-2.18,-7.87520203387578
COCCn1cc(C(=O)N2CCN(C(=O)Cc3cccc(C)c3)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C38485084_decoy,CASP3,Decoy,0,-8.30348,-6.5,-3.2,-6.860824335032104
CCOc1cccc2sc(N(Cc3ccccn3)C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)nc12,C36691747_decoy,CASP3,Decoy,0,-8.52599,-7.78,-3.1,-8.375513822259819
CCOn1c(C)c(S(=O)(=O)Oc2ccccc2)c2c1-c1nccc(S(=O)(=O)C(C)C)c1C(=O)CC2,C39459535_decoy,CASP3,Decoy,0,-8.89476,-7.85,-2.27,-6.861938470320235
CCOc1ccc(CN(C(=O)c2nc(S(=O)(=O)CC)ncc2Cl)[C@H]2CCS(=O)(=O)C2)cc1,C39909422_decoy,CASP3,Decoy,0,-8.84663,-5.65,-3.96,-6.163386473903618
CCOC(=O)C1CCN(c2c(/C=C3\SC(=S)N(CCOC)C3=O)c(C)c(C#N)c(=O)n2CC)CC1,C39989844_decoy,CASP3,Decoy,0,-8.69167,-6.64,-4.48,-7.406047442598916
CCOC(=O)c1c(NC(=O)c2sc3ncn(Cc4ccncc4)c(=O)c3c2C)sc2c1CCCC2,C41023838_decoy,CASP3,Decoy,0,-9.09258,-7.46,-2.19,-6.592536364593074
Cc1ccn2c(=O)c(Cc3nnc(SCC(=O)Nc4ccccc4C(F)(F)F)n3C)c(C)nc2c1,C41078197_decoy,CASP3,Decoy,0,-7.94517,-8.11,-2.03,-6.503443919480918
CCc1ccccc1-n1nc(C(=O)N2CCN(C(=O)CC3CC3)CC2)cc1-c1cccc(NC(C)=O)c1,C44960898_decoy,CASP3,Decoy,0,-8.62824,-6.71,-1.8,-8.058955949272374
C[C@@H]1CN(c2cc(Cl)nc(SCC(=O)NCc3ccccn3)n2)CCN1C(=O)c1ccccc1F,C00737460_decoy,CASP3,Decoy,0,-10.165,-7.64,-3.78,-10.226034753641386
CC(=O)OC[C@H]1O[C@@H](Oc2ccc(Br)cc2Br)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C00863063_decoy,CASP3,Decoy,0,-7.80414,-6.71,-3.1,-6.781662228195696
[H]/N=C1C(=C/c2ccc(OCCOc3ccccc3Cl)cc2)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C13514025_decoy,CASP3,Decoy,0,-9.08454,-7.71,-0.86,-6.695198234905511
COc1ccc(CCNC(=O)c2cc(-c3ccccc3)nc3c2c(C)nn3[C@@H]2CCS(=O)(=O)C2)cc1,C57310058_decoy,CASP3,Decoy,0,-7.6373,-6.31,-3.89,-5.896596426266007
Cc1ccc(S(=O)(=O)Cn2nnnc2[C@H](C(C)C)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1,C13505404_decoy,CASP3,Decoy,0,-7.33977,-7.58,-2.99,-6.358534029423574
CC(C)(C)OC(=O)NCCC(=O)/N=C1\S[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1C(F)(F)F,C32634657_decoy,CASP3,Decoy,0,-9.84739,-6.41,-2.49,-8.794720617027581
COc1cc(OC)c([C@@H]2[C@H]3C(=O)N(c4ccc([N+](=O)[O-])cc4)C(=O)[C@H]3ON2c2ccccc2)cc1OC,C18066603_decoy,CASP3,Decoy,0,-6.75464,-6.82,-2.32,-6.954243563786998
[H]/N=C1C(=C/c2cc(Br)c(OCCOc3ccccc3C)c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C41078493_decoy,CASP3,Decoy,0,-8.00141,-7.0,-3.22,-5.375692500757481
COc1ccc(CN2COc3ccc4c(c3C2)O/C(=C\c2ccc(OC)c(OC)c2OC)C4=O)cc1OC,C41660222_decoy,CASP3,Decoy,0,-8.64274,-7.85,-2.58,-8.19185267544988
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(C)cc3OC)c(Br)c2)\C(=O)N=C2C=C(C)ON2\1,C20236853_decoy,CASP3,Decoy,0,-7.94837,-6.94,-4.19,-5.972163420788748
CCCn1cc(C(=O)N2CCN(C(C)C)CC2)c(S(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)n1,C67337642_decoy,CASP3,Decoy,0,-8.78473,-6.88,-2.13,-6.017379759940379
Cc1cnc(NC(=O)CSc2nnc3c(n2)[nH]c2ccc(F)cc23)s1,C00886856_decoy,CASP3,Decoy,0,-7.46673,-7.17,-1.49,-6.261354876556844
CNC(=O)NC(=O)CSc1nnc(-c2cccc(Br)c2)o1,C05262654_decoy,CASP3,Decoy,0,-7.7899,-6.49,0.03,-5.032443604767262
CC(C)[C@@](C)(C#N)NC(=O)CN1C(=O)N[C@]2(CCCc3sccc32)C1=O,C05679810_decoy,CASP3,Decoy,0,-8.05456,-7.28,-0.9,-6.236743591312949
CC(C)[C@](C)(C#N)NC(=O)CN1C(=O)N[C@]2(CCCc3sccc32)C1=O,C05679814_decoy,CASP3,Decoy,0,-9.45821,-5.97,-0.7,-6.873512118350945
CC[C@]1(C)NC(=O)N(/N=C/c2cc(Br)c(O)c(OC)c2)C1=O,C03528233_decoy,CASP3,Decoy,0,-7.61875,-5.83,-0.4,-5.530119822082538
C[C@H](Sc1nnc(-c2ccncc2)n1N)C(=O)N1CCc2ccccc2C1,C06786962_decoy,CASP3,Decoy,0,-7.5811,-6.44,-0.19,-5.23266976905669
CC(=O)c1c(C)[nH]c(C(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c1C,C07005730_decoy,CASP3,Decoy,0,-6.44336,-7.83,-1.21,-6.484833492433956
Cc1c(C)c(C)c(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)c1C,C07728708_decoy,CASP3,Decoy,0,-7.0674,-8.24,-2.36,-6.501042552800824
CCNC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc4c(c3)OCO4)nc21,C09103688_decoy,CASP3,Decoy,0,-8.13759,-6.91,-0.86,-6.297371476818166
CC(=O)Nc1ccc(-c2csc(NC(=O)c3cnc(C)cn3)n2)c(F)c1,C10966295_decoy,CASP3,Decoy,0,-8.69163,-6.39,-1.53,-5.907774756793564
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc(-c2cccs2)no1,C12563744_decoy,CASP3,Decoy,0,-10.2826,-7.79,-1.6,-8.984671329728952
NC(=O)C1CCN(C(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)CC1,C13011774_decoy,CASP3,Decoy,0,-8.75075,-8.56,-0.96,-6.76013650510537
NC(=O)C1CCN(C(=O)c2cc(-c3ccco3)n(-c3ccc(Cl)cc3)n2)CC1,C13012838_decoy,CASP3,Decoy,0,-7.08583,-6.86,-2.56,-5.822943607324201
Cc1ccc(-c2nc(C(=O)NNC(=O)Cn3ccccc3=O)cs2)cc1,C14082993_decoy,CASP3,Decoy,0,-7.11786,-6.32,-2.49,-5.324338578824998
[H]/N=C1C(=C\c2ccc(O)c(OC)c2)\C(=O)N=C2Sc3cc(OCC)ccc3N2\1,C16996076_decoy,CASP3,Decoy,0,-7.37454,-6.61,-0.83,-5.639917377414213
Cc1ccnn1-c1ccc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1,C21767734_decoy,CASP3,Decoy,0,-6.63616,-6.49,-1.59,-5.1898190215499485
C[C@@H]1CCC[C@H](C)N1C(=O)CN1C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C1=O,C12681301_decoy,CASP3,Decoy,0,-6.02851,-7.49,-1.38,-4.853208041749835
Cc1noc(CSc2nnc(-c3cccc(Br)c3)n2N)n1,C26496736_decoy,CASP3,Decoy,0,-7.22883,-5.45,-1.88,-5.142687304706337
COc1cccc([C@@H]2[C@@H]3CN(C(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1OC,C16037324_decoy,CASP3,Decoy,0,-7.09169,-7.12,-6.35,-6.089235707897519
NC(=O)Cn1c(=O)nc(-c2cccs2)c2nc(N3CCCCC3)sc21,C32615279_decoy,CASP3,Decoy,0,-9.94646,-4.99,0.31,-7.024765249786609
Nc1ccc2nc(-c3ccccn3)c(CN3CCN(c4ccccn4)CC3)n2c1,C36270381_decoy,CASP3,Decoy,0,-6.60393,-6.75,-1.08,-5.4278473071169655
COC(=O)C1=C(C)NC2=NC(=O)NC(=O)[C@H]2[C@H]1c1ccccc1C(F)(F)F,C39140986_decoy,CASP3,Decoy,0,-6.52859,-6.78,-1.25,-8.296464997188634
CC1=C[C@@H](N2C(=O)C([O-])=C(C(=O)C3=C(C)C=[NH+][C@@H]3C)[C@@H]2c2ccccc2)NO1,C39277060_decoy,CASP3,Decoy,0,-6.99873,-6.97,-1.71,-6.03267256290969
CCCC1=NNN(C2CCN(C(=O)c3ccc(-c4ccn[nH]4)cc3)CC2)C1,C39388216_decoy,CASP3,Decoy,0,-7.50947,-7.12,-1.33,-5.85360019895494
Cc1sc(-c2ccccn2)nc1-c1ccc2c(c1)N(CC(N)=O)C(=O)[C@H](C)O2,C40600647_decoy,CASP3,Decoy,0,-8.87096,-6.78,-1.53,-6.585131424773452
O=C(Nc1cc(Cl)cc(Cl)c1)C(=O)NC1CCN(c2ncccn2)CC1,C41453077_decoy,CASP3,Decoy,0,-8.52695,-5.95,-2.01,-5.310404119369548
Cc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2,C43829283_decoy,CASP3,Decoy,0,-8.75675,-7.01,-1.58,-6.82391902950681
C[C@H](OC(=O)c1[nH]c2ccccc2c1Br)C(=O)N1CCNC1=O,C46767769_decoy,CASP3,Decoy,0,-5.78674,-5.89,-0.47,-4.887147144654315
CC(C)c1cc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c2cnn(C(C)C)c2n1,C56017361_decoy,CASP3,Decoy,0,-6.68216,-5.8,-2.46,-6.002292935583943
COC(=O)c1c(NC(=O)CN2CCNC(=O)C2)sc2c1CC[C@@H](C)C2,C57386120_decoy,CASP3,Decoy,0,-8.2101,-5.81,-1.83,-6.534777443980429
O=C(NCc1ccc(-n2cnc3ccccc32)nc1)c1ccc2[nH]cnc2c1,C58214598_decoy,CASP3,Decoy,0,-7.22966,-6.28,-0.77,-5.072082937623336
Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2ccc(Cl)nc2)c1C,C58382346_decoy,CASP3,Decoy,0,-5.91698,-7.21,-1.42,-6.459646577515595
Cc1nn(C)c2ncc(C(=O)O/N=C(\N)c3ccc(Cl)cc3)c(Cl)c12,C04286738_decoy,CASP3,Decoy,0,-7.72742,-6.26,-1.02,-5.761345181184569
Cc1cc(C(=O)N2CCCC[C@@H]2CC(N)=O)c(C)n1-c1ccc2c(c1)OCCO2,C60291860_decoy,CASP3,Decoy,0,-10.065,-7.91,-2.48,-9.697965429175788
Cc1cc(NC(=O)[C@@H]2CCCN2C(=O)Cc2c[nH]c3ccc(Cl)cc23)no1,C62372072_decoy,CASP3,Decoy,0,-6.34183,-6.22,-1.84,-5.598239574983032
Cc1n[nH]c(C)c1S(=O)(=O)N1CCNC(=O)[C@@H]1c1ccc(C(C)C)cc1,C62607950_decoy,CASP3,Decoy,0,-7.81418,-6.35,-4.62,-6.222516864148206
COc1ccc([C@@H]2C(C#N)=C(N)OC3=NN=C(C(F)(F)F)[C@H]32)cc1OC,C01062030_decoy,CASP3,Decoy,0,-7.18013,-6.98,-0.88,-6.653934653886483
COc1cc([C@@H]2CC(O)=Nc3c2ncn3-c2ccc(F)cc2)cc(OC)c1O,C36355010_decoy,CASP3,Decoy,0,-8.13364,-6.09,-0.82,-6.214823297201237
CC1CCN([C@@H]2C=CC(=O)N(CC(=O)NC3=C[C@H]4N=CC=C4C=C3)N2)CC1,C64435945_decoy,CASP3,Decoy,0,-7.38549,-7.21,-5.2,-4.861597513478211
O=C(Nc1ccccc1-n1cncn1)c1[nH]nc(C2CC2)c1Br,C65106554_decoy,CASP3,Decoy,0,-7.193,-5.87,-3.15,-5.849805218950023
O=C(Nc1ccccc1F)N[C@@H]1CCCN([C@@H]2C=C(c3ccncc3)N=N2)C1,C65257553_decoy,CASP3,Decoy,0,-7.09206,-7.22,-1.31,-6.253161762347323
COc1cc([C@H]2CC(=O)Nc3c2cnn3-c2ccc(F)cc2)cc(OC)c1O,C65331459_decoy,CASP3,Decoy,0,-8.39378,-8.62,-1.3,-12.721025279634365
CC(C)(C)n1cc(NS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)cn1,C65833846_decoy,CASP3,Decoy,0,-7.25833,-6.88,-1.18,-5.185324701120958
NS(=O)(=O)c1ccc(S(=O)(=O)Oc2ccc3ncccc3c2)c(F)c1,C65886432_decoy,CASP3,Decoy,0,-8.90291,-8.46,-0.56,-12.783370046825388
Cc1ccsc1C(=O)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C,C66557324_decoy,CASP3,Decoy,0,-7.68682,-5.34,-2.61,-5.679405265111298
CN(C)C(=O)C(C)(C)NC(=O)N1CCC(NC(=O)CC2CCCC2)CC1,C66978800_decoy,CASP3,Decoy,0,-6.86453,-6.31,-2.62,-5.194862369605056
CC1=C(C(=O)Nc2cc(C)on2)[C@@H](c2cscn2)NC(=S)N1C1CC1,C67029520_decoy,CASP3,Decoy,0,-7.10922,-4.99,-0.59,-5.6898595879526095
Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)CC(F)(F)F)CC2)c1,C67103155_decoy,CASP3,Decoy,0,-6.44472,-5.91,-1.52,-5.259080225738786
Cc1cc([C@@H](C)NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)c(C)o1,C67432990_decoy,CASP3,Decoy,0,-7.46641,-7.02,-1.16,-6.895844364878154
Cc1nn(C)c2ncc(NC(=O)C(=O)N[C@@H](C)c3ccc(F)c(Cl)c3)cc12,C67433145_decoy,CASP3,Decoy,0,-7.06992,-6.7,-0.62,-4.745271912798291
CCCC[C@H](NC(=O)CCc1c(C)c2ccc(O)c(C)c2oc1=O)C(=O)[O-],C02104775_decoy,CASP3,Decoy,0,-6.78271,-7.07,-0.62,-7.162579183462005
CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(=O)[O-])cc2)cc1,C05718020_decoy,CASP3,Decoy,0,-7.20534,-5.8,-0.55,-5.506041195635632
CC1(C)CC(=O)c2c(O)cc(OCC(=O)NCCCCCC(=O)[O-])cc2O1,C12296891_decoy,CASP3,Decoy,0,-7.95099,-5.68,-0.85,-6.361214352956853
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)NCC1CCCCC1,C13045382_decoy,CASP3,Decoy,0,-8.09052,-6.83,-1.0,-7.572852571062077
O=C(CSc1nnc(NCc2ccco2)s1)Nc1ccccc1C(=O)[O-],C13220786_decoy,CASP3,Decoy,0,-7.88121,-7.04,-2.01,-5.70941569491642
O=C(CSc1nnc(NCc2ccco2)s1)Nc1ccc(C(=O)[O-])cc1,C13220787_decoy,CASP3,Decoy,0,-8.47898,-6.84,-1.57,-6.828359070858644
CCNC(=O)CNC(=O)CSc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-],C13235432_decoy,CASP3,Decoy,0,-7.70176,-5.96,-1.03,-6.408167697411982
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CC2(C(=O)[O-])CCCC2)cc1,C13255399_decoy,CASP3,Decoy,0,-6.11716,-7.58,-2.66,-8.266166959049423
CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])cc1OC,C13255597_decoy,CASP3,Decoy,0,-8.36582,-6.29,-1.44,-5.758024949239428
Cc1cccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NC3CC3)n2CCC(=O)[O-])c1,C13270706_decoy,CASP3,Decoy,0,-7.41933,-6.27,-0.98,-8.932332649499115
O=C([O-])CC/C(=N/NC(=O)CNC(=O)/C=C/c1ccccc1)c1ccccc1,C15952515_decoy,CASP3,Decoy,0,-7.27282,-8.06,-1.39,-6.634816956297184
Cc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)NCCC(=O)[O-])cc1,C20035218_decoy,CASP3,Decoy,0,-6.45396,-7.55,-4.48,-7.458242675886176
COC(=O)c1ccc(NC(=O)CSc2nc(C)c(CCO)c([O-])n2)cc1,C32522938_decoy,CASP3,Decoy,0,-7.74418,-7.03,-0.96,-10.454177053174572
CCOC(=O)c1sc(Nc2ccc(NC(=O)/C=C\C(=O)[O-])cc2)nc1C,C32573519_decoy,CASP3,Decoy,0,-7.57846,-6.55,-3.32,-7.705431622041543
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1cccc(C(=O)NCC(F)(F)F)c1,C32899945_decoy,CASP3,Decoy,0,-6.07967,-5.96,-1.4,-6.274926293791126
CCOCCCNC(=O)Cn1c([O-])nc2c(-c3ccc(F)cc3)c[nH]c2c1=O,C33038048_decoy,CASP3,Decoy,0,-7.03244,-5.38,-2.1,-5.3159417144448415
CCN(CC)CCOC(=O)c1ccc(/N=C/c2c([O-])[nH]c(=O)[nH]c2=O)cc1,C01840335_decoy,CASP3,Decoy,0,-6.86657,-6.07,-1.26,-5.998206629027024
CC(C)(C)OC(=O)NCCCSC[C@H](NC(=O)OC(C)(C)C)C(=O)[O-],C38528820_decoy,CASP3,Decoy,0,-6.82765,-5.9,-1.29,-6.855506001146238
CCOc1ccc(/C(=C\c2ccc(OC)c(OCC)c2N)C(=O)[O-])cc1OC,C39289797_decoy,CASP3,Decoy,0,-7.24077,-5.54,-0.35,-9.47433460370206
CCOc1cc(/C(=C\c2ccc(OCC)c(OC)c2N)C(=O)[O-])ccc1OC,C39289798_decoy,CASP3,Decoy,0,-7.18794,-5.89,-1.32,-4.641821499105157
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(C)o2)[C@@H]1c1ccc(OCC(N)=O)cc1,C40025337_decoy,CASP3,Decoy,0,-8.49762,-6.55,-2.98,-7.33246907965933
CCCc1nnc([S-])n1CC(=O)NCCNc1nc2ccccc2s1,C40087225_decoy,CASP3,Decoy,0,-8.87539,-6.68,-2.19,-6.87225224198184
CCCCNc1nccc(-c2cc(C(=O)NCCCc3cccnc3)c([O-])nn2)n1,C33969157_decoy,CASP3,Decoy,0,-9.0842,-7.88,-1.31,-8.421040624152507
O=C([O-])CCCCCNC(=O)CN1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S,C15036646_decoy,CASP3,Decoy,0,-6.83891,-7.1,-1.89,-6.727721214571692
CCCCCCN/C([O-])=C(\C#N)C(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1,C49226999_decoy,CASP3,Decoy,0,-7.13305,-6.65,-2.05,-5.851527726687064
CCCNC(=O)NCCc1nc2cc(C(=O)[O-])ccc2n1C[C@@H]1CCCO1,C06690367_decoy,CASP3,Decoy,0,-8.29665,-5.88,-2.0,-6.414141281539047
CCc1ccc(N/C([O-])=C(\C#N)C(=O)CCCNC(=O)OC(C)(C)C)cc1,C50837600_decoy,CASP3,Decoy,0,-8.53711,-5.73,-2.25,-6.159287057314709
CCCCN/C([O-])=C(\C#N)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1,C51006984_decoy,CASP3,Decoy,0,-5.50439,-7.51,-1.36,-6.083409291090822
CC[C@@H](C)c1ccc(N/C([O-])=C(\C#N)C(=O)CCCNc2ncccn2)cc1,C51030750_decoy,CASP3,Decoy,0,-7.62487,-7.36,-0.87,-6.944538469346196
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2sc([S-])nc2C)cc1,C18071849_decoy,CASP3,Decoy,0,-10.8279,-7.19,-4.35,-10.5652234128774
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2sc([S-])nc2C)cc1,C18071850_decoy,CASP3,Decoy,0,-11.1543,-7.14,-1.47,-12.304686724131848
CCCS(=O)(=O)[N-]c1ccccc1C(=O)NCc1ccc(-c2ccn[nH]2)cc1,C58276320_decoy,CASP3,Decoy,0,-8.18407,-5.94,-1.0,-5.962737934869461
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(/N=C/c2ccc(O)cc2)cc1,C59466561_decoy,CASP3,Decoy,0,-7.96366,-5.5,-1.41,-5.736702151346271
CCS(=O)(=O)[N-]c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1,C59885334_decoy,CASP3,Decoy,0,-7.26806,-5.76,-2.93,-5.342660949360127
Cc1ccc(OCCNC(=O)NCc2ccccc2[N-]S(C)(=O)=O)cc1,C47720338_decoy,CASP3,Decoy,0,-7.83425,-6.84,-2.01,-5.974552418620895
COc1ccc(CCNC(=O)CSc2nc([O-])c3c[nH]nc3n2)cc1OC,C13543781_decoy,CASP3,Decoy,0,-7.96668,-6.8,-1.4,-7.748490549781036
CS(=O)(=O)[N-]c1ccc(CCCNS(=O)(=O)NC2CCCC2)cc1,C62225471_decoy,CASP3,Decoy,0,-8.01068,-7.35,-0.45,-6.975303865752071
C[C@H](CS(=O)(=O)[N-]c1cccc(F)c1)C(=O)NCC(=O)NC1CCCCC1,C62433262_decoy,CASP3,Decoy,0,-7.81431,-7.17,-1.51,-6.604319135494316
COc1ccc(CCNC(=O)c2cc([N-]S(C)(=O)=O)ccc2O)c(OC)c1,C64054859_decoy,CASP3,Decoy,0,-9.39144,-6.42,-1.35,-7.708770170768813
COc1ccc(CCCC/C([O-])=N/S(=O)(=O)c2ccc(C(N)=O)cc2)cc1,C66002622_decoy,CASP3,Decoy,0,-8.45338,-6.99,-1.62,-5.961628243343395
COc1ccc(CCCC/C([O-])=N/S(=O)(=O)c2cc(C(N)=O)n(C)c2)cc1,C66003191_decoy,CASP3,Decoy,0,-7.76935,-6.26,-1.98,-7.650191351023561
CCCc1nnc([S-])n1CC(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1,C66456045_decoy,CASP3,Decoy,0,-8.90957,-7.15,-1.7,-8.059656157284321
CCCCc1ccc(N/C([O-])=C(\C#N)C(=O)[C@@H](C)NC(=O)C2CCOCC2)cc1,C67001641_decoy,CASP3,Decoy,0,-7.36546,-7.58,-0.67,-5.922804540115122
C=CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OCCC(=O)[O-])cc1,C67028516_decoy,CASP3,Decoy,0,-7.27,-5.77,-1.27,-5.988811112863942
C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OCCC(=O)[O-])cc1,C67028517_decoy,CASP3,Decoy,0,-9.17866,-4.56,-1.95,-6.50153951273196
CC(=O)Nc1ccc([N-]S(C)(=O)=O)c(C(=O)N[C@H](C)CCCC(C)C)c1,C67043334_decoy,CASP3,Decoy,0,-8.14516,-5.24,-4.23,-5.471061121015705
CCCCCC[C@@H](C)NC(=O)c1cc(NC(C)=O)ccc1[N-]S(C)(=O)=O,C67043475_decoy,CASP3,Decoy,0,-8.03009,-5.88,-2.04,-6.218984828194109
CCCCCC[C@H](C)NC(=O)c1cc(NC(C)=O)ccc1[N-]S(C)(=O)=O,C67043476_decoy,CASP3,Decoy,0,-8.3785,-5.07,-0.69,-6.949077433101405
CCCc1nnc([S-])n1CC(=O)N[C@@H](C)c1cccc(S(=O)(=O)NC)c1,C67190340_decoy,CASP3,Decoy,0,-10.1576,-7.04,-0.86,-8.13791540857842
COCCNC(=O)CNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-],C67511155_decoy,CASP3,Decoy,0,-7.11803,-6.46,-2.15,-6.523878309763337
COc1cc([C@H]2NC(=O)NC3=C2C(=O)N(C)C3)cc(OC)c1OC,C04854787_decoy,CASP3,Decoy,0,-6.1693,-5.68,-1.37,-5.144155080592094
CNC(=O)NC(=O)CSc1nnc(-c2ccoc2C)n1C,C04947788_decoy,CASP3,Decoy,0,-5.85907,-6.36,-0.77,-5.471331661360915
Cc1cc(C)n2c(SCC(=O)NC(=O)NC(C)(C)C)nnc2n1,C03288231_decoy,CASP3,Decoy,0,-6.78631,-7.23,-0.71,-5.496371924437917
Cn1ncc2c(NNS(=O)(=O)c3ccc(Cl)cc3)ncnc21,C00116988_decoy,CASP3,Decoy,0,-7.00408,-5.71,0.45,-5.430992065798143
CNC(=O)c1nn(C)cc1NC(=O)c1noc2c1C[C@@H](C)CC2,C02803871_decoy,CASP3,Decoy,0,-7.44471,-5.57,-2.98,-5.110356561544208
CCn1nnc2cc(C(=O)N3C[C@H](C(N)=O)Oc4ccccc43)ccc21,C08339349_decoy,CASP3,Decoy,0,-7.07829,-7.6,-0.07,-7.372345357147724
C1=C[C@@H]2NN=C(C3CCN(c4ncnc5[nH]ncc45)CC3)N2C=C1,C11856485_decoy,CASP3,Decoy,0,-7.4999,-6.35,-0.37,-5.4173141177401245
C[C@@H](Sc1nnnn1C)C(=O)C(C#N)=C1Nc2ccccc2N1,C13021835_decoy,CASP3,Decoy,0,-4.65201,-6.69,-0.74,-5.417805358777673
COc1cc([C@@H]2ON=C(C(N)=O)[C@H]2C)c(OC)c2c1OCO2,C15081604_decoy,CASP3,Decoy,0,-7.20173,-5.64,-0.87,-6.320018386846863
Cc1nn(CC(=O)NC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c(=O)c(C#N)c1C,C24764335_decoy,CASP3,Decoy,0,-7.14391,-6.9,-2.29,-6.390634348296439
Cc1n[nH]c(=O)c2c(NC(=O)CN3C[C@H](C)OC[C@@H]3C)oc(C)c12,C27646429_decoy,CASP3,Decoy,0,-7.15669,-6.57,-1.09,-6.506609695673294
Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccccc1[N+](=O)[O-],C31662143_decoy,CASP3,Decoy,0,-5.95812,-5.86,-2.2,-4.040657007392348
Cc1sc2nc(Cn3nnn(-c4cccs4)c3=O)nc(N)c2c1C,C31793445_decoy,CASP3,Decoy,0,-6.84879,-5.48,-0.79,-3.9926322630509854
CCNC(=O)NC(=O)[C@@H](C)Sc1nnc2cc(C)nc(C)n12,C32922568_decoy,CASP3,Decoy,0,-6.39632,-6.78,-0.08,-5.847167413133924
O=C(Nc1ccc(Br)cc1[N+](=O)[O-])c1nc[nH]n1,C05670531_decoy,CASP3,Decoy,0,-5.80083,-5.1,-0.11,-4.921661951717668
CCO[C@H]1CC(=O)c2c(c3ncc(O)cc3c(=O)n2OCC)N1,C39451925_decoy,CASP3,Decoy,0,-7.83792,-7.39,-0.8,-11.272264405816154
CCc1nnc(NC(=O)NC2CCN(C(=O)c3ccoc3)CC2)s1,C43344776_decoy,CASP3,Decoy,0,-7.18511,-5.32,-1.87,-5.151002066594629
COC(=O)CNC(=O)N1CCc2[nH]cnc2[C@@H]1c1ccccn1,C44577627_decoy,CASP3,Decoy,0,-6.39701,-5.0,-0.96,-6.344672870367114
Cc1c(C(=O)NCc2cccnc2-n2cncn2)[nH]c2c1C(=O)CCC2,C47122658_decoy,CASP3,Decoy,0,-7.19914,-6.38,-1.96,-5.142471152799507
Cc1noc(C)c1S(=O)(=O)NC[C@H]1Oc2ccccc2NC1=O,C49739235_decoy,CASP3,Decoy,0,-5.59329,-6.91,-1.48,-8.27802872031762
COC(=O)N1CCC(NC(=O)N2CCC[C@H](C(=O)NC3CC3)C2)CC1,C51712730_decoy,CASP3,Decoy,0,-7.11587,-7.48,-1.65,-6.556427127690971
CC(C)c1cc(S(N)(=O)=O)n(-c2ccc([N+](=O)[O-])cc2)n1,C52306659_decoy,CASP3,Decoy,0,-6.57897,-5.53,0.6,-5.339572391717366
N#C[C@@]12C(N)=NC3(OCCO3)[C@]1(C#N)[C@@H]2c1ccc2c(c1)OCO2,C55242914_decoy,CASP3,Decoy,0,-6.18264,-6.93,-0.85,-5.251165605643593
COC(=O)N(C)c1ccc(NC(=O)N[C@H]2CCCc3c2cnn3C)cc1,C56662285_decoy,CASP3,Decoy,0,-7.70066,-6.24,-1.23,-5.527118476356807
Cc1cccc2c(=O)n(CC(=O)NNC(=O)c3cccn3C)cnc12,C57815048_decoy,CASP3,Decoy,0,-5.88715,-7.21,-1.96,-5.847339958317098
CC(C)C(=O)N1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1,C58148171_decoy,CASP3,Decoy,0,-4.95455,-5.75,-1.17,-4.635785859466125
Cc1ccn2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)nc2c1,C53625864_decoy,CASP3,Decoy,0,-7.27009,-5.99,-1.59,-5.3370558869746105
Cc1cc(NC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)no1,C59771989_decoy,CASP3,Decoy,0,-7.17786,-7.21,-1.3,-5.3240476994470205
Cc1nc2nc(N)nn2c(C)c1CCC(=O)N1C[C@@H](C)O[C@@H](C)C1,C17326804_decoy,CASP3,Decoy,0,-7.14664,-5.65,-1.42,-5.859275970854684
C[NH+]1CCN(N/C=C2/C(=O)N(c3ccccc3F)C(=O)N=C2[O-])CC1,C20291128_decoy,CASP3,Decoy,0,-7.19619,-6.42,-1.17,-5.656936071077436
C[C@@H]1CN(S(=O)(=O)c2ccc(N)cc2[N+](=O)[O-])CCCO1,C61939378_decoy,CASP3,Decoy,0,-5.75684,-5.16,-0.66,-4.408423044457158
Cc1ccc(C)n1-c1c(C(=O)NNc2ncccn2)cnn1C,C63739917_decoy,CASP3,Decoy,0,-6.24694,-6.65,-1.15,-6.80913754390631
CC1=C2[C@@H](NC(=O)C[C@@H]2c2ccccc2F)N(C2=NC=NC3=NC=N[C@@H]32)N1,C38587415_decoy,CASP3,Decoy,0,-8.06111,-6.21,-1.31,-5.514608901179735
CC1=C2C(=O)CCCC2=N[C@@H]1C(=O)NN1C(=O)NC2(CCCCC2)C1=O,C63908872_decoy,CASP3,Decoy,0,-6.2862,-7.35,-1.72,-4.50507832975084
CC1=NO[C@@H](c2ccc(NC(=O)[C@@H]3C=C(c4ccco4)N=N3)cc2)N1,C64422608_decoy,CASP3,Decoy,0,-6.56833,-6.42,-0.45,-4.860227518723693
O=C1NC[C@H](c2ccc(Cl)cc2)CC2=N[C@H](C3N=NN=N3)N[C@H]12,C65371119_decoy,CASP3,Decoy,0,-6.97279,-6.88,-0.84,-5.446285216612234
O=C(Nc1ccc(-n2cccn2)nc1)N[C@@H]1CCS(=O)(=O)C1,C48368829_decoy,CASP3,Decoy,0,-7.02188,-4.75,-1.1,-4.7955102529283975
Cc1cc(C)c2c(c1)=C[C@@H]([C@@H]1CC(=O)NC3=NN=C(C(=O)[O-])[C@H]31)C(=O)[NH+]=2,C65424356_decoy,CASP3,Decoy,0,-6.79604,-6.75,-1.74,-5.116074903813469
Cc1n[nH]c(C(=O)Nc2cc(-n3cnnn3)ccc2F)c1Br,C65787489_decoy,CASP3,Decoy,0,-6.40893,-7.94,-2.38,-8.389434025287704
Cc1cc([C@@H]2CCCN2C(=O)c2ccc(-n3ncc(C#N)c3N)cc2)on1,C66240610_decoy,CASP3,Decoy,0,-6.47297,-6.37,-2.32,-5.846509411075544
COC(=O)N1CCC(NC(=O)NCc2cn3ccsc3n2)CC1,C66362784_decoy,CASP3,Decoy,0,-8.07264,-4.96,-4.31,-6.455119758387129
Cc1cc(-c2cc(C(=O)Nc3cc[nH]n3)c3c(C)noc3n2)c(C)o1,C66457144_decoy,CASP3,Decoy,0,-6.75673,-6.58,-1.77,-5.837206560049323
Cc1ccsc1C(=O)NNC(=O)c1sccc1-n1cnnn1,C66557560_decoy,CASP3,Decoy,0,-7.68532,-6.03,-1.19,-4.719286751583568
CNC(=O)NC(C)(C)C(=O)N1CCN(c2nc3cccnc3s2)CC1,C67050412_decoy,CASP3,Decoy,0,-7.24456,-6.79,-1.18,-8.035366486432807
Cc1noc([C@@H]2CCCN(C(=O)NNC(=O)CC3CCCCC3)C2)n1,C67103537_decoy,CASP3,Decoy,0,-8.62231,-6.03,-4.09,-6.552806088316483
N#Cc1cnn(C(=O)Cc2csc(-c3cnccn3)n2)c1N,C67156989_decoy,CASP3,Decoy,0,-6.13722,-6.4,-0.97,-5.605870680827003
COc1ccc([C@H]2CC(O)=Nc3nc(C)[nH]c(=O)c32)c(OC)c1OC,C08971330_decoy,CASP3,Decoy,0,-6.30272,-5.17,-0.83,-4.860134816355021
Cc1nn(-c2ncnc3[nH]cnc23)c2c1[C@@H](c1ccccc1)CC(O)=N2,C20745686_decoy,CASP3,Decoy,0,-7.25217,-6.02,-0.47,-5.133778172316982
C[C@H](NC(=O)Nc1ccc(-n2cccn2)nc1)C(=O)N1CCSCC1,C67543433_decoy,CASP3,Decoy,0,-7.04515,-7.46,-0.69,-8.374732637832683
O=C(Nc1nnc(C(F)F)s1)NC1CCN(c2ncccn2)CC1,C67586588_decoy,CASP3,Decoy,0,-6.65817,-6.23,-1.02,-5.537474941068076
COc1ccc2c(c1OC)[C@]13CC[NH+](C)[C@H](C2)[C@@]12C=CC(=O)[C@@H]3c1c(OC)ccc(OC)c12,C01699864_decoy,CASP3,Decoy,0,-6.99109,-6.37,-0.66,-6.486402640509215
C[NH+](C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2,C05414975_decoy,CASP3,Decoy,0,-6.89214,-5.93,-2.78,-5.5217095031963055
Cc1cc(C)c2sc(N(CC[NH+](C)C)C(=O)c3ccccc3S(C)(=O)=O)nc2c1,C09386656_decoy,CASP3,Decoy,0,-8.52341,-6.0,-2.51,-6.621403267516051
CCS(=O)(=O)c1ccc(C(=O)N(CC[NH+](C)C)c2nc3c(C)cccc3s2)cc1,C09707951_decoy,CASP3,Decoy,0,-7.57503,-5.77,-2.78,-5.7914628116917015
COc1cc2c(cc1OC)[C@@H](c1ccccc1)[NH+](Cc1cc(=O)n3ccsc3n1)CC2,C09730066_decoy,CASP3,Decoy,0,-7.64084,-5.94,-4.43,-6.005874527287147
Cc1ccc2c(CSc3nnc(C[NH+]4CCCC4)n3-c3ccccc3)cc(=O)oc2c1,C09872856_decoy,CASP3,Decoy,0,-8.46885,-7.67,-0.67,-7.042163613444338
CSc1ccc2nc(N(CC[NH+](C)C)C(=O)c3cccc(S(C)(=O)=O)c3)sc2c1,C10816571_decoy,CASP3,Decoy,0,-9.10352,-6.99,-1.25,-6.877866567610201
CSc1cccc(C(=O)N(CC[NH+](C)C)c2nc3ccc(S(C)(=O)=O)cc3s2)c1,C10818421_decoy,CASP3,Decoy,0,-6.78541,-6.14,-3.29,-4.731873413808124
O=C(c1ccc2c(c1)OCO2)N1CCOc2ccc(C[NH+]3CCc4sccc4C3)cc2C1,C11998164_decoy,CASP3,Decoy,0,-8.99434,-6.43,-3.76,-6.130361625709409
COc1cc(C[NH+]2CCC[C@@H](c3nc(C)ncc3-c3ccc(F)cc3)C2)cc2c1OCO2,C12124052_decoy,CASP3,Decoy,0,-7.81485,-6.26,-1.13,-7.000164756472296
Clc1ccc(-n2cccc2C[NH+]2CCc3nnc(CCc4ccccc4)n3CC2)nc1,C12130266_decoy,CASP3,Decoy,0,-8.16245,-7.38,-1.62,-6.340420464257643
C[NH+](Cc1ccc2ccccc2n1)Cc1cnc(S(C)(=O)=O)n1Cc1ccccc1F,C12297203_decoy,CASP3,Decoy,0,-7.54211,-6.44,-1.42,-6.24264892147261
COc1cc2c(cc1OC)[C@H](C)[NH+](C[C@H]1C(=O)O[C@@]34[C@@H](CC[C@@]5(C)O[C@@H]35)[C@H](C)CC[C@@H]14)CC2,C12866856_decoy,CASP3,Decoy,0,-8.40832,-6.92,-1.78,-6.183624797535827
CCn1c(SC)nnc1C1CC[NH+](CC(=O)N(c2ccccc2)c2ccccc2)CC1,C13565093_decoy,CASP3,Decoy,0,-7.6695,-6.55,-3.99,-6.396419635269155
C[NH+](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)Cc1cnn(-c2ccccc2)c1,C14095886_decoy,CASP3,Decoy,0,-8.58583,-7.43,-1.88,-6.271481263237847
Cc1ccc2c(C[NH+]3CCC(C(=O)c4ccc5c(c4)OCCO5)CC3)cc(=O)oc2c1C,C14328547_decoy,CASP3,Decoy,0,-7.8994,-8.21,-1.27,-6.824021412523871
CCn1nc(C(=O)N2CCN(c3ccccc3)CC2)c2c1CC[NH+](C[C@@H]1CC=CCC1)C2,C14530869_decoy,CASP3,Decoy,0,-7.88852,-7.56,-2.01,-6.824452163745466
C[C@H](c1nccs1)N1C(=O)c2cccc(N3CC[NH+](C/C=C/c4ccccc4)CC3)c2C1=O,C14997777_decoy,CASP3,Decoy,0,-7.31451,-7.1,-2.36,-6.03376994845808
COc1ccccc1CN1C[C@@H]2C[C@@H](c3cccn3-c3nccs3)[NH+]3CCC[C@@]23C1=O,C20205331_decoy,CASP3,Decoy,0,-8.29364,-6.39,-4.42,-6.313259966419379
CCN1CCN(C2CC[NH+](Cc3nc(C4(c5ccc(C)cc5)CCCC4)no3)CC2)CC1,C20232993_decoy,CASP3,Decoy,0,-9.07134,-7.56,-2.91,-6.680593814231192
CCOc1ccc(N2C(=O)C[C@@H]([NH+]3CCN(Cc4ccc(Br)s4)CC3)C2=O)cc1,C22916568_decoy,CASP3,Decoy,0,-10.121,-6.24,-2.19,-6.425284679607877
C[C@@H](c1nnc(SCc2nccn2C(F)F)n1-c1ccc(F)cc1)[NH+]1CCCCC1,C25075408_decoy,CASP3,Decoy,0,-7.80098,-5.96,-2.17,-6.535404411683523
C=C(C)C[NH+]1CCN(C(=O)c2cc3cc(Br)cc(OCC)c3oc2=O)CC1,C28051484_decoy,CASP3,Decoy,0,-7.41444,-5.57,-1.53,-5.038778978848656
C[C@@H](c1nnc(SCC(=O)N(C)C2CCCCC2)n1-c1ccc(Cl)cc1)[NH+](C)C,C22620698_decoy,CASP3,Decoy,0,-7.08133,-7.18,-6.26,-5.707551897866138
Cc1cccc(-n2nc(C)c(C(=O)N3CC[NH+](C4CCCCC4)CC3)c2-n2cccc2)c1,C20979182_decoy,CASP3,Decoy,0,-7.82744,-6.55,-1.77,-5.728335782973059
CCC[NH+]1CCN(C(=O)c2ccc(-c3nc4ccccc4n(CC(C)C)c3=O)cc2)CC1,C33298549_decoy,CASP3,Decoy,0,-7.10584,-7.23,-2.1,-5.706183079755598
O=C(c1ccc(-c2nccnc2N2CCCCC2)cc1)N1CC[NH+](C2CCCCC2)CC1,C33313142_decoy,CASP3,Decoy,0,-8.36159,-6.75,-2.44,-5.909186723353829
CCSc1nc(N2CC[NH+](CC(=O)N3CCCC3)CC2)c2c(CC)c(C)sc2n1,C34760988_decoy,CASP3,Decoy,0,-10.0042,-6.5,-0.37,-7.176711148425009
CCc1c(C)sc2nc(SCC(C)C)nc(N3CC[NH+](CC(=O)N(C)C)CC3)c12,C34761494_decoy,CASP3,Decoy,0,-10.1692,-5.79,-1.32,-7.421097335053431
CCc1c(C)sc2nc(SCC(=O)N3CCCC3)nc(N3CC[NH+](CC)CC3)c12,C34762428_decoy,CASP3,Decoy,0,-8.65224,-6.58,-1.36,-6.786996372590566
Cc1cc(C)c2nc(N(CC[NH+](C)C)C(=O)c3cnn(-c4ccccc4)c3C)sc2c1,C36642751_decoy,CASP3,Decoy,0,-8.28848,-6.55,-4.59,-7.438014928225569
COc1cc(/C=C/C(=O)N2CC[NH+]([C@@H]3CCc4ccccc4C3)CC2)cc(OC)c1OC,C39200584_decoy,CASP3,Decoy,0,-7.36769,-6.37,-4.11,-5.655332303330285
O=C([C@H]1N=NC2=C1CCC2)N(CC1CC[NH+](Cc2ccccc2F)CC1)C[C@@H]1CCCO1,C39406201_decoy,CASP3,Decoy,0,-8.6778,-6.36,-0.96,-6.611428929148199
O=C([C@@H]1C=C(C2CC2)N=N1)N1CCC[C@@H]([NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)C1,C39552396_decoy,CASP3,Decoy,0,-7.59565,-5.94,-1.62,-5.360500070502916
CC[NH+](CC)Cc1nc(SCC2=NC(=O)[C@@H]3SC=CC3=N2)c2c(C)c(C)sc2n1,C39735438_decoy,CASP3,Decoy,0,-10.1369,-6.72,-2.1,-7.985246312820233
COc1cc2c(cc1OC)[C@@H]([C@H]1C=c3cc(C)c(C)cc3=[NH+]C1=O)N(C(=O)C(C)C)CC2,C40010484_decoy,CASP3,Decoy,0,-7.56754,-5.95,-1.64,-6.559588605218873
COc1cc2c(cc1OC)[C@@H]([C@@H]1C=c3ccc(C)cc3=[NH+]C1=O)N(C(=O)C(C)(C)C)CC2,C40010516_decoy,CASP3,Decoy,0,-8.05432,-7.67,-3.24,-5.639752674863811
CCc1ccc2c(c1)=C[C@@H]([C@@H]1c3cc(OC)c(OC)cc3CCN1C(=O)C1CC1)C(=O)[NH+]=2,C40010585_decoy,CASP3,Decoy,0,-7.19693,-7.02,-1.89,-5.426402941628553
COc1cc2c(cc1OC)[C@@H]([C@H]1C=c3ccc(C)c(C)c3=[NH+]C1=O)N(C(=O)C1CC1)CC2,C40010593_decoy,CASP3,Decoy,0,-7.76413,-6.41,-2.26,-4.57307067201831
Cc1cccn2c(=O)cc(CN(C)Cc3cn(-c4ccccc4)nc3-c3ccccc3)[nH+]c12,C32547960_decoy,CASP3,Decoy,0,-7.68452,-8.04,-4.22,-6.163837350184958
Cc1nn(Cc2ccccc2Cl)c(C)c1CN(C)Cc1cc(=O)n2cccc(C)c2[nH+]1,C32543427_decoy,CASP3,Decoy,0,-8.25459,-6.29,-5.31,-6.35247354267801
Cc1cc(C(=O)N2CC=C(C3=c4ccccc4=[NH+]C3)CC2)cc(S(=O)(=O)N(C)C)c1C,C39795880_decoy,CASP3,Decoy,0,-7.03044,-8.55,-1.22,-6.8335865304770165
COc1ccc2c(c1)=C1CCN([C@@H]3CC(=O)N(c4ccc(Cl)cc4Cl)C3=O)C[C@@H]1[NH+]=2,C63340012_decoy,CASP3,Decoy,0,-7.58984,-6.44,-3.65,-5.940377720313973
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3C=C4C(=O)[NH+]=c5ccc(C)cc5=C4S3)CC2)cc1,C63494323_decoy,CASP3,Decoy,0,-8.2497,-7.16,-1.07,-6.106759070966215
COc1ccc2cc(C(=O)N3CCC4=c5ccccc5=[NH+][C@@H]4[C@H]3c3ccccn3)n(C)c2c1,C64006669_decoy,CASP3,Decoy,0,-8.63453,-6.85,-3.02,-5.9018143259181
O=C(c1cccc(Cn2cccn2)c1)N1CCC2=c3ccccc3=[NH+][C@H]2[C@H]1c1ccccn1,C64093159_decoy,CASP3,Decoy,0,-6.29615,-7.95,-1.12,-5.769644822816767
COc1cccc([C@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2Cc2cccn2-c2ncccn2)c1,C64137163_decoy,CASP3,Decoy,0,-7.39023,-6.56,-1.05,-5.806107739766402
O=C(C1CCN(S(=O)(=O)[C@@H]2CC=CS2)CC1)N1CC=C(C2=c3ccccc3=[NH+]C2)CC1,C64182178_decoy,CASP3,Decoy,0,-9.99417,-6.4,-0.55,-5.805682773846422
O=C(CCCC1=c2ccccc2=[NH+]C1)N1CCN(S(=O)(=O)C2=CC[C@H](Cl)S2)CC1,C64213439_decoy,CASP3,Decoy,0,-8.17792,-7.73,-1.75,-6.954651504749375
O=C(CCCC1=c2ccccc2=[NH+]C1)N1CCN(S(=O)(=O)C2=CC[C@@H](Cl)S2)CC1,C64213440_decoy,CASP3,Decoy,0,-8.3625,-6.6,-1.66,-8.63117190241615
COc1cc(C[NH+](C)Cn2nc3c(Cl)cc(Cl)cn3c2=S)ccc1OC(F)F,C03387703_decoy,CASP3,Decoy,0,-6.41975,-5.73,-1.9,-4.69628477866203
COc1cccc2cc(C(=O)N(CCC[NH+](C)C)c3nc4c(F)cc(F)cc4s3)oc12,C08960065_decoy,CASP3,Decoy,0,-7.66181,-6.39,-3.03,-5.4321653360981
CCS(=O)(=O)c1cccc(C(=O)N(CC[NH+](C)C)c2nc3ccc(Cl)cc3s2)c1,C09385302_decoy,CASP3,Decoy,0,-8.61894,-5.53,-0.74,-6.941939257394434
Cc1ccc2sc(N(CCC[NH+](C)C)C(=O)c3ccccc3S(C)(=O)=O)nc2c1C,C09387576_decoy,CASP3,Decoy,0,-7.96482,-5.35,-3.34,-6.0286360129373024
O=C1CC[C@H]([NH+]2CCN(c3ncnc4ccccc34)CC2)CCN1Cc1cccc(Cl)c1,C11839404_decoy,CASP3,Decoy,0,-8.76214,-7.28,-1.83,-5.875599256646171
CN(C[C@H]1CCC[NH+](CCc2cccc(C(F)(F)F)c2)C1)C(=O)c1cc2ncccn2n1,C12112329_decoy,CASP3,Decoy,0,-6.68223,-6.69,-3.05,-5.869518538618876
COc1cccc([C@H]2CC[NH+](Cc3nc(C4(c5ccc(C)cc5)CCCC4)no3)C2)c1OC,C12432265_decoy,CASP3,Decoy,0,-8.46091,-7.51,-1.62,-7.633684913722996
COc1ccc(C[NH+](Cc2ccco2)C[C@@H]2C(=O)O[C@@H]3C[C@@]4(C)CCC[C@@]5(CO5)[C@@H]4C[C@H]23)cc1,C12864042_decoy,CASP3,Decoy,0,-9.2069,-6.85,-1.62,-7.287900925206826
Cc1oc(-c2cccc(Cl)c2)nc1C[NH+]1CCC[C@H](C(=O)N2CCN(c3ccccc3)CC2)C1,C09693925_decoy,CASP3,Decoy,0,-8.36647,-6.8,-2.93,-6.512455043893079
COc1ccc(C2=NN3[C@@H](C2)c2cc(Br)ccc2OC32CC[NH+](C)CC2)cc1OC,C13778246_decoy,CASP3,Decoy,0,-7.69828,-5.99,-5.81,-5.748544845506726
CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H]([NH+]1CCN(c3ccccc3F)CC1)C2,C14533739_decoy,CASP3,Decoy,0,-8.41237,-6.6,-1.18,-6.654542659161171
Cc1cnc(-c2nc(-c3ccccc3)c3n2CC[NH+](Cc2ccc([C@@H]4CCCCO4)s2)C3)cn1,C14536760_decoy,CASP3,Decoy,0,-8.85756,-7.27,-1.92,-6.900212911342524
Cc1ccc(C)c(N2CC[NH+]([C@@H]3CCc4c(c(C(=O)N5CCSCC5)nn4C)C3)CC2)c1,C14743490_decoy,CASP3,Decoy,0,-8.18579,-6.41,-0.75,-5.585328261877432
C=CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H]([NH+]1CCN(c3ccc(Cl)cc3)CC1)C2,C14743799_decoy,CASP3,Decoy,0,-9.17478,-5.77,-1.97,-6.471065563107354
CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H]([NH+]1CCN(c3cccc(C)c3C)CC1)C2,C14751999_decoy,CASP3,Decoy,0,-8.93596,-6.29,-1.93,-6.346383105444749
C[C@@H](c1nnc(SCc2cn3cc(Cl)ccc3n2)n1-c1ccc(Cl)cc1)[NH+](C)C,C16927561_decoy,CASP3,Decoy,0,-7.99099,-6.75,-3.04,-6.6495585271633
c1ccc(N2CCN([C@H]3CCC[NH+](C4CCN(c5ccc6c(c5)OCO6)CC4)C3)CC2)cc1,C19958433_decoy,CASP3,Decoy,0,-9.64664,-6.25,-1.37,-6.503266194629081
Fc1ccccc1-c1nn(C[NH+]2CCC(c3nc4ccccc4o3)CC2)c(=S)n1C1CC1,C21189620_decoy,CASP3,Decoy,0,-6.71862,-7.61,-0.51,-6.503729932453505
Cc1ccccc1C[NH+]1CCCN(C(=O)c2cc(-c3cccs3)nc3onc(C)c23)CC1,C31765698_decoy,CASP3,Decoy,0,-9.37352,-7.51,-3.32,-7.336636636270155
CCn1c(N2CC[NH+](Cc3ccc(Cl)cc3)CC2)nc2sc3c(c2c1=O)CC(C)(C)OC3,C34734861_decoy,CASP3,Decoy,0,-9.05809,-6.58,-1.76,-6.159667635799627
CCSc1nc(N2CC[NH+](CC(=O)N3CCCCC3)CC2)c2c(CC)c(C)sc2n1,C34760983_decoy,CASP3,Decoy,0,-7.88352,-7.71,-1.59,-7.151347009978878
CCc1c(C)sc2nc(SCC(=O)N(C)C)nc(N3CC[NH+](Cc4cc(C)ccc4C)CC3)c12,C34762287_decoy,CASP3,Decoy,0,-10.0118,-6.82,-1.87,-7.038413819532251
Cc1ccccc1[C@H]1c2ccsc2CC[NH+]1CC(=O)N1CCCN(C(=O)c2ccco2)CC1,C34787977_decoy,CASP3,Decoy,0,-6.62367,-6.27,-2.03,-5.689058881919272
C/C(=N\[n+]1c(-c2ccc([N+](=O)[O-])cc2)csc1NC1CCCCC1)c1ccc(Br)cc1,C35535492_decoy,CASP3,Decoy,0,-8.03534,-6.24,-4.19,-6.079982163571205
C[C@@H](Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)N(C)C1CCCCC1,C36819192_decoy,CASP3,Decoy,0,-8.58189,-7.06,-2.22,-6.705643298748454
C[C@H]1C[C@H](C)CN(C(=O)[C@@H](C)Sc2nnc([C@@H](C)[NH+](C)C)n2-c2ccc(Cl)cc2)C1,C36819201_decoy,CASP3,Decoy,0,-8.60816,-6.8,-3.16,-6.219509935283235
Cc1c(Cl)ccc2sc(N(CC[NH+](C)C)C(=O)[C@H]3Oc4ccccc4O[C@H]3C)nc12,C36643034_decoy,CASP3,Decoy,0,-8.73743,-6.09,-3.16,-6.661027830617719
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N(CCC[NH+](C)C)c1nc2c(F)cc(F)cc2s1,C36645325_decoy,CASP3,Decoy,0,-8.78883,-6.34,-2.63,-6.3525849561556855
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N(CCC[NH+](C)C)c1nc2c(F)cc(F)cc2s1,C36645327_decoy,CASP3,Decoy,0,-7.24416,-6.65,-2.89,-6.282348936537814
Cc1c(Cl)ccc2sc(N(CCC[NH+](C)C)C(=O)[C@H]3Oc4ccccc4O[C@H]3C)nc12,C36645536_decoy,CASP3,Decoy,0,-8.73951,-6.74,-2.26,-5.089881191675011
Cc1cc(Cl)cc2sc(N(CC[NH+](C)C)C(=O)[C@@H]3Oc4ccccc4O[C@H]3C)nc12,C38837667_decoy,CASP3,Decoy,0,-8.22329,-5.69,-1.67,-5.679054300798339
Cc1cc(Cl)cc2sc(N(CC[NH+](C)C)C(=O)[C@H]3Oc4ccccc4O[C@@H]3C)nc12,C38837669_decoy,CASP3,Decoy,0,-8.19057,-6.45,-2.3,-5.998397988501599
O=C(c1nc2sccn2c1C[NH+](CC1CCC1)C[C@@H]1CCCO1)N1CCCCCCC1,C19146039_decoy,CASP3,Decoy,0,-9.78907,-5.49,-2.37,-7.637168071494541
COc1cc(C[NH+]2CCC(C(=O)N3C[C@]4(C)C[C@H]3CC(C)(C)C4)CC2)cc(OC)c1OC,C39937949_decoy,CASP3,Decoy,0,-7.86322,-6.67,-4.32,-7.938531399961218
CC(C)(C)c1noc(C[NH+]2CCC(C(=O)N3CCN(c4ccccc4Cl)CC3)CC2)n1,C40926562_decoy,CASP3,Decoy,0,-7.88077,-6.91,-2.28,-5.482910634216304
Cc1[nH+]c(SCC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)n(C2CCCCC2)c1C,C10869250_decoy,CASP3,Decoy,0,-8.54018,-6.72,-1.7,-7.294089666051429
Cc1ccc(N2CC[NH+]([C@@H]3CCc4c(c(C(=O)N5CCSCC5)nn4C)C3)CC2)c(C)c1,C14747209_decoy,CASP3,Decoy,0,-8.22461,-5.79,-2.71,-5.546408789742468
c1ccc2c(c1)CC([NH+]1CCC(CN(Cc3cccc4nonc34)C[C@@H]3CCCO3)CC1)C2,C15062094_decoy,CASP3,Decoy,0,-9.45023,-7.23,-1.55,-7.575317517015101
C[C@@H]1C[C@H](C)CN(C(=O)[C@@H](C)Sc2nnc([C@@H](C)[NH+](C)C)n2-c2ccc(Cl)cc2)C1,C36819198_decoy,CASP3,Decoy,0,-7.49461,-7.3,-2.1,-5.411934977069222
COCCCN1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2cccc3ccccc23)C1=O,C63137775_decoy,CASP3,Decoy,0,-6.62297,-6.29,-5.28,-5.282197271693576
CCCCCCN1CC(=O)N2[C@H](c3ccc(OC)cc3)[C@H]3[NH+]=c4ccccc4=C3C[C@H]2C1=O,C63140114_decoy,CASP3,Decoy,0,-7.45562,-5.86,-1.98,-5.71761447656185
COc1ccccc1CN1CC(=O)N2[C@H](c3ccccc3C)[C@@H]3[NH+]=c4ccccc4=C3C[C@H]2C1=O,C63140717_decoy,CASP3,Decoy,0,-7.44229,-6.81,-2.69,-5.418123310835852
COc1ccccc1[C@H]1[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(Cc3ccccc3Cl)CC(=O)N21,C63140819_decoy,CASP3,Decoy,0,-8.05267,-6.97,-1.24,-6.799064988870551
O=C1[C@@H]2N=NC(c3ccc(Cl)cc3)=C2[C@@H](c2cccnc2)N1CCC1=c2ccccc2=[NH+]C1,C63296229_decoy,CASP3,Decoy,0,-8.142,-7.17,-1.58,-6.959858138479908
C[C@]12C(=O)N(Cc3ccco3)CC(=O)N1C[C@@H](c1ccccc1Cl)C1=c3ccccc3=[NH+][C@@H]12,C63362724_decoy,CASP3,Decoy,0,-7.7985,-9.18,-1.9,-6.757005520706962
COc1ccccc1[C@H]1CN2C(=O)CN(CCC(C)C)C(=O)[C@]2(C)[C@H]2[NH+]=c3ccccc3=C12,C63372981_decoy,CASP3,Decoy,0,-8.07336,-8.25,-2.83,-7.636899328408476
COCCCN1CC(=O)N2C[C@@H](c3ccc(Cl)cc3)C3=c4ccccc4=[NH+][C@@H]3[C@@]2(C)C1=O,C63374860_decoy,CASP3,Decoy,0,-7.23793,-6.88,-1.36,-5.8390123046365785
CCOc1ccc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2Cc2cccn2-c2ncccn2)cc1,C63832301_decoy,CASP3,Decoy,0,-7.92837,-6.55,-3.93,-5.851500578476091
COc1ccc(/C=N/N2C(=O)[C@H]3CC4=c5ccccc5=[NH+][C@@H]4CN3[C@H]2c2ccc(C)cc2)cc1,C64348734_decoy,CASP3,Decoy,0,-8.30279,-6.91,-3.71,-5.689279347789052
C[C@H]1[C@@H](CN2CCC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccccn2)C(=O)N(c2ccccc2)N1C,C64636323_decoy,CASP3,Decoy,0,-8.0161,-7.63,-4.51,-5.861215946124571
Fc1ccccc1N1CC[NH+]([C@@H](c2ccc(Cl)cc2)c2nnnn2Cc2cccs2)CC1,C01351504_decoy,CASP3,Decoy,0,-9.42899,-6.78,-2.6,-7.377044676407714
Cc1ccc2[nH+]c(C(F)(F)F)cc(N3CCN(/C=C(\C#N)S(=O)(=O)c4cccs4)CC3)c2c1,C01039947_decoy,CASP3,Decoy,0,-7.62075,-8.34,-1.45,-8.576212338680488
Cc1c(Cl)ccc2sc(N(CCC[NH+]3CCOCC3)C(=O)Cc3ccc4c(c3)OCO4)nc12,C09521168_decoy,CASP3,Decoy,0,-8.49536,-7.24,-2.3,-6.196039108264977
Cc1cc2nc(N(CCC[NH+]3CCOCC3)C(=O)Cc3ccc4c(c3)OCO4)sc2cc1C,C09521173_decoy,CASP3,Decoy,0,-8.48678,-7.58,-1.9,-7.660920568377623
Cc1ccc(=O)n([C@@H](C(=O)c2ccc(F)cc2)C(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)c1,C09833462_decoy,CASP3,Decoy,0,-8.49057,-7.76,-2.15,-7.186745113257833
COc1cc2[nH+]cc(C(=O)c3ccc(C)cc3)c(N3CCN(c4ccc(F)cc4)CC3)c2cc1OC,C02694461_decoy,CASP3,Decoy,0,-7.92352,-7.22,-1.99,-6.26805258475649
CC[NH+](CC)CCN(C(=O)c1ccc(Cl)cc1Cl)c1nc2cc3c(cc2s1)OCO3,C10066847_decoy,CASP3,Decoy,0,-8.04842,-6.19,-4.01,-5.934059682969091
Cc1ccc2c(CSc3nnc(C[NH+]4CCCCC4)n3-c3ccccc3)cc(=O)oc2c1C,C09877417_decoy,CASP3,Decoy,0,-8.49744,-7.06,-1.52,-6.875919717249621
C[C@H](c1nnc(S[C@H](C)C(=O)N2CCCc3ccccc32)n1-c1ccc(F)cc1)[NH+]1CCCCC1,C11416126_decoy,CASP3,Decoy,0,-8.1525,-6.73,-2.43,-6.2739033016914725
O=C(OC[C@H]1CCC[NH+]2CCCC[C@H]12)c1cc2nc(-c3ccc(F)cc3)cc(C(F)(F)F)n2n1,C12374701_decoy,CASP3,Decoy,0,-7.50222,-7.59,-2.17,-5.72809300492226
C[C@@H](c1nnc(SCc2nc(-c3ccccc3Cl)no2)n1-c1ccc(F)cc1)[NH+]1CCCCC1,C09338552_decoy,CASP3,Decoy,0,-9.33437,-7.25,-2.61,-5.714953634693004
CSc1ncc(C(=O)N2CCN(c3cc[nH+]c4cc(Cl)ccc34)CC2)n1-c1ccccc1,C12628320_decoy,CASP3,Decoy,0,-7.10477,-6.8,-1.17,-6.115969756240842
CCc1ccc(-n2c(=O)c3ccccc3n3c(=S)n(C[NH+]4CCC[C@H]4c4cccs4)nc23)cc1,C13070106_decoy,CASP3,Decoy,0,-8.05862,-8.06,-1.71,-6.944546658550685
CCCCN1CN(CCN2C(=O)S/C(=C\c3ccc(C)cc3)C2=O)Cn2c1[nH+]c1ccccc12,C13015962_decoy,CASP3,Decoy,0,-6.70366,-8.05,-0.97,-5.778277372197941
COc1ccc([C@H]2[C@H]3C(=O)N(c4ccc(C)cc4)C(=O)[C@H]3ON2c2ccccc2)cc1C[NH+]1CCC(C)CC1,C02399812_decoy,CASP3,Decoy,0,-7.54356,-7.41,-2.8,-6.578895863281704
C=C(C)CSc1nc(N2CC[NH+](CC(=O)N3CCCCC3)CC2)c2c3c(sc2n1)CCCC3,C34756092_decoy,CASP3,Decoy,0,-9.89947,-7.15,-2.12,-7.186907753427507
C=C(C)C[NH+]1CCN(c2nc(SCC(=O)N3CCCC3)nc3sc(C)c(CC)c23)CC1,C34762442_decoy,CASP3,Decoy,0,-8.71354,-6.66,-1.44,-6.564080334659179
CC[NH+]1CCN(C(=O)c2cc(-c3ccc(OC)cc3)nn2-c2ccc(Cl)c(Cl)c2)CC1,C35251462_decoy,CASP3,Decoy,0,-8.40151,-5.79,-1.22,-6.783579114031963
CCOc1ccccc1N1CCN(C(=O)C[NH+]2CCn3cccc3[C@@H]2c2ccc(Cl)cc2)CC1,C35522984_decoy,CASP3,Decoy,0,-8.05002,-6.11,-2.56,-5.797323565153537
Cc1ccccc1N1CCN(C(=O)c2ccc(C[NH+]3CCn4cccc4[C@@H]3c3ccccc3Cl)o2)CC1,C35523333_decoy,CASP3,Decoy,0,-6.83245,-7.92,-4.81,-5.048142929910056
Cc1ccccc1N1CCN(C(=O)c2ccc(C[NH+]3CCn4cccc4[C@H]3c3ccccc3Cl)o2)CC1,C35523334_decoy,CASP3,Decoy,0,-7.97902,-8.58,-5.69,-6.640907052297788
CCN(C)c1nc(N2CCN(c3ccccc3)CC2)[nH+]c2c1CN(C(=O)c1cccc(C(F)(F)F)c1)CC2,C34676779_decoy,CASP3,Decoy,0,-8.49895,-7.62,-2.64,-6.613298954025147
Cc1ccc(N(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)S(=O)(=O)c2ccc(C)cc2)cc1,C37570543_decoy,CASP3,Decoy,0,-7.4787,-6.94,-4.2,-5.382288012322523
O=S(=O)(c1ccc(Cl)cc1)N(c1ccc2c(c1)OCO2)C1CC[NH+](Cc2c(F)cccc2F)CC1,C37587795_decoy,CASP3,Decoy,0,-8.45695,-7.62,-2.95,-8.059626151285592
Cc1nc(-c2ccc(-c3ccc(C(=O)N4CCc5cc6c(cc54)C4(CC[NH+](C)CC4)CO6)cc3)c(C)c2)no1,C01485772_decoy,CASP3,Decoy,0,-7.75847,-7.68,-3.72,-6.558664589872439
CS(=O)(=O)N1N=C([C@H]2C(=O)[NH+]=c3ccc(Cl)cc3=C2c2ccccc2)C[C@H]1c1cccs1,C38661940_decoy,CASP3,Decoy,0,-7.58185,-6.54,-3.01,-6.168550115929203
CC[NH+](CC)CCN(C(=O)[C@@H]1Oc2ccccc2O[C@@H]1C)c1nc2ccc(Cl)cc2s1,C36642353_decoy,CASP3,Decoy,0,-9.02749,-5.3,-3.06,-6.338660193336097
O=C1[NH+]=c2ccc(Cl)cc2=C(c2ccccc2)[C@H]1C1=NN(C(=O)CCl)[C@H]([C@@H]2CC=CO2)C1,C38799076_decoy,CASP3,Decoy,0,-8.21718,-7.02,-4.05,-6.789040779866392
Cc1cc(Cl)cc2sc(N(CCCn3cc[nH+]c3)C(=O)/C=C/c3ccc4c(c3)OCO4)nc12,C38848127_decoy,CASP3,Decoy,0,-8.13026,-6.13,-1.88,-6.690570029548584
COc1cc(C(=O)N(C[C@@H]2C=c3cc(C)ccc3=[NH+]C2=O)c2ccc(C)cc2C)cc(OC)c1OC,C38905923_decoy,CASP3,Decoy,0,-8.01689,-7.14,-1.92,-6.361187209863951
COc1cc(C(=O)N(C[C@H]2C=c3cc(C)ccc3=[NH+]C2=O)c2ccc(C)cc2C)cc(OC)c1OC,C38905924_decoy,CASP3,Decoy,0,-8.21886,-7.63,-1.22,-6.965848993643963
COc1cc(C(=O)N(C[C@H]2C=c3ccccc3=[NH+]C2=O)c2cc(C)ccc2C)cc(OC)c1OC,C38914950_decoy,CASP3,Decoy,0,-7.35274,-6.09,-2.08,-6.80828174973174
Cc1cccc(CCN(C[C@@H]2C=c3c(C)cc(C)cc3=[NH+]C2=O)S(=O)(=O)c2cccc3nsnc23)c1,C39325291_decoy,CASP3,Decoy,0,-9.67641,-7.02,-1.07,-8.381979260042941
Cc1cc(C)c(S(=O)(=O)N(CCc2ccccc2)C[C@H]2C=c3cc4c(cc3=[NH+]C2=O)OCCO4)c(C)c1,C39325314_decoy,CASP3,Decoy,0,-7.59538,-7.12,-2.72,-5.639945101072896
CCc1cccc2c1=[NH+]CC=2C(=O)[C@H](Sc1nnc(-c2ccc3c(c2)OCO3)o1)c1ccccc1,C39421821_decoy,CASP3,Decoy,0,-7.87564,-8.91,-3.66,-6.600407056490326
COc1cc(/C=N/[C@@H]2C(=O)[NH+]=c3ccc(Br)cc3=C2c2ccccc2)cc(OC)c1OC,C40140873_decoy,CASP3,Decoy,0,-8.4172,-7.26,-1.95,-7.135088020307296
C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(c2nc(CN3CCOCC3)nc3scc(-c4cccs4)c23)C1,C40149321_decoy,CASP3,Decoy,0,-10.2946,-6.37,-1.56,-7.42036495200721
CC(C)c1ccc(-c2ccc(N3CCC(C(=O)N4CCC([NH+]5CCCCC5)CC4)CC3)nn2)cc1,C40921207_decoy,CASP3,Decoy,0,-7.44487,-6.31,-1.57,-6.839199042906432
O=C(N1CCN(c2ccc(-c3noc(C4CCCC4)n3)c[nH+]2)CC1)C12CC3CC(CC(C3)C1)C2,C44096294_decoy,CASP3,Decoy,0,-8.35224,-6.93,-0.83,-5.526462331613856
N#Cc1nc(-c2ccco2)oc1N1CC[NH+](Cc2ccc(-c3ccc(Br)cc3)o2)CC1,C46569166_decoy,CASP3,Decoy,0,-7.82468,-7.62,-1.21,-5.258313940924241
C[C@@H]1C[C@H](C)CN(C(=O)CSc2nc3sc4c(c3c(=O)n2CCC[NH+](C)C)CCCC4)C1,C36803014_decoy,CASP3,Decoy,0,-8.1718,-5.92,-3.76,-5.972883368775015
COc1ccc(-c2nc(C)c(C(=O)N3CCC(C4=c5ccccc5=[NH+]C4)CC3)s2)cc1OC,C63135219_decoy,CASP3,Decoy,0,-8.22389,-6.88,-2.66,-5.54936121391015
COc1ccccc1[C@@H]1[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(Cc3ccccc3Cl)CC(=O)N12,C63140813_decoy,CASP3,Decoy,0,-7.54003,-6.4,-1.68,-6.055751993921412
CCOc1ccccc1[C@@H]1[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(CCc3ccccc3F)CC(=O)N12,C63141050_decoy,CASP3,Decoy,0,-8.18207,-6.81,-4.59,-5.888991611615392
CCOc1ccc(-n2c(SCC(=O)C3=c4ccccc4=[NH+]C3)nc3sc4c(c3c2=O)CCCC4)cc1,C39940292_decoy,CASP3,Decoy,0,-8.91274,-6.99,-3.78,-7.588568441835386
COc1cc(C(=O)N(C[C@@H]2C=c3ccc(C)cc3=[NH+]C2=O)c2ccc(C)c(C)c2)cc(OC)c1OC,C63249898_decoy,CASP3,Decoy,0,-7.38671,-7.26,-1.74,-6.577628965966929
CCc1ccc([C@H]2CN3C(=O)CN(CCc4ccc(OC)cc4)C(=O)[C@]3(C)[C@H]3[NH+]=c4ccccc4=C23)cc1,C63374959_decoy,CASP3,Decoy,0,-9.44907,-8.89,-3.14,-7.291955891885443
O=C1[C@H]2N=NC(c3ccc(Br)cc3)=C2[C@H](c2ccccn2)N1CCC1=c2ccccc2=[NH+]C1,C63561156_decoy,CASP3,Decoy,0,-8.12303,-8.08,-2.04,-8.180486510131484
COc1cc(C(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@H]2c2ccc(SC)cc2)cc(OC)c1OC,C63697597_decoy,CASP3,Decoy,0,-9.28872,-5.45,-5.01,-6.438928437204885
COc1ccc(C)cc1-n1nnnc1S[C@H]1C(=O)[NH+]=c2ccc(Cl)cc2=C1c1ccccc1,C40070593_decoy,CASP3,Decoy,0,-7.26439,-8.35,-1.43,-5.797795257790003
COC(=O)C1C(=O)[C@H](C(=O)OC)[C@@H](c2ccc(C)cc2)C(C#N)(C#N)[C@H]1c1cccc2ccccc12,C04489395_decoy,CASP3,Decoy,0,-5.822,-6.04,-1.44,-5.719028214320097
CC(=O)N(c1ccccc1)c1nc(COC(=O)c2ccc(-n3nc(C)c(Cl)c3C)cc2)cs1,C09248527_decoy,CASP3,Decoy,0,-8.38862,-6.6,-4.55,-5.566051630842057
Cc1ccc(C2=NN(C(=O)CSc3nnc(Cc4ccccc4)n3C)[C@H](c3ccco3)C2)cc1,C09376884_decoy,CASP3,Decoy,0,-7.64413,-6.22,-2.63,-5.575876335156307
Cc1c(Cl)cccc1-n1c(SCC(=O)N2CCC(c3ccccc3)=N2)nnc1-c1ccncc1,C09471065_decoy,CASP3,Decoy,0,-7.5226,-5.83,-3.22,-6.195783701393302
CN(Cc1nc2ccccc2s1)C(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1,C09796920_decoy,CASP3,Decoy,0,-8.50709,-8.16,-0.97,-7.383688536605468
COc1ccc(-n2c(SCc3cc(=O)oc4c(C)c(C)ccc34)nnc2-c2ccncc2)cc1,C09925077_decoy,CASP3,Decoy,0,-7.45012,-8.73,-2.2,-7.047291870278761
Cc1nn(-c2ccccc2)c(N2CCCC2)c1/C=C1\N=C(c2cccc(OC(F)F)c2)OC1=O,C03206304_decoy,CASP3,Decoy,0,-7.77998,-6.58,-1.45,-6.0537928633426485
CCOc1ccc(-n2c(SCc3nc(CC)no3)nc3sc4c(c3c2=O)CCCC4)cc1,C12781773_decoy,CASP3,Decoy,0,-8.62062,-5.69,-1.78,-6.436939116830692
C[C@H](Sc1ncnc2c1cnn2-c1ccccc1)C(=O)N(c1nccs1)C1CCCCC1,C12819062_decoy,CASP3,Decoy,0,-7.57799,-6.42,-1.44,-6.142627262964211
Cc1cc(-n2c(C)cc(C(=O)CSc3nc4ccccc4c(=O)n3-c3ccccc3F)c2C)no1,C10316932_decoy,CASP3,Decoy,0,-7.88552,-8.17,-3.81,-7.03692292243459
Cc1ccccc1-n1nnnc1SCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2,C15405753_decoy,CASP3,Decoy,0,-8.69459,-7.73,-2.29,-7.1457915347687
COc1ccc([C@H]2C3=C(C[C@H](c4ccco4)CC3=O)N=C(C)C2C(=O)OC2CCCC2)cc1OC,C16294067_decoy,CASP3,Decoy,0,-8.49985,-6.22,-2.37,-6.255359857254067
C=CCN(CC(=O)N1CCCC[C@H]1c1nc(-c2ccc(Br)cc2)no1)C(=O)C(C)(C)C,C16613402_decoy,CASP3,Decoy,0,-7.52209,-6.29,-3.06,-6.589774612892798
O=C(C1CC1)N(CCC1=CCCCC1)Cc1cc2cc3c(cc2nc1N1CCOCC1)OCO3,C14978516_decoy,CASP3,Decoy,0,-9.10759,-6.99,-2.44,-7.437106374291788
COc1ccccc1N1CCN([C@@H](c2ccc(Cl)cc2)c2nnnn2Cc2cccs2)CC1,C13505287_decoy,CASP3,Decoy,0,-10.0418,-6.97,-1.14,-7.459078512872944
COC(=O)c1c(OC2Cc3ccccc3C2)cc(=O)n2c1CCN(Cc1cc3ccccc3o1)CC2,C20210267_decoy,CASP3,Decoy,0,-8.89622,-7.94,-2.4,-6.744170913619709
COc1ccc(-c2nnc(S[C@H](C)C(=O)N3CCCc4ccccc43)n2C[C@@H]2CCCO2)cc1,C21239629_decoy,CASP3,Decoy,0,-7.60694,-7.83,-0.95,-6.61328233565062
CCc1nn2c(=O)cc(CSc3nc4cc(Cl)ccc4c(=O)n3CCC(C)C)nc2s1,C22647976_decoy,CASP3,Decoy,0,-9.1682,-6.43,-1.6,-6.457997958767946
Cc1ccc(-n2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)N(C(C)C)C(C)C)nnc23)cc1,C23271504_decoy,CASP3,Decoy,0,-6.83862,-6.62,-3.86,-5.866483760590101
COc1ccc(-c2nnc(SCc3csc(N(C(C)=O)c4ccccc4F)n3)n2C)cc1,C29832792_decoy,CASP3,Decoy,0,-8.04177,-7.74,-4.7,-8.282447997156881
COc1ccc(N2CCN(C(=O)c3csc(CSc4nc5c(C)cccc5o4)n3)CC2)cc1,C33653111_decoy,CASP3,Decoy,0,-8.57261,-7.52,-1.35,-6.255136581840378
CC(C)(C)c1cc2nc(-c3ccccc3Cl)cc(C(=O)N(CCC#N)Cc3cccnc3)n2n1,C34833211_decoy,CASP3,Decoy,0,-7.67959,-5.78,-3.2,-7.113692246827386
CCOc1ccc([C@@H]2c3c(oc4ccccc4c3=O)C(=O)N2c2nc(C)c(C)s2)cc1OCC,C34990999_decoy,CASP3,Decoy,0,-6.63442,-5.53,-3.91,-5.873770435998915
CC(C)N(C(=O)CSc1nc(Cl)cc(N2CCN(C(=O)C3CCCC3)CC2)n1)C(C)C,C35305451_decoy,CASP3,Decoy,0,-9.67383,-6.37,-1.93,-8.70245697609352
CCOC(=O)[C@H]1CCCN(C(=O)C2CCN(c3nc(Cc4ccc(Cl)cc4)ns3)CC2)C1,C35373533_decoy,CASP3,Decoy,0,-9.29583,-6.22,-1.93,-6.951266920893503
COc1ccc(-n2nc(-c3c(C)nc4c(OCc5ccc(C)cc5)cccn4c3=O)cc2C)cc1,C35563033_decoy,CASP3,Decoy,0,-7.8274,-7.65,-3.0,-6.412771107383894
Cc1c(C(=O)OCC(=O)N(c2ccccc2)C2CCCCC2)sc2nc3n(c(=O)c12)CCC3,C21371664_decoy,CASP3,Decoy,0,-9.95143,-7.05,-2.21,-6.296678509373208
COc1ccc(-n2c(S[C@H](C)c3nc4ccccc4n3C(F)F)nnc2-c2ccncc2)cc1,C37133349_decoy,CASP3,Decoy,0,-7.70204,-6.61,-1.89,-7.909331319114154
CCCC(=O)N1CCCN(c2nc([C@@H](C)CCC)nc3c2c(C)nn3-c2ccc(F)cc2)CC1,C37379523_decoy,CASP3,Decoy,0,-7.71544,-6.4,-3.8,-5.475740774021648
COCc1nc(-c2ccccc2)nc(N2CCN(S(C)(=O)=O)CC2)c1Cc1ccc(Cl)cc1,C37399542_decoy,CASP3,Decoy,0,-8.62689,-5.52,-4.4,-5.865078729054183
COc1cc(-c2nnc(COc3ccc4cc(Br)ccc4c3)o2)cc(OC)c1OC,C01156529_decoy,CASP3,Decoy,0,-8.31777,-7.79,-1.54,-6.459305168064259
CCn1c(SCC(=O)N2CCN(c3ccccc3)CC2)nnc1-c1cc2cc(Cl)ccc2o1,C04058306_decoy,CASP3,Decoy,0,-7.5773,-7.21,-1.6,-6.142278716850557
COc1ccc(CCN2C(=O)C(C#N)=C(C)/C(=C/c3ccc(-c4ccc(F)cc4)o3)C2=O)cc1OC,C38608303_decoy,CASP3,Decoy,0,-9.6948,-8.09,-1.46,-7.261961627342982
COc1ccc(C(=O)N(CCn2nc(C)cc2C)c2nc3c(C)c(Cl)ccc3s2)cc1OC,C38902022_decoy,CASP3,Decoy,0,-8.19911,-6.65,-3.79,-7.06014906937281
CCON1C[C@](C)(S(=O)(=O)C(C)C)N(CC2(C3CCCCC3)CCN(Cl)CC2)C1=O,C39490979_decoy,CASP3,Decoy,0,-8.83803,-6.55,-1.92,-7.573185348387441
CCc1cc2oc(=O)cc(CSc3nnc(CN4CCCCCC4=O)n3CC)c2cc1Cl,C39575831_decoy,CASP3,Decoy,0,-8.09918,-7.68,-1.61,-6.414249488158254
CN1/C(=C\C(=O)COC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)C(C)(C)c2ccccc21,C10526074_decoy,CASP3,Decoy,0,-7.18408,-4.92,-2.26,-5.316009572705935
CCOc1ccc([C@@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2Cc2ccco2)cc1OCC,C39840119_decoy,CASP3,Decoy,0,-6.42841,-6.38,-2.17,-4.63935465454503
COc1ccc(-c2nn(-c3ccccc3)cc2/C=C2\SC(=O)N(c3ccccc3OC)C2=O)cc1,C39857502_decoy,CASP3,Decoy,0,-6.47177,-6.69,-3.41,-5.470294988430515
CCOc1ccc([C@H]2c3c(oc4c(C)cc(C)cc4c3=O)C(=O)N2Cc2ccco2)cc1OCC,C39910913_decoy,CASP3,Decoy,0,-7.5149,-5.9,-4.74,-4.799686344446526
CO[C@H]1C[C@H](OC(C)=O)[C@H]2[C@@H]3CC[C@H]4C[C@H](OC(C)=O)CC[C@]4(C)[C@@H]3C[C@H](OC(C)=O)[C@]21C,C39941931_decoy,CASP3,Decoy,0,-8.47319,-5.28,-1.58,-6.428795100393904
CCOc1cc(C2=NC(=O)C3=C4CC[C@@H](C(C)(C)C)C[C@@H]4SC3=N2)ccc1OS(C)(=O)=O,C39960971_decoy,CASP3,Decoy,0,-8.88232,-6.74,-2.96,-9.18341072579664
CCOc1cc(C2=NC(=O)C3=C4CC[C@@H](C(C)(C)C)C[C@H]4SC3=N2)ccc1OS(C)(=O)=O,C39960973_decoy,CASP3,Decoy,0,-7.47126,-6.32,-3.21,-4.965475651226585
C=CCN(C(=O)C1CCN(c2cc(-n3nccc3-c3ccccc3)ncn2)CC1)c1ccccc1,C40854490_decoy,CASP3,Decoy,0,-8.18495,-6.83,-2.34,-9.956073756885614
Cc1ccc(-n2cnnc2SCC(=O)N2N=C(c3ccco3)C[C@@H]2c2cccs2)c(C)c1,C45649614_decoy,CASP3,Decoy,0,-8.56368,-7.23,-1.8,-6.835014515555901
Cc1c(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)nnn1-c1nc(-c2ccccc2)cs1,C56935003_decoy,CASP3,Decoy,0,-8.48344,-8.29,-0.68,-5.643536228311335
C=CCn1c(S[C@H](C)c2nnc(C)o2)nnc1-c1cc(-c2ccc(C)cc2)nc2ccccc12,C59359985_decoy,CASP3,Decoy,0,-8.78748,-8.65,-2.22,-8.341048033883993
CC1=C(/C=C(\C#N)C(=O)OCC2=NC(=O)C3=C4CCCC[C@@H]4SC3=N2)C[C@H](C)N1CC(C)C,C40084012_decoy,CASP3,Decoy,0,-8.2871,-8.56,-0.9,-5.772606114097092
COc1ccccc1CN1CCC2=NC(SCc3nc(-c4cccc(C)c4)oc3C)=NC(=O)[C@@H]2C1,C64392311_decoy,CASP3,Decoy,0,-9.18755,-7.32,-1.27,-5.921100491396116
CC(=O)c1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(-c4cnc5ccccc5n4)cc3)CC2)cc1,C65031632_decoy,CASP3,Decoy,0,-7.27746,-6.81,-2.81,-5.567691117438978
CCOCCOC(=O)C1C(C)=NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@H]1c1ccccc1F,C06195675_decoy,CASP3,Decoy,0,-8.53162,-6.49,-1.87,-6.976540658903628
CCOCCOC(=O)C1C(C)=NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@H]1c1ccccc1C,C06195666_decoy,CASP3,Decoy,0,-9.30089,-5.48,-1.68,-7.105151792618936
COC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OC(C)=O)cc3)c(=O)n2[C@H]1c1ccc(OC)c(OC)c1,C09310609_decoy,CASP3,Decoy,0,-7.5838,-7.37,-3.0,-7.931665197731274
CCOC(=O)[C@H](C)Sc1nnc(Cn2c(=O)sc3ccccc32)n1-c1cccc(C(F)(F)F)c1,C09278748_decoy,CASP3,Decoy,0,-9.41964,-6.79,-3.05,-7.408994263211599
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)N(C[C@H]2CCCO2)c2nc3c(OC)cccc3s2)cc1,C10874089_decoy,CASP3,Decoy,0,-9.86512,-6.98,-4.03,-7.194759594968174
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c3ccc(OC(F)F)c(OC)c3)c2C)cc1,C13096492_decoy,CASP3,Decoy,0,-7.17949,-6.85,-1.09,-6.074219526659416
COC(=O)CC[C@H](C)[C@@H]1CC[C@@H]2[C@@H]3[C@@H](CC(=O)[C@]21C)[C@@]1(C)CC[C@@H](OC(C)=O)C[C@@H]1C[C@H]3OC(C)=O,C13424977_decoy,CASP3,Decoy,0,-9.0988,-7.02,-1.9,-7.266705764435761
COC(=O)CC[C@H](C)[C@H]1CC[C@@H]2[C@@H]3[C@@H](CC(=O)[C@]21C)[C@@]1(C)CC[C@@H](OC(C)=O)C[C@@H]1C[C@H]3OC(C)=O,C13424979_decoy,CASP3,Decoy,0,-8.82052,-6.94,-2.32,-6.826576674838747
Cc1ccc(Cn2nc(C)c3cc(C(=O)OCC(=O)c4cc(C)n(C[C@H]5CCCO5)c4C)sc32)cc1,C03406098_decoy,CASP3,Decoy,0,-9.8183,-7.43,-1.17,-7.139973775699622
CCCCN(CC(=O)N1CCc2sccc2[C@H]1c1ccc(OC)cc1)C(=O)c1ccc([N+](=O)[O-])cc1,C16507519_decoy,CASP3,Decoy,0,-8.19711,-6.62,-1.27,-6.756532752162933
CCCN(Cc1cccn1Cc1ccc(C(=O)N2CCC[C@@H](C(=O)OCC)C2)o1)C(=O)c1ccc(C)cc1,C16533761_decoy,CASP3,Decoy,0,-8.33175,-7.21,-5.14,-6.848688463511976
COc1ccc(CCN(C)c2cc(Cl)nc(SCC(=O)N3CCc4ccccc4C3)n2)cc1OC,C16611567_decoy,CASP3,Decoy,0,-10.0778,-6.85,-3.54,-9.308549193272352
Cc1cc(C)c(S(=O)(=O)N(CC(=O)N(Cc2ccc3c(c2)OCO3)Cc2ccco2)C(C)C)c(C)c1,C16653428_decoy,CASP3,Decoy,0,-7.90322,-7.03,-4.0,-6.653548758874708
CCOCCOC(=O)C1C(C)=NC2=C(C(=O)C[C@H](c3ccc(OC)cc3)C2)[C@@H]1c1cccc(OC)c1OC,C16677370_decoy,CASP3,Decoy,0,-7.76517,-5.7,-3.97,-6.846843372039433
COC(=O)C1=CN(Cc2ccc(OC)c(OC)c2)C=C(C(=O)OC)C1c1ccc(OC(F)(F)F)cc1,C02797059_decoy,CASP3,Decoy,0,-8.00779,-5.89,-3.24,-6.418520942979128
CCCOc1ccc(/C=C2/SC(=O)N(CN3CCN(c4ccc(C)c(Cl)c4)CC3)C2=O)cc1OC,C20266062_decoy,CASP3,Decoy,0,-10.0211,-5.37,-0.82,-5.417042326876997
CCC(=O)N(c1ccccc1)[C@H]1C[C@@H](C)N(C(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)c2ccccc21,C22838972_decoy,CASP3,Decoy,0,-8.02586,-7.22,-2.96,-6.038712290113704
CCO/C=N\C1=C(C#N)[C@H](c2ccc(OC)c(OC)c2)c2c(-c3ccccc3)nn(-c3ccccc3)c2O1,C05846527_decoy,CASP3,Decoy,0,-7.1723,-7.36,-3.13,-6.435097163172753
CCCc1nc(-c2ccccc2)nc(C(=O)N2CCN(C(=O)C(C)(C)CCl)[C@H](C)C2)c1C(=O)OCC,C33595787_decoy,CASP3,Decoy,0,-7.76654,-5.46,-1.93,-6.265290063624498
CCOCCCN(CC(=O)N(Cc1ccccc1)Cc1sccc1C)C(=O)c1ccc2c(c1)OCO2,C33626438_decoy,CASP3,Decoy,0,-8.1892,-6.76,-3.87,-7.546838023352641
CC[C@H](C)CN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1sccc1C)C(=O)c1ccc(OC)cc1,C34837606_decoy,CASP3,Decoy,0,-9.45276,-7.32,-2.03,-8.093622169344457
CCS(=O)(=O)N(CC(=O)N(Cc1ccc(C)cc1)C1CCN(C(=O)Cc2cccs2)CC1)CC(C)C,C34909886_decoy,CASP3,Decoy,0,-8.71647,-7.8,-2.64,-7.907327722767135
CCC(=O)N1CCN(C(=O)CCCSc2nnc(-c3ccc(C)cc3)n2-c2ccc(C)cc2)C[C@H]1C,C35129645_decoy,CASP3,Decoy,0,-7.07241,-6.92,-2.12,-6.412010304313829
C[C@H]1CN(C(=O)CCCSc2nnc(-c3cccs3)n2-c2ccccc2)CCN1C(=O)C(C)(C)C,C35173915_decoy,CASP3,Decoy,0,-8.88475,-6.88,-1.68,-7.996106951494948
CCCc1nc(-c2ccccc2)nc(C(=O)N2CCN(C(=O)c3ccc(C)cc3)[C@H](C)C2)c1C(=O)OCC,C35176177_decoy,CASP3,Decoy,0,-7.18554,-7.14,-3.1,-6.094514739204439
COc1cc(OC)cc(C(=O)N(CCc2csc3nc(-c4ccc(C)cc4)cn23)C[C@H]2CCCO2)c1,C35470622_decoy,CASP3,Decoy,0,-9.52464,-7.64,-3.05,-7.472002954231548
CCCCCOc1ccc([C@@H]2c3c(oc4ccc(C)cc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C35485625_decoy,CASP3,Decoy,0,-6.24817,-6.3,-1.66,-5.787528700122104
CCCCCOc1ccc([C@H]2c3c(oc4ccc(C)cc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C35485629_decoy,CASP3,Decoy,0,-8.01274,-6.42,-1.25,-5.237972986489678
CCOC(=O)[C@H]1CCCN(C(=O)[C@@H](C)Sc2nnc3c4ccccc4n(Cc4ccccc4)c3n2)C1,C35701713_decoy,CASP3,Decoy,0,-9.27178,-8.0,-1.05,-6.731920786747048
CCOCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1sccc1C)C(=O)c1ccc(C)cc1,C35808217_decoy,CASP3,Decoy,0,-8.83494,-6.11,-1.82,-7.063834146069783
CCOC(=O)c1c(C)c(C(=O)CN(Cc2ccco2)S(=O)(=O)c2c(C)cc(C)cc2C)c(C)n1CC,C35869506_decoy,CASP3,Decoy,0,-6.99203,-5.57,-2.7,-6.326452378895282
COC(=O)CC[C@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@H](OC(C)=O)[C@]12C)[C@@]1(C)CCC(=O)C[C@@H]1C[C@H]3OC(C)=O,C37246017_decoy,CASP3,Decoy,0,-8.88121,-6.61,-1.24,-6.815436054902717
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@H](OC(C)=O)[C@]12C)[C@@]1(C)CCC(=O)C[C@@H]1C[C@H]3OC(C)=O,C37246018_decoy,CASP3,Decoy,0,-8.61319,-6.93,-1.13,-7.619219503471591
CCOc1cc(/C=C2/C(=O)N(CCCOC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1,C38606718_decoy,CASP3,Decoy,0,-9.13591,-7.48,-1.49,-6.834796576918295
CCOc1cc(/C=C2/C(=O)N(CCc3ccc(OC)c(OC)c3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C,C38608357_decoy,CASP3,Decoy,0,-9.6663,-6.82,-2.13,-7.209275010264468
CCOC(=O)C1=C(c2ccccc2)N=c2s/c(=C\[C@@H]3C=CC=N3)c(=O)n2[C@H]1c1cccc(OC)c1OC,C39350864_decoy,CASP3,Decoy,0,-6.7172,-5.74,-3.43,-5.760670693336947
CCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC(C)C)cc1OCC,C39840508_decoy,CASP3,Decoy,0,-7.73213,-4.92,-0.99,-5.579798219888336
CCCCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CCCC)c2N2C[C@@H](C)O[C@@H](C)C2)SC1=S,C39991312_decoy,CASP3,Decoy,0,-9.35353,-6.43,-1.44,-8.865569135333274
CCOCCCN1C(=O)/C(=C/c2c(Oc3ccc(CC)cc3)nc3ccc(C)cn3c2=O)SC1=S,C39999163_decoy,CASP3,Decoy,0,-8.77246,-6.31,-1.28,-5.087735765585827
CCOc1ccc([C@H]2c3c(oc4ccc(CC)cc4c3=O)C(=O)N2c2nnc(CC)s2)cc1OCC,C40038916_decoy,CASP3,Decoy,0,-8.15637,-5.23,-2.02,-5.826419774884532
C=CCN1C(=O)[C@@H](Cc2cc(Cl)ccc2Cl)S/C1=N\N=C\c1cc(OC)c(OC)c(OC)c1,C40147781_decoy,CASP3,Decoy,0,-8.9052,-6.14,-2.62,-7.151937023515515
C=CCc1ccc(OCCn2c([C@@H]3CC(=O)N(c4ccccc4OCC)C3)nc3ccccc32)c(OC)c1,C40253431_decoy,CASP3,Decoy,0,-7.72261,-7.79,-2.15,-8.310013228584594
C=CCc1ccc(OCCCn2c([C@H]3CC(=O)N(c4cccc(OC)c4)C3)nc3ccccc32)c(OC)c1,C40253788_decoy,CASP3,Decoy,0,-7.6411,-7.58,-4.92,-6.808815432971353
C=CCc1ccc(OCCCCn2c([C@H]3CC(=O)N(c4ccc(OC)cc4)C3)nc3ccccc32)c(OC)c1,C40257708_decoy,CASP3,Decoy,0,-8.91593,-7.16,-3.78,-8.319439651016891
COc1cc(CN(C[C@@H]2CCCO2)C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc(OC)c1OC,C41021694_decoy,CASP3,Decoy,0,-8.19664,-7.11,-1.35,-6.788620332925189
COC(=O)c1ccc(/C=C2/Oc3c4c(cc(C)c3C2=O)OCN(CCc2ccc(OC)c(OC)c2)C4)cc1,C41646046_decoy,CASP3,Decoy,0,-9.64659,-6.47,-1.63,-6.693163189520678
COc1ccccc1CCN1COc2cc(C)c3c(c2C1)O/C(=C\c1ccc(OC)c(OC)c1OC)C3=O,C41649208_decoy,CASP3,Decoy,0,-9.4054,-7.5,-2.17,-7.14963539755472
CCOC(=O)C1=C(C)N=C(CN(Cc2ccc3c(c2)OCO3)S(=O)(=O)c2ccc(F)cc2F)[C@H]1C,C63612902_decoy,CASP3,Decoy,0,-8.90224,-7.46,-1.15,-7.734515913779138
CCOC(=O)C1=C(C)C(C(=O)/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)=N[C@H]1C,C40051617_decoy,CASP3,Decoy,0,-7.52242,-7.78,-1.18,-7.3223166817211425
CCCCN(CCCC)C(=O)c1cn(CC)nc1S(=O)(=O)N1CCN(c2ccccc2Cl)CC1,C67337337_decoy,CASP3,Decoy,0,-9.11735,-5.55,-1.5,-9.305339804301996
CC(=O)N(c1ccc(N(C(C)=O)S(=O)(=O)c2ccc(C)cc2)cc1)S(=O)(=O)c1ccc(C)cc1,C00822115_decoy,CASP3,Decoy,0,-5.71324,-7.13,-2.4,-6.916030536981936
CCOC(=O)COc1c(I)cc(/C=C2\N=C(c3ccco3)OC2=O)cc1OC,C00679160_decoy,CASP3,Decoy,0,-7.90702,-5.5,-1.52,-5.735159883832677
COc1ccc(CCN2C(=O)/C(=C/c3c(N(C)C)nc4c(C)cccn4c3=O)SC2=S)cc1OC,C02370487_decoy,CASP3,Decoy,0,-9.26568,-6.55,-1.77,-6.160680431489116
COc1cc2c(cc1OC)-c1cc(N(CC[C@@H](c3ccccc3)c3ccco3)C(C)=O)nc(=O)n1CC2,C02108708_decoy,CASP3,Decoy,0,-6.93379,-8.16,-2.8,-6.47529126077069
CCOC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(C3CCCC3)C2=O)CC1,C08970570_decoy,CASP3,Decoy,0,-7.79716,-6.76,-1.72,-5.576838275775567
C[C@H](Oc1nnc(S[C@@H](C)C(=O)N2CCc3ccccc32)n1C)C(=O)N1CCc2ccccc21,C09579477_decoy,CASP3,Decoy,0,-7.23882,-8.27,-2.06,-8.850031546933218
O=C(CSc1nnnn1Cc1cccs1)N(Cc1cccs1)c1ccc2c(c1)OCCO2,C09605987_decoy,CASP3,Decoy,0,-9.58254,-6.38,-1.93,-6.981087434863384
Cc1ccc(-n2c(S[C@H](C(=O)N3CCOCC3)c3ccccc3)nnc2N2CCOCC2)cc1,C09208943_decoy,CASP3,Decoy,0,-8.18183,-6.76,-1.43,-6.096288204777629
C=CCn1c(SCC(=O)N2N=C(c3cccs3)C[C@H]2c2ccco2)nnc1-c1ccncc1,C09793429_decoy,CASP3,Decoy,0,-8.00379,-7.67,-4.7,-6.633285038733662
COC(=O)C1CCN(C(=O)COC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1,C09848790_decoy,CASP3,Decoy,0,-8.41598,-6.64,-3.47,-5.846394744780709
COc1ccc(-n2c(C)cc(C(=O)CSc3nnc([C@H]4COc5ccccc5O4)o3)c2C)cc1,C09338605_decoy,CASP3,Decoy,0,-8.90236,-8.77,-1.53,-7.053430249939142
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1/C=C/C(=O)OCC(=O)N1CCCc2ccccc21,C09963848_decoy,CASP3,Decoy,0,-8.68966,-7.56,-0.91,-7.287412892893865
COC(=O)c1c(OCCc2scnc2C)cc(=O)n2c1CCN(C(=O)Cc1cccs1)CC2,C12450150_decoy,CASP3,Decoy,0,-9.16035,-7.08,-1.2,-7.567709424796714
C#CCn1/c(=N/C(=O)c2ccc(S(=O)(=O)N(CCC#N)CCC#N)cc2)sc2cc(C)c(C)cc21,C09511145_decoy,CASP3,Decoy,0,-8.42721,-6.05,-5.75,-6.121260959103945
Cc1ccc(-n2c(C)cc(C(=O)COC(=O)CN3C(=O)c4ccccc4S3(=O)=O)c2C)cc1C,C09220583_decoy,CASP3,Decoy,0,-6.73644,-8.66,-2.24,-6.9025389453363655
C=CCn1c(SCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)nnc1-c1cccnc1,C09338946_decoy,CASP3,Decoy,0,-8.66801,-7.33,-1.7,-6.186162608179606
COc1ccccc1N1CCN(C(=O)c2csc(CSc3nnc(C)n3-c3ccccc3)n2)CC1,C16460286_decoy,CASP3,Decoy,0,-9.2826,-7.55,-4.32,-6.472362945947209
Cc1c(Cl)cccc1N1CN(C(=O)CN(Cc2ccccc2)C(=O)c2ccc3c(c2)OCO3)CC1=O,C16646598_decoy,CASP3,Decoy,0,-8.00399,-7.09,-4.47,-6.016257628084473
CCCc1nnc(N2C(=O)c3oc4ccc(F)cc4c(=O)c3[C@H]2c2ccc(OCC)c(OC)c2)s1,C16741985_decoy,CASP3,Decoy,0,-7.83945,-5.97,-1.57,-6.004152756714373
CCN(C(=O)[C@@H](C)Sc1nnc(N2CCCCC2)n1-c1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1,C18595426_decoy,CASP3,Decoy,0,-8.61596,-5.56,-4.59,-7.096140772022278
COc1ccc(CN2CCc3c(C(=O)N(C)[C@@H](C)c4ccco4)c(OC)cc(=O)n3CC2)cc1C,C20455486_decoy,CASP3,Decoy,0,-8.35731,-5.9,-1.72,-6.761537117735418
COC(=O)c1c(OC[C@H]2CC(=O)N(C)C2)cc(=O)n2c1CCN(Cc1cc(C)c(C)cc1C)CC2,C20778162_decoy,CASP3,Decoy,0,-8.99103,-8.06,-2.06,-6.142144659776693
CN(C(=O)COC(=O)Cn1cnc2ccccc2c1=O)[C@@]1(c2ccccc2Cl)CCCCC1=O,C21713348_decoy,CASP3,Decoy,0,-8.23823,-7.57,-4.42,-8.426472759981198
O=C(CSc1nnc(Cc2ccccc2)n1-c1ccccc1)N1CCN(C(=O)c2ccco2)CC1,C21825123_decoy,CASP3,Decoy,0,-8.1687,-6.89,-2.37,-6.732567669696507
Cc1cccc(-c2nnc(SCC(=O)N3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)n2C)c1,C24137283_decoy,CASP3,Decoy,0,-8.25171,-8.34,-1.48,-5.854315110484379
CSc1ncc(C(=O)N2CCN(Cc3nc(-c4ccsc4)no3)CC2)n1-c1ccc(F)cc1,C12603683_decoy,CASP3,Decoy,0,-9.73254,-7.68,-1.57,-8.860969667622971
O=C(CSc1ncnc2c1cnn2-c1ccc(F)cc1)N1CCN(CCOc2ccccc2)CC1,C13296112_decoy,CASP3,Decoy,0,-7.39739,-6.99,-1.32,-6.952714989050419
CCOc1nc2sc3c(c2c(=O)n1CCN1CCN(S(=O)(=O)CC(C)C)CC1)CCCC3,C28559779_decoy,CASP3,Decoy,0,-8.45959,-6.62,-1.79,-7.729241598169123
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)[C@@H](Cl)c3ccccc3)[C@H](C)C2)c1C(=O)OCC,C33703417_decoy,CASP3,Decoy,0,-7.75249,-6.7,-2.7,-7.496273508475938
CCOC(=O)[C@@H]1CCCN(c2c(/C=C3\SC(=S)N(CC(C)C)C3=O)c(C)c(C#N)c(=O)n2C)C1,C33812331_decoy,CASP3,Decoy,0,-7.95772,-7.04,-4.08,-6.513695398094294
CCOC(=O)[C@@H]1CCCN(c2c(/C=C3\SC(=S)N(C4CCCC4)C3=O)c(C)c(C#N)c(=O)n2C)C1,C33812359_decoy,CASP3,Decoy,0,-8.47195,-7.0,-3.36,-9.588934054930265
C=CCOC(=O)c1c(C)nc(-c2ccccc2)nc1C(=O)N1CCN(C(=O)c2cccc(F)c2)[C@@H](C)C1,C34852876_decoy,CASP3,Decoy,0,-7.81395,-5.78,-0.94,-6.154760500679078
CCN1CCN(C(=O)CSc2nc(Cl)cc(N3CCN(C(=O)CC(C)C)[C@H](C)C3)n2)CC1,C00737560_decoy,CASP3,Decoy,0,-8.75619,-6.84,-2.77,-7.003459429725986
COc1cc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C)s2)ccc1OCCC(C)C,C35485922_decoy,CASP3,Decoy,0,-8.6498,-6.8,-2.02,-6.843215214811824
CCOc1ccc([C@@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2CCN2CCOCC2)cc1OC,C35515567_decoy,CASP3,Decoy,0,-9.48608,-6.17,-2.4,-6.859480119538618
O=C(CN(CC1CC1)C(=O)c1ccco1)N1CCN(c2ccc(-c3ccccc3Cl)nn2)CC1,C35712438_decoy,CASP3,Decoy,0,-8.82154,-7.71,-1.88,-7.776439948931222
COc1ccc(N2CCN(C(=O)c3ccc(CN4CCn5cccc5[C@H]4c4ccoc4)o3)CC2)cc1,C35846382_decoy,CASP3,Decoy,0,-9.69971,-6.79,-1.99,-6.397318218556492
COc1ccc(-c2nnc(S[C@@H](C)C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)n2-c2ccccc2)cc1,C15855142_decoy,CASP3,Decoy,0,-8.57757,-7.14,-1.99,-7.225984183641165
Cc1ccc(-c2ccc(N3CCN(C(=O)CN(Cc4ccco4)C(=O)c4cccc(F)c4)CC3)nn2)cc1,C36069463_decoy,CASP3,Decoy,0,-8.52432,-7.26,-1.14,-8.416850910904015
Cc1ccc(-c2ccc(N3CCCN(C(=O)CN(Cc4ccco4)C(=O)C(C)C)CC3)nn2)cc1,C36070024_decoy,CASP3,Decoy,0,-7.90874,-7.43,-2.18,-7.067359953814533
CCCn1c(=O)c2ccccc2n2c(SCC(=O)c3cc(C)n(C[C@H]4CCCO4)c3C)nnc12,C03375368_decoy,CASP3,Decoy,0,-7.78594,-7.51,-1.8,-6.905085794181943
CCOc1ccc([C@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2[C@H]2CCS(=O)(=O)C2)cc1OCC,C38649107_decoy,CASP3,Decoy,0,-8.74456,-6.52,-1.11,-7.012763342930026
CC(C)Cn1c(SCC(=O)N(C2CCCCC2)[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccco1,C09052503_decoy,CASP3,Decoy,0,-8.61464,-6.93,-4.55,-6.647995706632607
COc1cccc([C@]2(CC(=O)N(C)C[C@@H]3N=NC4=C3CCCC4)CC(=O)N(C3CCCC3)C2=O)c1,C39388420_decoy,CASP3,Decoy,0,-8.87131,-7.04,-1.12,-7.522430631986015
Cn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1,C09723688_decoy,CASP3,Decoy,0,-9.7673,-7.68,-1.35,-7.52632510073583
CCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CC)c2N2CCC(C(=O)OCC)CC2)SC1=S,C39989838_decoy,CASP3,Decoy,0,-8.82145,-6.38,-3.68,-7.037891786155881
COCCn1c(SCc2cc(=O)n3nc(C)sc3n2)nc2sc3c(c2c1=O)CCCC3,C46865753_decoy,CASP3,Decoy,0,-10.2496,-6.57,-0.94,-6.159157664881639
COC(=O)COc1cc(Br)c(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1OC,C59333063_decoy,CASP3,Decoy,0,-7.76048,-6.2,-1.98,-5.9491896036569685
CCOC(=O)Cn1c2c(sc1=O)[C@@H](c1ccco1)[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1S2,C47139301_decoy,CASP3,Decoy,0,-9.19941,-5.94,-0.82,-6.5286966205575165
CCCn1cc(C(=O)N2CCC[C@H](C)C2)c(S(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)n1,C67337606_decoy,CASP3,Decoy,0,-8.69503,-7.44,-1.67,-6.199918016587619
CN(Cc1ccc(-c2ccc(Br)cc2)o1)C(=O)CSc1nnnn1C[C@H]1CCCO1,C08770400_decoy,CASP3,Decoy,0,-8.71447,-6.46,-2.67,-8.849520572806314
COC(=O)[C@@]1(C#N)[C@@H]2C=Cc3ccccc3N2[C@@H](C(=O)c2ccc(OC(C)=O)cc2)[C@@H]1c1ccco1,C09455567_decoy,CASP3,Decoy,0,-8.45189,-7.05,-0.67,-7.529911370775824
CCn1c2ccccc2c2nnc(SCC(=O)N(Cc3ccccc3)[C@@H]3CCS(=O)(=O)C3)nc21,C09493255_decoy,CASP3,Decoy,0,-9.40503,-6.81,-2.87,-7.268526879495453
CCOc1cccc2sc(N3CCN(C(=O)c4ccc(S(=O)(=O)N(CC)CC)cc4)CC3)nc12,C09543009_decoy,CASP3,Decoy,0,-8.14833,-5.66,-2.88,-7.524869610095591
O=C(CSc1nnc(-c2cccnc2)n1C1CC1)N1N=C(c2cccs2)C[C@H]1c1ccco1,C10216940_decoy,CASP3,Decoy,0,-7.80638,-6.41,-4.32,-5.810936847582034
O=C(CCCc1nnc2c(=O)n(-c3ccc(Cl)cc3)ccn12)N1CCN(c2ccccc2)CC1,C09833246_decoy,CASP3,Decoy,0,-7.31943,-8.47,-1.46,-6.57543247333536
COc1ccc(C(=O)N(C[C@@H]2CCCO2)c2nc3c(S(C)(=O)=O)cccc3s2)cc1OC,C10828810_decoy,CASP3,Decoy,0,-8.80829,-6.02,-0.62,-6.687680247624094
O=C(CSc1nnc(N2CCCCC2)n1C[C@@H]1CCCO1)N1CCN(c2ccc(F)cc2)CC1,C11275039_decoy,CASP3,Decoy,0,-8.68139,-6.84,-2.2,-5.656892617537103
COC(=O)c1c(S(=O)(=O)N(C)CC(C)C)sc2c1CCN(C(=O)c1cccc(N(C)C)c1)C2,C12570533_decoy,CASP3,Decoy,0,-7.1377,-5.64,-1.91,-4.61979108216242
Cc1ccc(N2C(=O)CC[C@@H](C(=O)OCCn3nc4ccccn4c3=O)[C@H]2c2cccs2)cc1,C12918891_decoy,CASP3,Decoy,0,-6.94,-6.15,-1.5,-5.668582943650166
COc1ccc(Cl)c2sc(N(C[C@@H]3CCCO3)C(=O)[C@@H]3CCCN(S(C)(=O)=O)C3)nc12,C13791248_decoy,CASP3,Decoy,0,-9.31192,-6.24,-1.7,-7.07721943767768
COc1ccc(Cl)c2sc(N(C[C@@H]3CCCO3)C(=O)[C@H]3CCCN(S(C)(=O)=O)C3)nc12,C13791252_decoy,CASP3,Decoy,0,-8.74668,-7.06,-3.41,-7.449828180225389
CCOC(=O)c1nn(Cc2ccncc2)c2c1CN(C(=O)c1csc(-c3cccs3)n1)CC2,C14540024_decoy,CASP3,Decoy,0,-10.2164,-5.91,-0.82,-7.808405338982722
CCn1c(CN(c2ccc(C)cc2)S(C)(=O)=O)nnc1SCC(=O)N1[C@H](C)CCC[C@@H]1C,C15019639_decoy,CASP3,Decoy,0,-8.66059,-6.4,-1.86,-10.913265442879364
Cc1c(C(=O)CSc2nnc(CN(c3ccccc3)S(C)(=O)=O)n2C)c2ccccc2n1C,C15019777_decoy,CASP3,Decoy,0,-8.90836,-7.52,-1.47,-7.352243773042872
C=CCn1c(SCC(=O)N2CCN(S(C)(=O)=O)CC2)nnc1-c1ccc(C(C)(C)C)cc1,C18324996_decoy,CASP3,Decoy,0,-7.63924,-7.54,-1.48,-5.354387912863921
COc1ccc(-c2nc(C(=O)OCC(=O)c3cc(C)n([C@H]4CCS(=O)(=O)C4)c3C)cs2)cc1,C19176798_decoy,CASP3,Decoy,0,-8.27767,-6.52,-1.14,-5.964570904758945
CCn1c(CN(c2ccc(C)cc2)S(C)(=O)=O)nnc1SCC(=O)N1C[C@H](C)C[C@@H](C)C1,C19925986_decoy,CASP3,Decoy,0,-8.2,-7.02,-4.22,-6.66039760269692
Cc1nn(-c2ccccc2Cl)c2sc(C(=O)OCC(=O)N(C)[C@H]3CCS(=O)(=O)C3)cc12,C20979316_decoy,CASP3,Decoy,0,-8.58387,-7.4,-1.25,-5.941917368378871
Cc1cc(C(=O)COC(=O)C2CCN(C(=O)C(C)(C)C)CC2)c(C)n1-c1ccc2c(c1)OCCO2,C21511479_decoy,CASP3,Decoy,0,-7.68036,-6.96,-1.82,-9.610641416814657
CC(C)c1nnc(SCC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)n1C1CC1,C22133366_decoy,CASP3,Decoy,0,-10.244,-6.83,-1.44,-6.930912100135664
CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc(-c2cc(C)oc2C)nc2c1cnn2C(C)C,C22280352_decoy,CASP3,Decoy,0,-7.88113,-7.86,-3.21,-7.548532138985396
CCc1nnc(CSC2=N/C(=C\c3ccc(OC)cc3)C(=O)N2c2ccc(Cl)c(OC)c2)o1,C24832296_decoy,CASP3,Decoy,0,-8.89969,-6.88,-2.98,-7.786229634433386
COc1ccc(-c2c(C)c(-c3nnc(C)o3)nn2-c2ccc(C(=O)N(C)Cc3ccccc3)cc2)cc1,C25163400_decoy,CASP3,Decoy,0,-7.47337,-6.88,-3.61,-5.715414441386382
CSc1ccc(C(=O)c2ccccc2C(=O)N2CCN(C(=O)c3cccs3)CC2)cc1[N+](=O)[O-],C25611782_decoy,CASP3,Decoy,0,-7.43555,-7.06,-3.32,-6.3948249131802966
CCOc1ccc(N2/C(=N/C(=O)Cc3ccc(OC)c(OC)c3)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1,C32505355_decoy,CASP3,Decoy,0,-8.11547,-6.93,-1.99,-6.82700447565841
O=C(CSc1nnc(-c2cccnc2)n1C1CC1)N1N=C(c2ccco2)C[C@@H]1c1cccs1,C32741858_decoy,CASP3,Decoy,0,-8.67475,-5.69,-3.2,-6.816314914565504
CCOC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cc3cnn(C(C)C)c3nc2C)CC1,C32850866_decoy,CASP3,Decoy,0,-8.02265,-6.46,-1.54,-8.473591499488153
CCOC(=O)C1CCN(c2c(/C=C3\SC(=S)N(C4CCCC4)C3=O)c(C)c(C#N)c(=O)n2C)CC1,C33450661_decoy,CASP3,Decoy,0,-9.09062,-6.76,-2.91,-6.938708880292091
C[C@H]1CN(C(=O)CSc2nnc(-c3cccs3)n2-c2ccccc2)CCN1C(=O)c1ccco1,C35173887_decoy,CASP3,Decoy,0,-7.14371,-7.23,-1.95,-5.898617368953145
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)c3cc(Cl)cc(Cl)c3)[C@@H](C)C2)c1C(=O)OCC,C35176149_decoy,CASP3,Decoy,0,-9.06757,-6.76,-2.63,-7.586962564265569
CCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C35485925_decoy,CASP3,Decoy,0,-7.99316,-5.45,-1.4,-6.865136510591594
O=C(c1ccc2c(c1)OCO2)N(Cc1c(-c2ccccc2)noc1N1CCCC1)C[C@@H]1CCCO1,C35780527_decoy,CASP3,Decoy,0,-7.89861,-7.71,-3.86,-7.205263671050113
COc1ccccc1N1CCN(C(=O)c2ccc(CN3CCn4cccc4[C@H]3c3ccoc3)o2)CC1,C35846301_decoy,CASP3,Decoy,0,-8.30935,-7.07,-0.51,-6.623798302237122
COCCN(CC(=O)N1CCN(c2ccc(-c3ccccc3Cl)nn2)CC1)C(=O)c1ccccc1C,C36061673_decoy,CASP3,Decoy,0,-8.42416,-6.71,-1.97,-6.053399693864179
O=C(CN(C[C@H]1CCCO1)C(=O)c1cccc(F)c1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1,C36061799_decoy,CASP3,Decoy,0,-8.433,-6.41,-1.85,-5.542595993242745
O=C(/C=C/c1ccc(OC(F)F)cc1)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1,C36735438_decoy,CASP3,Decoy,0,-7.22684,-6.85,-1.18,-6.4381427427470825
CCN1CCN(C(=O)CN2C(=O)COc3ccc(C(=O)COc4c(C)cc(C)cc4C)cc32)CC1,C37512439_decoy,CASP3,Decoy,0,-9.09191,-6.85,-3.68,-8.166358000022626
Cc1ccc(S(=O)(=O)Cn2nnnc2[C@H](c2ccccc2)N2CCN(c3ccccc3)CC2)cc1,C20142095_decoy,CASP3,Decoy,0,-7.61108,-7.19,-2.61,-6.778400324296483
O=C(CSc1nnc(C2CC2)n1Cc1ccco1)N1N=C(c2cccs2)C[C@@H]1c1ccco1,C36663531_decoy,CASP3,Decoy,0,-11.2798,-7.31,-2.53,-7.661602933883326
CCOC(=O)C1=C(C)N=C(C(=O)C(=O)N2CCN(c3ccccc3OC)CC2)[C@H]1c1ccccc1,C39704914_decoy,CASP3,Decoy,0,-7.71443,-7.27,-1.62,-8.557253680075597
CCOC(=O)C1=C(C)N=C(C(=O)C(=O)N2CCN(c3ccccc3)CC2)[C@H]1c1ccc(OC)cc1,C39705112_decoy,CASP3,Decoy,0,-7.61231,-6.14,-1.34,-6.529781846133581
CCCn1c(N2C[C@@H](C)O[C@@H](C)C2)c(/C=C2/SC(=S)N(Cc3ccco3)C2=O)c(C)c(C#N)c1=O,C39770398_decoy,CASP3,Decoy,0,-8.1512,-6.93,-1.97,-6.229546087696149
COc1ccccc1OCCCn1c([C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc21,C40182340_decoy,CASP3,Decoy,0,-8.42069,-6.7,-4.53,-5.8464883973556665
CCCN(CCC)C(=O)Cn1c([C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc21,C40182420_decoy,CASP3,Decoy,0,-7.95422,-6.42,-0.91,-7.37616379709416
CCOc1ccccc1CN(Cc1ccco1)C(=O)c1nn([C@H]2CCS(=O)(=O)C2)c2c1CCCC2,C40987971_decoy,CASP3,Decoy,0,-9.46376,-7.39,-2.93,-7.906646222269495
O=S(=O)(c1ccc(CSc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)o1)N1CCCC1,C46861482_decoy,CASP3,Decoy,0,-11.0072,-6.18,-1.41,-7.165016171552845
COc1ccc(/C=C2\Oc3c(cc4c(c3C)OCN(CCCN3CCOCC3)C4)C2=O)c(OC)c1,C20713915_decoy,CASP3,Decoy,0,-9.21509,-6.49,-1.04,-6.22933233124387
COc1ccc(N2/C(=N/C(=O)Cc3ccc(OC)c(OC)c3)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1Cl,C32507718_decoy,CASP3,Decoy,0,-9.31977,-6.37,-1.47,-6.850897547101201
CC1=C(C(=O)COC(=O)CCC2=NC(=O)C3=C4CCCC[C@@H]4SC3=N2)C[C@@H](C)N1c1nccs1,C39943050_decoy,CASP3,Decoy,0,-9.39722,-8.17,-2.3,-7.888332627263451
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1/C=C/C(=O)OCC(=O)N1CCc2ccccc21,C03365666_decoy,CASP3,Decoy,0,-8.54136,-7.01,-1.16,-6.233850257464488
CCOC(=O)C1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(CC)C2=O)CC1,C01480711_decoy,CASP3,Decoy,0,-8.38043,-5.45,-3.15,-5.903939592824579
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(S[C@H]1C[C@H](C)OC1=O)n2-c1ccccc1OC,C09198931_decoy,CASP3,Decoy,0,-8.06613,-6.82,-1.81,-8.20207384598212
Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)N1CCN(S(=O)(=O)c2ccccc2C#N)CC1,C09670396_decoy,CASP3,Decoy,0,-8.15985,-6.68,-2.06,-7.418046150610905
CCN(C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1C)[C@H]1CCS(=O)(=O)C1,C09713685_decoy,CASP3,Decoy,0,-8.10674,-5.99,-1.96,-6.222515227046489
Cc1ccc(-n2nnnc2SCC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)cc1C,C09876170_decoy,CASP3,Decoy,0,-8.77459,-7.8,-4.04,-7.578059874201275
Cc1cc(C)cc(-n2nnnc2SCC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)c1,C09948852_decoy,CASP3,Decoy,0,-9.01266,-6.72,-1.11,-7.220586731548122
CCn1c(CN2C(=O)S/C(=C\c3cccs3)C2=O)nc2cc(S(=O)(=O)N(C)C)ccc21,C11896764_decoy,CASP3,Decoy,0,-10.2075,-5.9,-1.6,-6.422952532720728
CCCn1c(C)cc(C(=O)COC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1C,C12179401_decoy,CASP3,Decoy,0,-7.76588,-7.71,-2.18,-5.743932722944555
Cc1cnc(-n2ncc(C(=O)N(C)C[C@H]3COCCO3)c2-c2cccs2)nc1-c1ccc(F)cc1,C12212769_decoy,CASP3,Decoy,0,-7.73417,-7.45,-1.7,-5.911815001449966
COc1cccc(-c2nc(CC(=O)N(C[C@H]3CCCO3)[C@@H]3CCS(=O)(=O)C3)cs2)c1OC,C13076310_decoy,CASP3,Decoy,0,-7.48742,-5.96,-3.02,-6.007138957018146
O=C(CSc1nnc(-c2cccnc2)n1C1CC1)N(c1ccccc1)[C@@H]1CCS(=O)(=O)C1,C13163770_decoy,CASP3,Decoy,0,-8.29277,-8.54,-2.07,-7.134724702433594
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N2CCN(c3cccc(Cl)c3)CC2)c1,C09635616_decoy,CASP3,Decoy,0,-7.40443,-6.66,-3.03,-6.502689872771141
CCN(C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1C)[C@@H]1CCS(=O)(=O)C1,C09716732_decoy,CASP3,Decoy,0,-8.39595,-6.0,-2.66,-6.219223079685745
Cc1csc(CC(=O)N2CCN(C(=O)CCc3c(C)nc4c(cnn4C(C)C)c3C)CC2)n1,C14252446_decoy,CASP3,Decoy,0,-9.0935,-7.74,-1.35,-7.216555746093453
O=C(c1cscn1)N1CCc2c(c(C(=O)N3CCCCC3)nn2CCCc2cccnc2)C1,C14732652_decoy,CASP3,Decoy,0,-7.17897,-8.04,-2.03,-6.681621775676947
CCN(C(=O)[C@@H](C)OC(=O)c1c(C)nn(Cc2ccccc2)c1Cl)[C@@H]1CCS(=O)(=O)C1,C16822466_decoy,CASP3,Decoy,0,-8.53603,-7.31,-1.73,-6.905147632890265
CCN(C(=O)[C@H](C)OC(=O)c1c(C)nn(Cc2ccccc2)c1Cl)[C@@H]1CCS(=O)(=O)C1,C16822468_decoy,CASP3,Decoy,0,-8.24287,-7.45,-2.17,-6.711518272402593
O=C(CSc1nnc(N2CCOCC2)n1-c1cccc(F)c1)c1ccc(N2CCCC2=O)cc1,C18960094_decoy,CASP3,Decoy,0,-8.18438,-6.33,-1.29,-6.17042948171929
Cc1ccc(-n2c(SCC(=O)N(C)[C@@H]3CCS(=O)(=O)C3)nnc2N2CCCCC2)cc1,C19420707_decoy,CASP3,Decoy,0,-8.92175,-6.59,-3.85,-7.503779345057639
CCCN1CCN(C(=O)C2CCN(C(=O)c3cnn(-c4ccccc4)c3-n3cccc3)CC2)CC1,C20416030_decoy,CASP3,Decoy,0,-9.22231,-6.59,-2.21,-6.312833943307552
CSc1ncc(C(=O)OCC(=O)c2cc(C)n([C@@H]3CCS(=O)(=O)C3)c2C)n1-c1ccccc1,C21433181_decoy,CASP3,Decoy,0,-7.55587,-7.61,-2.55,-6.381386771247836
CCN(CC)S(=O)(=O)N1CCN(C(=O)c2cc(OC)cc(Br)c2OC)CC1,C22416172_decoy,CASP3,Decoy,0,-8.27009,-4.91,-2.71,-5.710418771668713
CCOc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3SC(F)F)CC2)cc1,C23233899_decoy,CASP3,Decoy,0,-7.98336,-7.71,-1.65,-8.623848522718305
Cc1cnc(C(=O)N(CCCN2CCOCC2)CCC(=O)N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)cn1,C33677097_decoy,CASP3,Decoy,0,-8.31921,-7.21,-2.88,-6.948792475213515
Cc1cnc(C(=O)N(CCCN2CCOCC2)CCC(=O)N2C[C@]3(C)C[C@H]2CC(C)(C)C3)cn1,C33677099_decoy,CASP3,Decoy,0,-8.59648,-7.59,-1.54,-7.445961533534026
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)[C@H](Cl)c2ccccc2)[C@@H](C)C1,C35151714_decoy,CASP3,Decoy,0,-7.88365,-7.48,-1.95,-6.620085995093446
Cc1nc(C)c(C(=O)OC(C)C)c(C(=O)N2CCN(C(=O)CSc3ccccc3)[C@H](C)C2)n1,C35174246_decoy,CASP3,Decoy,0,-7.94923,-6.56,-1.59,-8.179472317459378
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)[C@H]2C[C@H]2c2ccccc2)[C@H](C)C1,C35175606_decoy,CASP3,Decoy,0,-7.69311,-7.28,-1.58,-7.315836425282536
COc1cc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C)s2)ccc1OCC(C)C,C35485976_decoy,CASP3,Decoy,0,-7.41607,-6.12,-5.29,-5.720844547602722
CC[C@@H]1S[C@H](c2ccc(OC)c(OC)c2)N(CCN2CCN(C(=O)c3ccco3)CC2)C1=O,C35614221_decoy,CASP3,Decoy,0,-7.8429,-6.85,-2.69,-6.239226519264566
Cc1c(CN(C[C@H]2COC(C)(C)O2)C(=O)c2cnc3ccccc3c2)c(=O)n(-c2ccccc2)n1C,C35839158_decoy,CASP3,Decoy,0,-6.27725,-6.42,-4.18,-5.931007784306352
Cc1cc(N2C(=O)CCS2(=O)=O)ccc1S(=O)(=O)N1CCN(C/C=C/c2ccccc2)CC1,C16700645_decoy,CASP3,Decoy,0,-8.47693,-7.74,-2.0,-6.582283428918851
CCN(C(=O)COC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)[C@H]1CCS(=O)(=O)C1,C09612658_decoy,CASP3,Decoy,0,-7.88572,-6.88,-2.76,-6.644165709150164
N#Cc1ccc(-n2c(SCC(=O)N(C3CC3)[C@@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)cc1,C24719856_decoy,CASP3,Decoy,0,-7.12857,-5.97,-1.76,-7.586605746643891
COc1cc(CO[C@@H]2CN(C(=O)C3=CC4=CC=N[C@@H]4C=C3)CC(=O)N(C(C)C)C2)cc(OC)c1,C39344594_decoy,CASP3,Decoy,0,-8.33192,-7.43,-3.46,-7.226817268805421
COC(=O)[C@@H]1[C@@H](OCCc2cccs2)CC(=O)N2CCN(C(=O)C3=C[C@H]4N=CC=C4C=C3)CC[C@H]12,C39380832_decoy,CASP3,Decoy,0,-9.27182,-6.13,-3.55,-5.9113533996541054
CC1CCN(C(=O)C2=CN(C(C)C)C[C@H](C(=O)N(C)[C@@H](C)[C@@H]3C=C(c4ccccc4)N=N3)C2=O)CC1,C39405808_decoy,CASP3,Decoy,0,-7.91855,-7.38,-1.13,-8.628249587224392
COc1cccc(CCC(=O)N2CCN(CC3=NC(=O)C4=C(C)[C@@H](C)SC4=N3)CC2)c1OC,C39726640_decoy,CASP3,Decoy,0,-8.98517,-6.77,-3.45,-5.902819419640596
COc1cccc(CCC(=O)N2CCN(CC3=NC(=O)C4=C(C)[C@H](C)SC4=N3)CC2)c1OC,C39726642_decoy,CASP3,Decoy,0,-8.42927,-6.56,-2.55,-5.676539185051558
CCCn1c(N2C[C@H](C)O[C@@H](C)C2)c(/C=C2\SC(=S)N(CCOC)C2=O)c(C)c(C#N)c1=O,C39990253_decoy,CASP3,Decoy,0,-8.54758,-6.21,-1.68,-6.483116894880392
O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1)N(C1CC1)[C@H]1CCS(=O)(=O)C1,C19297602_decoy,CASP3,Decoy,0,-7.53285,-7.38,-2.14,-6.3572913304984215
COc1cc(-c2nc(CN3CCN(C(=O)c4cccs4)CC3)c(C)o2)cc(OC)c1OC,C40963715_decoy,CASP3,Decoy,0,-9.83669,-6.86,-1.54,-9.438976489542108
COc1ccc(CN(C(=O)c2cc(-c3ccc(F)c(F)c3)on2)[C@@H]2CCS(=O)(=O)C2)cc1OC,C40986963_decoy,CASP3,Decoy,0,-8.15954,-7.3,-2.64,-6.856543530687657
COc1ccc(Cc2nnc(SCC(=O)c3cc(C)n([C@H]4CCS(=O)(=O)C4)c3C)o2)cc1,C45240838_decoy,CASP3,Decoy,0,-7.15868,-6.39,-2.74,-5.247165045064305
Cc1cc(C(=O)COC(=O)c2cccc(N3CCCS3(=O)=O)c2)c(C)n1-c1nccs1,C12890617_decoy,CASP3,Decoy,0,-7.88815,-7.24,-1.12,-6.584174524599405
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)N2CCC(n3nnc4c3CCCC4)CC2)c1,C58289614_decoy,CASP3,Decoy,0,-7.52864,-7.23,-1.04,-5.769269169168537
Cc1c(C)c(C)c(S(=O)(=O)N2CCN(CC(=O)N(C)Cc3cnn(C)c3)CC2)c(C)c1C,C59384506_decoy,CASP3,Decoy,0,-8.08503,-6.22,-2.0,-6.460259915213085
COC(=O)C=C1SCC(=O)N1CCCN1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21,C60269006_decoy,CASP3,Decoy,0,-7.42266,-7.28,-1.71,-7.292931625785637
CC(=O)C1=C(C)C(C(=O)COC(=O)c2ccc3c(c2)S(=O)(=O)c2ccccc2C3=O)=N[C@H]1C,C39945838_decoy,CASP3,Decoy,0,-8.79854,-7.53,-3.48,-8.116645797825155
Cc1ccc2nc(CCCn3ccnc3)c(/C=C3\SC(=S)N(Cc4ccco4)C3=O)c(=O)n2c1,C08858216_decoy,CASP3,Decoy,0,-8.35421,-7.72,-1.55,-6.59801415880928
CCOc1cc(/C=C2\C(=O)N([C@@H]3CCS(=O)(=O)C3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C,C09345327_decoy,CASP3,Decoy,0,-9.34418,-5.9,-4.04,-6.566336465409807
COCCn1c(SCc2cc(=O)n3cc(Br)ccc3n2)nnc1-c1ccncc1,C03354497_decoy,CASP3,Decoy,0,-7.76021,-6.21,-1.52,-6.2115020778486
COc1ccc([C@H]2C(C#N)=C(/N=C/N3CCCC3)Oc3c2c(C)nn3-c2ccccc2)cc1OC,C02425840_decoy,CASP3,Decoy,0,-7.83534,-5.48,-2.31,-4.9278928304369645
Cn1c(COc2ccc(Cl)cc2)nnc1SCCN1C(=O)c2ccccc2S1(=O)=O,C09634637_decoy,CASP3,Decoy,0,-8.59057,-7.05,-2.06,-6.099358977052911
COc1cc(C(=O)OCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)cc(Cl)c1OC,C09816389_decoy,CASP3,Decoy,0,-7.70773,-6.57,-1.19,-6.275623551332011
CCn1c(CSc2nnc(C)n2-c2cccc(C)c2)nc2cc(S(=O)(=O)N(C)C)ccc21,C09568754_decoy,CASP3,Decoy,0,-7.71817,-7.8,-3.09,-6.7143096870067165
COc1cc(OC)c(OC)cc1/C=C/C(=O)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1,C09990841_decoy,CASP3,Decoy,0,-7.98767,-6.87,-1.98,-6.919670184505254
CN(C)S(=O)(=O)c1ccc(C(=O)N(CCCn2ccnc2)c2nc3ccccc3s2)cc1,C10528589_decoy,CASP3,Decoy,0,-7.48992,-6.91,-1.95,-6.592008000170174
COc1cc(CC(=O)N2CCC(n3c(C4CCC4)nc4cccnc43)CC2)cc(OC)c1OC,C12243032_decoy,CASP3,Decoy,0,-8.14841,-6.6,-1.69,-8.198490982557338
CCN(C(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C(C)C)[C@@H]1CCS(=O)(=O)C1,C09717162_decoy,CASP3,Decoy,0,-8.71109,-6.22,-2.88,-7.219000155302175
COc1ccc(Cl)c2sc(N(Cc3ccncc3)C(=O)C3CCN(S(C)(=O)=O)CC3)nc12,C13789150_decoy,CASP3,Decoy,0,-9.51367,-6.81,-0.9,-6.703418693580533
COc1ccc(Cl)c2sc(N(Cc3ccncc3)C(=O)[C@@H]3CCCN(S(C)(=O)=O)C3)nc12,C13791081_decoy,CASP3,Decoy,0,-9.40467,-6.47,-0.95,-6.85398307445602
O=C(OCc1nc2ccccc2n1C(F)F)[C@H]1CCCN(C2=NS(=O)(=O)c3ccccc32)C1,C14121358_decoy,CASP3,Decoy,0,-6.67426,-7.76,-1.35,-5.6359462862700935
COc1cc(CO[C@@H]2CN(C(=O)c3ccc(C(C)=O)s3)CC(=O)N(C(C)C)C2)cc(OC)c1,C14743738_decoy,CASP3,Decoy,0,-9.18508,-6.2,-1.46,-7.242063538773749
COC(=O)c1c(OCCCc2ccncc2)cc(=O)n2c1CCN(C(=O)c1cccs1)CC2,C14881874_decoy,CASP3,Decoy,0,-8.60686,-5.74,-2.15,-6.557369468280529
CCC(CC)C(=O)N1CCN(C(=O)c2cn(C(C)C)cc3c(=O)n(-c4ccccc4)nc2-3)CC1,C16839032_decoy,CASP3,Decoy,0,-7.3842,-6.28,-2.68,-5.842757279678937
CCN(C(=O)[C@@H](C)Sc1nnc(N2CCCCC2)n1-c1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1,C18595429_decoy,CASP3,Decoy,0,-8.70388,-7.49,-2.25,-8.30658555493107
O=C(CSc1nnnn1-c1ccc(OC(F)(F)F)cc1)c1ccc(N2CCCC2=O)cc1,C18962820_decoy,CASP3,Decoy,0,-6.37555,-7.05,-0.69,-5.4281537931189
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)OCC(=O)N(C)C[C@@H]1COc2ccccc2O1,C19044520_decoy,CASP3,Decoy,0,-6.39944,-6.77,-1.71,-4.65150175342068
COC(=O)c1c(OC[C@@H]2CC(=O)N(C)C2)cc(=O)n2c1CCN(Cc1cc(C)cc(C)c1)CC2,C20906738_decoy,CASP3,Decoy,0,-7.90291,-7.74,-1.97,-5.792527694567235
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)OCC(=O)c3ccc(Cl)s3)c12,C21441288_decoy,CASP3,Decoy,0,-8.72607,-6.15,-0.61,-6.231045036234128
CN(C(=O)CCc1nc(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)no1)C1CCCCC1,C21873822_decoy,CASP3,Decoy,0,-8.61232,-7.14,-2.7,-5.607457584510881
O=C(CSc1nnc(N2CCCCC2)n1C1CC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2,C22473884_decoy,CASP3,Decoy,0,-8.08685,-5.72,-0.77,-5.887643332547282
O=C(CSc1nnc(N2CCCCC2)n1C1CC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2,C22473887_decoy,CASP3,Decoy,0,-9.39573,-7.61,-0.8,-7.280673183000911
COc1ccc(CN(C)C(=O)c2ccc(OC)c(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)c2)cc1OC,C23235617_decoy,CASP3,Decoy,0,-7.03577,-7.18,-4.64,-7.770961039558234
Cn1c(COc2ccccc2Cl)nnc1SCCN1C(=O)c2ccccc2S1(=O)=O,C25020987_decoy,CASP3,Decoy,0,-9.03668,-8.26,-1.57,-9.117561201833007
COc1cc(-c2nn(CN3CCO[C@H](c4ccc(F)cc4)C3)c(=S)o2)cc(OC)c1OC,C29894457_decoy,CASP3,Decoy,0,-8.70065,-6.42,-3.99,-7.129460727534604
Cc1nc(-c2ccccc2)nc(C(=O)N2CCN(C(=O)CCl)[C@@H](C)C2)c1C(=O)OCC(C)C,C33453783_decoy,CASP3,Decoy,0,-8.67495,-6.17,-1.41,-6.6594600582341394
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)[C@@H](C)C1,C34767310_decoy,CASP3,Decoy,0,-7.58796,-5.64,-1.67,-6.050289835449182
CCn1c(SCCCC(=O)N2CCN(C(=O)c3ccco3)[C@H](C)C2)nnc1-c1ccccc1,C35129561_decoy,CASP3,Decoy,0,-7.2149,-6.68,-2.79,-5.876074277971405
CCn1c(SCCCC(=O)N2CCN(C(=O)c3ccco3)[C@@H](C)C2)nnc1-c1ccccc1,C35129562_decoy,CASP3,Decoy,0,-6.52149,-7.27,-1.85,-5.7201259035903504
COC(=O)c1c(C(=O)N2CCN(C(=O)CSc3ccccc3)[C@@H](C)C2)nc(C)nc1C(C)C,C35176331_decoy,CASP3,Decoy,0,-8.11054,-6.98,-1.67,-7.222915185129049
CCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nncs2)cc1OCC,C35490453_decoy,CASP3,Decoy,0,-6.82984,-6.34,-4.07,-4.793868694006168
Cc1c(CN(C[C@@H]2COC(C)(C)O2)C(=O)C2=Cc3ccccc3OC2)c(=O)n(-c2ccccc2)n1C,C35497478_decoy,CASP3,Decoy,0,-6.5881,-7.94,-1.66,-7.6879995751987344
COCC(=O)N1CCN(C(=O)c2ccc(CSc3ccc(-c4ccccc4)nn3)o2)C[C@@H]1C,C00738002_decoy,CASP3,Decoy,0,-7.9338,-6.74,-1.63,-7.040645291896252
Cc1ccc(-c2ccc(N3CCN(C(=O)CN(C[C@@H]4CCCO4)C(=O)C4CC4)CC3)nn2)cc1,C36069825_decoy,CASP3,Decoy,0,-8.73105,-7.6,-1.77,-6.56161481380055
CCCn1c(=O)n(C)c(=O)c2c(S[C@H](C)C(=O)N3CCc4ccccc43)nc(C(C)C)nc21,C36805995_decoy,CASP3,Decoy,0,-6.75633,-6.11,-1.93,-6.830850455330899
COc1ccc(/C=C/C(=O)N2CCN(C(=O)/C=C/c3ccc(OC)c(OC)c3)CC2)cc1OC,C12493458_decoy,CASP3,Decoy,0,-7.67445,-6.55,-1.83,-6.39009675278893
COC(=O)O[C@@H]1C=C2C[C@@H](OC(C)=O)CC[C@]2(C)[C@@H]2[C@@H]1[C@@H]1CCC(=O)[C@@]1(C)C[C@@H]2OC(C)=O,C39095090_decoy,CASP3,Decoy,0,-8.55072,-5.71,-2.31,-6.942208423502539
COC(=O)O[C@@H]1C=C2C[C@H](OC(C)=O)CC[C@]2(C)[C@@H]2[C@@H]1[C@@H]1CCC(=O)[C@@]1(C)C[C@H]2OC(C)=O,C39095091_decoy,CASP3,Decoy,0,-7.60149,-6.71,-0.79,-5.465604224104859
CC(=O)C1=C(C)C(C(=O)CSc2nc3nn(-c4ccccc4)c(=O)c-3c3n2CCCCC3)=N[C@H]1C,C39733715_decoy,CASP3,Decoy,0,-7.97097,-7.53,-1.7,-6.530148226610875
CC(=O)c1ccc(-c2ccc(C(=O)OCC(=O)N(C3CCCC3)[C@@H]3CCS(=O)(=O)C3)o2)cc1,C19297588_decoy,CASP3,Decoy,0,-9.32738,-6.99,-1.57,-6.54673254355303
CCn1c(/C(Cl)=C/c2ccc(-n3cncn3)c(F)c2)nc2cc(S(=O)(=O)N(C)C)ccc21,C45800012_decoy,CASP3,Decoy,0,-7.61196,-7.39,-2.41,-5.30591549239749
Cc1nn(C)c2ncc(C(=O)OCC(=O)N(C)[C@@]3(c4ccccc4Cl)CCCCC3=O)cc12,C45917750_decoy,CASP3,Decoy,0,-8.18734,-7.09,-1.48,-7.25653296988858
COc1ccc(CN(C)C(=O)COC(=O)c2cc(-c3cccs3)nc3c2c(C)nn3C)cc1,C58635499_decoy,CASP3,Decoy,0,-9.6826,-7.54,-2.03,-7.672745659762731
COc1ccc(CN2CCN(C(=O)[C@@H]3C=C(c4ccc(Cl)cc4)N=N3)CC2)c(OC)c1OC,C63558002_decoy,CASP3,Decoy,0,-7.91632,-6.39,-3.42,-5.861254446165724
COc1ccc(-n2c(SCC(=O)[C@H]3N=C(C)C(C(C)=O)=C3C)nnc2-c2ccccn2)cc1,C02654693_decoy,CASP3,Decoy,0,-8.15306,-8.21,-0.77,-7.468049438170546
CC(=O)C1=C(C)C(C(=O)OCC(=O)N(Cc2cccs2)c2ccc3c(c2)OCCO3)=N[C@@H]1C,C38697155_decoy,CASP3,Decoy,0,-10.2357,-5.95,-1.48,-7.169438259856128
CCOC(=O)c1ccc(N2C(=O)C[C@@H](N3C(=O)/C(=C/c4ccc(OC)cc4)SC3=S)C2=O)cc1,C15051176_decoy,CASP3,Decoy,0,-9.56294,-7.65,-1.44,-6.49314423607095
C=C1C(=O)[C@]23[C@H](C(=O)C[C@H]1[C@@H]2OC(C)=O)[C@]1(COC(C)=O)CCCC(C)(C)[C@H]1C[C@H]3OC(C)=O,C08382459_decoy,CASP3,Decoy,0,-7.60157,-7.13,-5.19,-7.526058129336371
COc1cc([C@H]2S[C@H](C)C(=O)N2c2c(C)n(C)n(-c3ccccc3)c2=O)cc(OC)c1OC,C08716641_decoy,CASP3,Decoy,0,-7.93164,-6.53,-1.94,-6.2635292407915095
COc1ccc(-c2nnc(SCC(=O)N(Cc3ccccc3)[C@H]3CCS(=O)(=O)C3)o2)cc1,C08893457_decoy,CASP3,Decoy,0,-9.12604,-6.57,-1.0,-6.562583488892972
CC(=O)Oc1ccc2c(C)c(CC(=O)N3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)c(=O)oc2c1OC(C)=O,C09134341_decoy,CASP3,Decoy,0,-7.35453,-6.9,-2.44,-5.997217350510743
COc1ccccc1-n1nnnc1SCC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1,C09884793_decoy,CASP3,Decoy,0,-8.2008,-6.55,-4.24,-6.679480883913997
CCN(CC)C(=O)Cn1cnc2sc(C(=O)N3CCN(c4ccccc4)CC3)c(C)c2c1=O,C10013202_decoy,CASP3,Decoy,0,-8.475,-6.13,-1.86,-5.563523613672436
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)N(C)Cc1cnn(Cc2ccccc2)c1,C11084083_decoy,CASP3,Decoy,0,-6.49905,-8.45,-0.94,-6.713302947351282
CCn1ncc2c(C(=O)OCC(=O)c3ccc(N4CCCC4=O)cc3)cc(-c3cccs3)nc21,C11304385_decoy,CASP3,Decoy,0,-8.54654,-8.34,-2.23,-7.570119055627666
CC(=O)OC(OC(C)=O)[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccc(I)cc3)C(=O)[C@@H]12,C12379824_decoy,CASP3,Decoy,0,-7.89103,-5.99,-1.73,-8.572459375053665
CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)CCCn3cnc4c(C)cccc4c3=O)ccc21,C12638303_decoy,CASP3,Decoy,0,-6.77577,-8.41,-1.13,-6.682647826557892
COC(=O)[C@H]1C(=O)[C@H](C(=O)OC)[C@H](c2ccc(SC)cc2)C(C#N)(C#N)[C@@H]1c1ccncc1,C13397980_decoy,CASP3,Decoy,0,-8.51411,-4.88,-0.95,-6.762358044912224
CCOC(=O)C1CCN(C(=O)c2cnn(-c3ncc(C)c(-c4cccs4)n3)c2C2CC2)CC1,C14969298_decoy,CASP3,Decoy,0,-10.8263,-5.97,-3.73,-6.895257731462471
Cc1cc(C)c2c(n1)sc1c(=O)n(CC(=O)OCC(=O)c3cc(C)n(C4CC4)c3C)cnc12,C19675197_decoy,CASP3,Decoy,0,-9.21843,-6.77,-0.71,-6.75606522482854
O=S(=O)(c1ccccc1C(F)(F)F)N1CCN(Cc2nnnn2-c2cccc(F)c2)CC1,C21149718_decoy,CASP3,Decoy,0,-6.95001,-8.31,-1.5,-6.679354628764195
COc1ccc(F)cc1COC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1,C21441869_decoy,CASP3,Decoy,0,-9.08736,-7.12,-1.99,-7.19109293463123
COc1ccc(-c2nc(CSc3nnc(C[C@H]4CCS(=O)(=O)C4)o3)cs2)cc1OC,C22012188_decoy,CASP3,Decoy,0,-10.009,-6.92,-2.5,-7.070616100922138
COC(=O)c1c(OCc2ccncc2)cc(=O)n2c1CCN(Cc1ccc(OC)c(C)c1)CC2,C23128890_decoy,CASP3,Decoy,0,-9.79181,-6.92,-2.3,-6.67567900347127
CCn1c(SCC(=O)N2CCN(c3ccccc3)CC2)nnc1-c1c(C)nc2sccn12,C23141480_decoy,CASP3,Decoy,0,-9.01194,-7.77,-1.78,-8.034935056429838
COc1ccc(/C=C2\N=C(SCc3nnc(C)o3)N(c3ccc(Cl)c(OC)c3)C2=O)cc1,C23470767_decoy,CASP3,Decoy,0,-9.08418,-7.09,-2.16,-8.929153641438605
O=C([C@H](Sc1nnc(N2CCCCC2)n1C[C@@H]1CCCO1)c1ccccc1)N1CCOCC1,C24907224_decoy,CASP3,Decoy,0,-8.69257,-6.33,-2.8,-6.724879244869575
CN(Cc1cnn(-c2ccccc2)c1)C(=O)CSc1ncnc2c1cnn2-c1ccc(F)cc1,C24966045_decoy,CASP3,Decoy,0,-7.20225,-7.85,-1.39,-5.866664367913028
Cc1nc(C)c(-c2nnc(SCC(=O)N3N=C(c4ccco4)C[C@H]3c3cccs3)o2)s1,C27059774_decoy,CASP3,Decoy,0,-10.3164,-8.06,-0.75,-7.85556750221251
COc1ccc(CN2CCN(C(=O)c3cnn(-c4ccccc4C)c3C3CC3)CC2)c(OC)c1OC,C29776994_decoy,CASP3,Decoy,0,-8.9444,-6.25,-1.83,-8.558967121316032
COc1cc(-c2nn(CN3CCO[C@@H](c4ccc(F)cc4)C3)c(=S)o2)cc(OC)c1OC,C29894453_decoy,CASP3,Decoy,0,-7.6889,-6.3,-0.82,-5.784661680504429
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)[C@@H](CC)c2ccccc2)[C@H](C)C1,C33371236_decoy,CASP3,Decoy,0,-7.68623,-6.14,-4.29,-6.169751494245318
C=CCOC(=O)c1c(C)nc(-c2ccccc2)nc1C(=O)N1CCN(C(=O)C2CCC2)[C@@H](C)C1,C33779222_decoy,CASP3,Decoy,0,-7.22234,-8.01,-2.52,-7.072053565737025
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)[C@H](C)C1,C34767306_decoy,CASP3,Decoy,0,-9.194,-5.86,-2.67,-6.387874514029941
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)c3ccc(CC)cc3)[C@H](C)C2)c1C(=O)OCC,C34890140_decoy,CASP3,Decoy,0,-7.54763,-6.98,-2.82,-6.858909037206417
Cc1ccccc1-n1c(C)nnc1SCCCC(=O)N1CCN(C(=O)c2ccco2)[C@H](C)C1,C35138395_decoy,CASP3,Decoy,0,-7.88479,-7.93,-3.2,-6.672063827468994
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)c2ccc3ccccc3c2)[C@@H](C)C1,C35175557_decoy,CASP3,Decoy,0,-5.92697,-6.78,-2.0,-5.395729936294084
C=CCn1c(SCc2nc(C(=O)N3CCOCC3)co2)nc2sc3c(c2c1=O)CCCC3,C35497836_decoy,CASP3,Decoy,0,-8.7309,-6.72,-1.0,-6.834547249230599
COCC(=O)N1CCN(C(=O)c2ccc(CSc3ccc(-c4ccccc4)nn3)o2)C[C@H]1C,C00738003_decoy,CASP3,Decoy,0,-7.42522,-7.59,-1.95,-5.960404149969405
Cc1cc(C(=O)CN2CCN(S(=O)(=O)c3cccs3)CC2)c(C)n1-c1ccc2c(c1)OCO2,C15406873_decoy,CASP3,Decoy,0,-8.20773,-7.26,-1.74,-8.223180498184595
Cc1ccc(-c2ccc(N3CCN(C(=O)CN(Cc4ccco4)C(=O)C4CCC4)CC3)nn2)cc1,C36069441_decoy,CASP3,Decoy,0,-8.47088,-8.07,-1.63,-7.113064162628971
O=C(Oc1ccc(N(C(=O)c2ccncc2)S(=O)(=O)c2cccs2)cc1)c1ccncc1,C01129513_decoy,CASP3,Decoy,0,-6.93964,-6.89,-2.61,-5.734626222268867
COc1ccccc1-c1nnc(C2CCN(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)CC2)s1,C38900577_decoy,CASP3,Decoy,0,-8.59786,-7.23,-1.98,-5.974905857301058
CO[C@@H]1CN(S(=O)(=O)Oc2ccccc2)[C@@]2(CC[C@H](S(=O)(=O)Oc3ccccc3)C2)C1,C39508277_decoy,CASP3,Decoy,0,-8.14647,-6.85,-3.14,-6.104258484195731
COCCN1C(=O)/C(=C/c2c(Oc3ccc(OC)cc3)nc3ccccn3c2=O)SC1=S,C40221164_decoy,CASP3,Decoy,0,-7.04037,-7.06,-3.43,-6.447726320622309
COc1cc(-c2nc(CN3CCN(C(=O)c4sccc4C)CC3)c(C)o2)cc(OC)c1OC,C40963537_decoy,CASP3,Decoy,0,-9.99065,-6.86,-0.75,-7.001473683109451
COc1cccc(-c2nc(CSc3nnc([C@H]4CCS(=O)(=O)C4)n3C)cs2)c1OC,C45556167_decoy,CASP3,Decoy,0,-8.40739,-6.51,-1.35,-6.182929827676121
CCN(CC)S(=O)(=O)c1ccc(C(=O)N2Cc3nn(C(C)(C)C)c(-n4cccc4)c3C2)cc1,C56911144_decoy,CASP3,Decoy,0,-7.32666,-5.49,-3.36,-6.044499249657118
CS(=O)(=O)N1CCCc2cc(C(=O)CSc3nnc(C4CC4)n3Cc3ccco3)ccc21,C57594065_decoy,CASP3,Decoy,0,-8.80418,-6.65,-3.93,-6.60378894782386
Cc1nc(-c2ccccn2)sc1C(=O)OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2,C28236700_decoy,CASP3,Decoy,0,-10.0973,-6.93,-1.26,-7.328347933525185
CCCn1c2ccccc2c2nnc(S[C@@H](C)C(=O)N(CC)[C@@H]3CCS(=O)(=O)C3)nc21,C58669189_decoy,CASP3,Decoy,0,-7.76769,-7.09,-1.08,-6.009463885578258
CCCn1c2ccccc2c2nnc(S[C@H](C)C(=O)N(CC)[C@H]3CCS(=O)(=O)C3)nc21,C58669196_decoy,CASP3,Decoy,0,-7.93693,-5.81,-2.37,-6.217715769073963
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCN(C(=O)C(C)(C)C)CC2)cc1OC,C58702525_decoy,CASP3,Decoy,0,-7.95334,-6.36,-3.38,-6.426741712180088
CN(CCOc1ccc(Br)cc1)C(=O)Cn1cc(Br)c([N+](=O)[O-])n1,C59741027_decoy,CASP3,Decoy,0,-6.68899,-6.51,-0.77,-5.082663339773786
O=C(OCC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccc(Cn2cncn2)cc1,C21921563_decoy,CASP3,Decoy,0,-7.11135,-7.14,-4.23,-6.054805420444214
COc1ccc(CC(=O)N2CCN(C(=O)[C@H]3C=C(c4ccc(Cl)cc4)N=N3)CC2)cc1OC,C63562171_decoy,CASP3,Decoy,0,-7.44487,-3.01,-1.92,-4.268018998623106
CCOC(=O)Cn1c2c(sc1=O)C(C)(C)[C@H]1C(=O)N(c3ccc(OC)cc3)C(=O)[C@H]1S2,C15087761_decoy,CASP3,Decoy,0,-7.40996,-6.16,-1.16,-6.383852813475211
COc1cc([C@H]2S[C@@H](C)C(=O)N2c2c(C)n(C)n(-c3ccccc3)c2=O)cc(OC)c1OC,C08716643_decoy,CASP3,Decoy,0,-7.50461,-6.11,-4.21,-5.649116841546157
Cc1cc(C(=O)CSc2nnc(C)n2C2CC2)c(C)n1-c1c(C)n(C)n(-c2ccccc2)c1=O,C09335730_decoy,CASP3,Decoy,0,-8.24924,-8.35,-1.5,-10.100177354243751
CCn1c(CN2CCCCCC2=O)nnc1SCC(=O)N1CCN(c2ccccc2F)CC1,C09208866_decoy,CASP3,Decoy,0,-8.31086,-6.34,-1.4,-5.7225421658068
Cc1ccnc(SCc2cc(=O)c(OC(=O)[C@H]3CC(=O)N(c4ccc(C)c(C)c4)C3)co2)n1,C09829335_decoy,CASP3,Decoy,0,-9.51484,-7.85,-1.56,-6.16008419377123
CN(Cc1ccc2c(c1)OCCO2)C(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1,C09950147_decoy,CASP3,Decoy,0,-8.56542,-6.26,-0.8,-6.5113507176353504
COc1cc2c(cc1OC)CN(C(=O)CSc1ncnc3c1cnn3-c1ccccc1)CC2,C09951169_decoy,CASP3,Decoy,0,-7.18525,-7.22,-1.11,-7.400611886207872
Cn1c(SCC(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)nnc1-c1cccs1,C10710724_decoy,CASP3,Decoy,0,-10.0351,-6.57,-1.19,-7.338406243937828
Cc1cc(C(=O)COC(=O)c2cccc(S(C)(=O)=O)c2)c(C)n1-c1ccc2c(c1)OCCO2,C11318592_decoy,CASP3,Decoy,0,-9.47073,-7.48,-1.93,-7.496259240781425
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)Cc1cccc(C)c1)CC2,C11840937_decoy,CASP3,Decoy,0,-8.38627,-6.54,-2.08,-6.669607044122416
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)CCc1cccs1)CC2,C11912354_decoy,CASP3,Decoy,0,-7.53461,-6.15,-3.86,-6.344793035368629
CN(CCc1ccccn1)C(=O)c1cnn(-c2nccc(-c3cc4ccccc4o3)n2)c1C1CC1,C12457243_decoy,CASP3,Decoy,0,-7.26016,-6.94,-1.55,-5.212559335447343
COCCN1C(=O)C[C@@H](C(=O)OC)C12CCN(C(=O)c1csc(-c3cccs3)n1)CC2,C12510096_decoy,CASP3,Decoy,0,-8.36207,-5.27,-0.68,-6.525496247479847
Cc1occc1-c1nnc(SCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)n1C,C09336126_decoy,CASP3,Decoy,0,-7.36272,-8.47,-1.82,-7.022480868698794
CN(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=O)c1cccc(-n2cnnn2)c1,C12770770_decoy,CASP3,Decoy,0,-7.11188,-8.26,-2.59,-6.496844648157739
COc1ccc(-c2ccnc(-n3ncc(C(=O)N(C)CCc4ccccn4)c3C3CC3)n2)cc1F,C12152815_decoy,CASP3,Decoy,0,-8.67343,-6.63,-1.74,-5.815604459917553
CC(=O)c1ccc(C(=O)N2CCc3c(c(C(=O)N(C)Cc4cscn4)nn3CC3CC3)C2)s1,C14543026_decoy,CASP3,Decoy,0,-8.71733,-5.68,-2.31,-6.3171698111828745
COC(=O)c1c(OC[C@@H]2CCCCO2)cc(=O)n2c1CCN(C(=O)Cc1cccc(F)c1F)CC2,C14964356_decoy,CASP3,Decoy,0,-8.36258,-7.05,-1.58,-7.148091018124338
CCCN(Cc1cccn1Cc1ccc(C(=O)N2CCN(C(C)=O)CC2)o1)C(=O)C1CCCC1,C16533911_decoy,CASP3,Decoy,0,-7.96621,-6.8,-1.99,-7.037136588148732
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1cnc(SC)n1-c1ccccc1)CC2,C19182340_decoy,CASP3,Decoy,0,-9.1857,-7.67,-1.06,-7.570679666082889
CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nnc(N2CCOCC2)n1-c1ccccc1,C19355720_decoy,CASP3,Decoy,0,-8.88259,-7.2,-1.65,-7.27867386123671
CN(C)c1ccc([C@H](c2nnnn2C[C@H]2CCCO2)N2CCN(c3ccccc3F)CC2)cc1,C13504436_decoy,CASP3,Decoy,0,-7.4759,-7.43,-3.68,-6.015764636426023
CN(C)c1ccc([C@@H](c2nnnn2C[C@H]2CCCO2)N2CCN(c3ccccc3F)CC2)cc1,C13504437_decoy,CASP3,Decoy,0,-8.55152,-8.02,-1.83,-8.177259370676719
COCCN1CCN(C(=O)c2cnn(-c3ncc(C)c(-c4ccc(F)cc4)n3)c2C(C)C)CC1,C20351193_decoy,CASP3,Decoy,0,-7.16773,-6.54,-1.7,-5.331231761350349
C[C@@H]1C[C@H](C)CN(C(=O)CSc2nnc(CN(c3ccc(F)cc3)S(C)(=O)=O)n2C)C1,C20416313_decoy,CASP3,Decoy,0,-8.39711,-7.5,-4.59,-7.608787470629817
Cc1ccccc1OCCOC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1,C21441579_decoy,CASP3,Decoy,0,-8.09679,-5.66,-3.24,-5.750322677509367
CCCN(Cn1nc2n(CCC(C)C)c(=O)c3ccccc3n2c1=S)[C@H]1CCS(=O)(=O)C1,C12515347_decoy,CASP3,Decoy,0,-7.82565,-7.78,-3.27,-7.696865728107568
Cc1ccc(N(CC(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)S(C)(=O)=O)c(C)c1,C22328137_decoy,CASP3,Decoy,0,-7.12605,-7.47,-1.39,-7.801844053986499
COc1ccc(COC(=O)c2cc(C3CC3)nc3c2c(C)nn3[C@H]2CCS(=O)(=O)C2)cc1F,C23264878_decoy,CASP3,Decoy,0,-8.05187,-7.27,-0.58,-6.159803118458553
Cn1c(SCC(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)nnc1-c1ccc(C(C)(C)C)cc1,C24142680_decoy,CASP3,Decoy,0,-8.72216,-6.83,-2.24,-5.668120442959329
COc1cc(CN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)C2CC2)ccc1OC(F)F,C24749798_decoy,CASP3,Decoy,0,-8.21419,-6.77,-1.43,-6.581826866287391
COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(-n5c(C)ccc5C)cc4)CC3)n2)cc1,C25010642_decoy,CASP3,Decoy,0,-8.3651,-7.81,-2.83,-5.308277282345864
CCCn1c(=O)n(C)c(=O)c2c(SCCS(=O)(=O)c3ccccc3)nc(C(C)C)nc21,C32865380_decoy,CASP3,Decoy,0,-8.30445,-6.91,-1.6,-6.941241210436416
CCSc1nnc(-c2nn(C)c3c2CN(S(=O)(=O)c2cc(F)ccc2C)CC3)n1CC,C33287974_decoy,CASP3,Decoy,0,-8.09083,-6.5,-3.7,-6.532949260720819
COc1ccc(-c2csc(CCn3nnnc3[C@@H](c3ccccc3)N3CCOCC3)n2)cc1,C01414983_decoy,CASP3,Decoy,0,-7.14715,-5.82,-1.85,-5.702086769564614
N#CC(C#N)=C(SCC(=O)c1ccc2c(c1)OCO2)SCC(=O)c1ccc2c(c1)OCO2,C34943920_decoy,CASP3,Decoy,0,-8.6275,-6.51,-1.63,-7.226704038127579
Cc1nnc(SCCCCC(=O)N2CCN(C(=O)c3ccco3)[C@@H](C)C2)n1-c1ccccc1,C35128546_decoy,CASP3,Decoy,0,-7.66849,-7.04,-2.02,-8.345291221455225
Cc1nc(C)c(C(=O)OC(C)C)c(C(=O)N2CCN(C(=O)[C@H](Cl)c3ccccc3)[C@H](C)C2)n1,C35174228_decoy,CASP3,Decoy,0,-7.5672,-6.07,-2.95,-5.802512753541875
C=CCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C35485971_decoy,CASP3,Decoy,0,-7.51455,-7.19,-3.03,-6.884532509288261
CCn1c(CN(c2ccccc2)S(C)(=O)=O)nnc1SCC(=O)N1[C@H](C)CCC[C@H]1C,C36086239_decoy,CASP3,Decoy,0,-8.39893,-6.56,-3.6,-6.257424804511124
O=C(CSc1ncnc2c1nnn2Cc1ccccc1F)N1CCN(c2ccccc2)CC1,C04056938_decoy,CASP3,Decoy,0,-8.76397,-7.58,-1.23,-7.13120010455071
CC(=O)c1ccc(-c2ccc(C(=O)OCC(=O)N(C3CCCC3)[C@H]3CCS(=O)(=O)C3)o2)cc1,C19297589_decoy,CASP3,Decoy,0,-8.54722,-8.71,-1.3,-7.069882909651112
CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2nn([C@@H]3CCS(=O)(=O)C3)c3c2CCCC3)cc1,C40987862_decoy,CASP3,Decoy,0,-9.45765,-6.22,-2.1,-7.284764566731692
Cc1nn(-c2ccc(C(=O)OCC(=O)N(C3CCCC3)[C@@H]3CCS(=O)(=O)C3)cc2)c(C)c1Cl,C17534224_decoy,CASP3,Decoy,0,-10.8434,-7.52,-1.27,-8.012900428973403
CCOc1cc(/C=C/C(=O)N2CCN(Cc3nnc4n3CCCCC4)CC2)cc(Cl)c1OC,C45865055_decoy,CASP3,Decoy,0,-8.78061,-8.46,-1.72,-7.105649422586669
CCN(Cc1ccc2c(c1)OCCO2)C(=O)CSc1nnc(N2CCC(C)CC2)n1C1CC1,C21700500_decoy,CASP3,Decoy,0,-8.51838,-7.13,-2.29,-6.477161172639247
COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)/C=C/c2ccccc2Cl)CC1,C58948443_decoy,CASP3,Decoy,0,-7.05023,-7.85,-2.52,-5.498230122880587
COc1cc(C(=O)/C=C/c2cnc3c(c2)c(C)nn3[C@H]2CCS(=O)(=O)C2)ccc1OC(F)F,C62590188_decoy,CASP3,Decoy,0,-8.50307,-8.48,-1.05,-9.614265213600875
COc1cc(/C=C2\Oc3c4c(cc(C)c3C2=O)OCN(Cc2ccncc2)C4)cc(OC)c1OC,C41645446_decoy,CASP3,Decoy,0,-8.33546,-7.2,-1.43,-7.07324155406454
COc1ccc(OC)c(C2=C[C@H](C(=O)N3CCN(C(=O)[C@@H]4C[C@@H]4c4cccs4)CC3)N=N2)c1,C64415280_decoy,CASP3,Decoy,0,-6.76948,-7.88,-2.12,-6.164354198829656
CCCn1cc(C(=O)N2CCC[C@H](C)C2)c(S(=O)(=O)N2CCN(c3ccc(Cl)cc3)CC2)n1,C67337810_decoy,CASP3,Decoy,0,-9.12234,-6.44,-2.63,-6.863092593606601
C=CCc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(OCC)c1OCC(=O)[O-],C02099757_decoy,CASP3,Decoy,0,-6.63378,-5.37,-1.11,-6.697637406429686
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCC(C(=O)N[C@H](C(=O)[O-])C(C)C)CC2)cc1,C02432410_decoy,CASP3,Decoy,0,-7.00765,-6.39,-1.7,-8.21616635257553
CC(=O)OC[C@H]1O[C@@H](n2cnc3c([S-])nc(N)nc32)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C08638131_decoy,CASP3,Decoy,0,-8.52068,-5.32,-1.33,-4.825557177601816
CCCc1nnc(SCC(=O)N[C@]2(C)CCS(=O)(=O)C2)n1CC(=O)[O-],C13203331_decoy,CASP3,Decoy,0,-7.39803,-6.49,-1.59,-6.353704293824384
Cc1ccccc1CN(C)C(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13235867_decoy,CASP3,Decoy,0,-7.33129,-7.93,-1.52,-7.885231731965178
Cc1ccc(CN(C)C(=O)CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])o1,C13236586_decoy,CASP3,Decoy,0,-5.6469,-7.5,-2.68,-6.244007361512312
Cc1ccc(CN(C)C(=O)CNC(=O)N[C@@H](CC(=O)N2CCCC2)C(=O)[O-])cc1,C13245185_decoy,CASP3,Decoy,0,-7.52793,-7.75,-2.77,-7.511435893219565
O=C(NCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)N[C@H](CC(=O)N1CCCC1)C(=O)[O-],C13245629_decoy,CASP3,Decoy,0,-8.88557,-8.3,-1.94,-7.449106033312494
O=C(NCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1)N[C@@H](CC(=O)N1CCCC1)C(=O)[O-],C13245636_decoy,CASP3,Decoy,0,-9.23909,-7.45,-1.85,-8.671930547226927
Cn1c(C[C@@H]2CCS(=O)(=O)C2)nnc1Sc1ccc(C(=O)NCC(=O)[O-])cc1[N+](=O)[O-],C13273447_decoy,CASP3,Decoy,0,-5.85931,-7.54,-2.33,-8.018485196447491
COc1ccc(CN(C)c2ccc(C(=O)N[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])cc1,C13299398_decoy,CASP3,Decoy,0,-6.40316,-6.69,-1.49,-6.05871050918956
CCOc1cc(/C=C2/SC(=S)N(NC(=O)c3cccnc3)C2=O)ccc1OCC(=O)[O-],C16915858_decoy,CASP3,Decoy,0,-8.18195,-6.13,-2.59,-6.221762307898146
CCOc1cc(/C=C2/SC(=S)N(NC(=O)c3cccnc3)C2=O)ccc1O[C@@H](C)C(=O)[O-],C16917111_decoy,CASP3,Decoy,0,-7.9155,-5.82,-1.49,-6.2118824348593575
CCOc1cc(/C=C2/SC(=S)N(NC(=O)c3cccnc3)C2=O)ccc1O[C@H](C)C(=O)[O-],C16917117_decoy,CASP3,Decoy,0,-8.0034,-5.57,-1.62,-5.475310048796189
COc1cc2c(cc1OC)[C@H](O)[C@@](O)(CO)[C@H](C(=O)[O-])[C@H]2c1cc(OC)c(OC)c(OC)c1,C16990727_decoy,CASP3,Decoy,0,-7.51838,-5.66,-1.39,-6.4737162588231145
COC(=O)/C=C(\Nc1ccc(S(=O)(=O)[N-]c2nc(C)cc(C)n2)cc1)C(N)=O,C21946017_decoy,CASP3,Decoy,0,-9.45554,-6.23,-0.97,-7.098674590894624
COc1ccc(C2=NN(C3=NC(=O)[C@@H](CC(=O)NCC(=O)[O-])S3)[C@@H](c3cccs3)C2)cc1,C28158804_decoy,CASP3,Decoy,0,-9.44334,-7.86,-1.54,-7.714285570525252
COc1ccccc1O[C@@H]1O[C@H]2CO[C@@H](c3ccco3)O[C@@H]2[C@H](O[C@@H](C)C(=O)[O-])[C@@H]1NC(C)=O,C35057215_decoy,CASP3,Decoy,0,-7.16967,-7.76,-1.96,-10.199450104020448
COc1ccccc1O[C@H]1O[C@@H]2CO[C@H](c3ccco3)O[C@@H]2[C@@H](OCC(=O)[O-])[C@@H]1NC(C)=O,C35057905_decoy,CASP3,Decoy,0,-6.10673,-6.56,-1.35,-6.568178590155324
COc1ccc(O[C@H]2O[C@@H]3CO[C@H](c4ccco4)O[C@@H]3[C@H](OCC(=O)[O-])[C@H]2NC(C)=O)cc1,C35057919_decoy,CASP3,Decoy,0,-6.5708,-5.8,-1.18,-4.756533195754788
CC(=O)N[C@H]1[C@@H](Oc2ccccc2C(C)=O)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1OCC(=O)[O-],C35058017_decoy,CASP3,Decoy,0,-7.48265,-6.09,-0.5,-6.76998316651674
COc1ccc2c(c1)c([C@H](C(=O)[O-])[NH+]1CCN(Cc3c(C)noc3C)CC1)cn2CC(=O)[O-],C36359558_decoy,CASP3,Decoy,0,-6.64894,-6.28,-1.7,-6.187897058472907
C=CCn1c(CC2=CS[C@@H](NC(=O)CN3C(=O)N[C@@](C)(C4CC4)C3=O)[N-]2)n[nH]c1=S,C38798745_decoy,CASP3,Decoy,0,-8.78606,-6.85,-2.24,-6.2312067184604825
C=CCn1c(CC2=CS[C@@H](NC(=O)CN3C(=O)N[C@](C)(C4CC4)C3=O)[N-]2)n[nH]c1=S,C38798746_decoy,CASP3,Decoy,0,-9.12943,-6.32,-3.16,-8.7269153287427
CCOC(=O)[C@H]1[C@@H](C)[C@H](C(C)=O)S[C@@H]1NC(=O)CSc1nnc(C)c([O-])n1,C39403911_decoy,CASP3,Decoy,0,-8.38296,-6.72,-0.82,-6.729434153132397
COc1cc(OC)c([C@H]2[C@@H]3N=CN=C3C[C@H](C(=O)[O-])N2C(=S)Nc2ccccc2)cc1OC,C39546381_decoy,CASP3,Decoy,0,-6.7297,-6.68,-2.3,-6.377444184160097
CCn1c(CCC(N)=O)nnc1SCC1=NC(=O)C2=C(C)[C@H](C(=O)[O-])SC2=N1,C39639655_decoy,CASP3,Decoy,0,-8.21981,-7.08,-2.34,-7.100930734526146
COCCNc1nnc(SCC2=NC(=O)C3=C(C(=O)[O-])[C@H](C)OC3=N2)s1,C39680341_decoy,CASP3,Decoy,0,-7.65624,-5.2,-2.14,-5.129816368893034
O=C(CS[C@H]1NN=CN1c1ccccc1F)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39692545_decoy,CASP3,Decoy,0,-7.31717,-7.49,-1.23,-6.671432341702697
O=C(CS[C@@H]1Nc2ccccc2C(=O)N1C1CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39692984_decoy,CASP3,Decoy,0,-8.51402,-7.32,-0.66,-6.106002171639318
COc1cc(/C=N/N=C2/S[C@@H](CC(=O)NCC(=O)[O-])C(=O)N2c2ccc(O)cc2)ccc1O,C39769064_decoy,CASP3,Decoy,0,-9.13918,-5.96,-0.6,-7.285799792429088
COc1cc(/C=C2\SC(=S)N([C@H](CC(N)=O)C(=O)[O-])C2=O)cc(OC)c1OC,C39862014_decoy,CASP3,Decoy,0,-8.109,-6.1,-1.68,-7.431076743825565
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccncc2)s1,C40098747_decoy,CASP3,Decoy,0,-8.71323,-5.19,-2.15,-5.2455452181036
CC[C@@H](C)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cc(OC)cc(OC)c2C(=O)OC)[C@H]2C([O-])=NC(=O)[C@@H]21,C43221722_decoy,CASP3,Decoy,0,-5.88046,-6.29,-1.98,-4.748390414323133
CC(=O)OC[C@H]1O[C@@H](n2cnc3c([S-])nc(N)nc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C44608226_decoy,CASP3,Decoy,0,-8.93531,-5.63,-3.97,-5.374459006970286
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2[O-])no1,C10158682_decoy,CASP3,Decoy,0,-7.49661,-7.15,-1.37,-7.531627403432711
CCn1c(CCC(N)=O)nnc1SCc1nc2sc(C(=O)[O-])c(C)c2c(=O)[nH]1,C13035951_decoy,CASP3,Decoy,0,-8.41193,-7.9,-1.66,-7.498398783687469
CCOc1cc(/C=C2\SC(=S)N(CC(=O)NCCC(=O)[O-])C2=O)ccc1O,C15036476_decoy,CASP3,Decoy,0,-8.47468,-7.25,-0.61,-12.256228538721324
O=C([O-])CCCNC(=O)CN1C(=O)S/C(=C\c2ccc([N+](=O)[O-])cc2)C1=O,C47152490_decoy,CASP3,Decoy,0,-6.41374,-7.77,0.14,-6.128083023359584
C=CCn1c(Cn2nnc3ccccc32)nnc1SC/C([O-])=N/c1ncn[nH]1,C59265427_decoy,CASP3,Decoy,0,-7.7383,-7.11,-2.07,-6.97559358930557
COC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@@H]1c1cc(OC)c(OC)c(OC)c1,C59293879_decoy,CASP3,Decoy,0,-7.76492,-6.06,-1.04,-7.159847691823656
COC(=O)C1=C(N)N2C(=O)[C@@H](CC(=O)[O-])SC2=C(C#N)[C@H]1c1cc(OC)c(OC)c(OC)c1,C59293880_decoy,CASP3,Decoy,0,-7.94623,-5.41,-1.87,-7.054668904362248
CS(=O)(=O)[N-]c1ccc(-c2csc(NC(=O)CCc3nc(-c4nc[nH]n4)no3)n2)cc1,C60297581_decoy,CASP3,Decoy,0,-9.84447,-6.49,-2.88,-6.270097722313241
Cc1ccn2c(CC(=O)N[C@@H](CCC(N)=O)C(=O)[O-])c(-c3ccc(C)c(C)c3)nc2c1,C62049321_decoy,CASP3,Decoy,0,-9.28723,-6.57,-3.39,-7.318308263597338
COc1cc(NC(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)[O-])c(C(=O)[O-])cc1OC,C63373544_decoy,CASP3,Decoy,0,-6.00732,-6.81,-1.96,-6.467123443540367
CS(=O)(=O)c1ccc(OCCCCC(=O)Nc2nc(C#N)c(C#N)[n-]2)cc1,C63466380_decoy,CASP3,Decoy,0,-7.47932,-5.3,-1.69,-5.212941714960961
COCCCN1C(=O)c2cc3c(cc2N[C@H]1SC/C([O-])=N/c1ncn[nH]1)OCO3,C63763327_decoy,CASP3,Decoy,0,-8.81806,-6.81,-1.04,-8.064234971698042
CCCS(=O)(=O)[N-]c1cccc(C(=O)Nc2cnn(CC(=O)N(C)C)c2)c1,C66672788_decoy,CASP3,Decoy,0,-7.64749,-5.5,-0.25,-6.013673650972133
CN(CCc1ccccn1)C(=O)CNC(=O)c1ccccc1[N-]S(C)(=O)=O,C66747420_decoy,CASP3,Decoy,0,-8.56604,-7.23,-2.37,-7.039474326978167
CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(NC(C)=O)ccc1[N-]S(C)(=O)=O,C67044246_decoy,CASP3,Decoy,0,-7.46503,-6.08,-0.91,-6.2717461405241535
CC(=O)Oc1ccc2c(c1)CC[C@H]1[C@H]3CCC(=O)[C@]3(C)C[C@@H](OC(C)=O)[C@]21O,C05007197_decoy,CASP3,Decoy,0,-7.89562,-6.66,-0.97,-6.13542210620475
Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@]12CC[C@](C)(C(=O)C1)C2(C)C,C04185869_decoy,CASP3,Decoy,0,-8.1577,-6.59,-2.72,-6.871634208799799
Cc1cccc(C(=O)Nc2nnc([C@@H]3CC(=O)N(c4ccccc4C)C3)s2)c1,C09197957_decoy,CASP3,Decoy,0,-7.31238,-7.0,-0.9,-5.125382688710433
O=C(N[C@@H]1CCCc2c1cnn2-c1ccccn1)c1ccccc1N1CCCC1,C11667798_decoy,CASP3,Decoy,0,-7.63113,-7.05,-1.48,-7.641580545922773
CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)Cc2cccs2)C1,C12744391_decoy,CASP3,Decoy,0,-8.501,-5.8,-0.77,-7.114452552227888
Cc1ccc(-c2csc(NC(=O)[C@H]3CCCN(C(=O)c4ccoc4)C3)n2)cc1,C12945706_decoy,CASP3,Decoy,0,-8.13687,-6.59,-2.83,-5.127896221287005
CCNC(=O)C1CCN(C2=NS(=O)(=O)C(c3ccc(Cl)cc3)=C2C)CC1,C15732999_decoy,CASP3,Decoy,0,-7.64379,-6.17,-0.34,-5.755596917019068
C[C@@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1,C16827730_decoy,CASP3,Decoy,0,-7.95362,-7.33,-2.7,-6.088120860989905
O=C1CCCC2=C1[C@@H](c1ccsc1)n1nc(SCc3cccnc3)nc1N2,C18200063_decoy,CASP3,Decoy,0,-8.86679,-6.24,-1.3,-6.46615419767788
CC[C@@H]1C[C@H](C(F)(F)F)n2nc([C@@H]3CCCN3C(=O)c3ccncc3)cc2N1,C19520757_decoy,CASP3,Decoy,0,-7.12641,-6.62,-0.96,-6.138312167308339
COc1cc(Oc2c(OC)ccc3c2CN(C)CC3)c2c(c1O)CN(C)CC2,C24717716_decoy,CASP3,Decoy,0,-8.52477,-6.8,-1.45,-6.544045603675802
Cc1ccnc(NC(=O)[C@@H](C)n2nc(C(F)(F)F)c(Br)c2C)n1,C27936502_decoy,CASP3,Decoy,0,-6.32426,-5.33,-2.5,-4.933877814950604
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)N3CCOC[C@@H]3C)cc2)c1,C29923569_decoy,CASP3,Decoy,0,-7.49894,-7.44,-1.18,-6.545109979365284
Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)c1[nH]c2c(c1C)C(=O)CCC2,C31492869_decoy,CASP3,Decoy,0,-6.93126,-7.13,-2.37,-7.500474631046838
Cc1ccc(S(=O)(=O)N/N=C\c2c(Br)nc3n2CCS3)cc1,C17121241_decoy,CASP3,Decoy,0,-10.3192,-5.57,-1.02,-5.965788441100264
CCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2)s1,C31816521_decoy,CASP3,Decoy,0,-8.91971,-5.48,-0.76,-5.973323100762432
Cc1cccc(NC(=O)c2cc(-c3cccs3)n([C@H]3CCS(=O)(=O)C3)n2)c1,C33325426_decoy,CASP3,Decoy,0,-9.40248,-6.56,-0.78,-8.816680181904136
CCOC(=O)[C@@H]1CS[C@]2(C(=O)Nc3ccccc32)N1C(=O)c1ccc(F)cc1,C35743780_decoy,CASP3,Decoy,0,-6.24104,-6.2,-1.16,-6.054824165450151
Cc1nc(C)c2c(C)c(C(=O)N[C@H](c3ccccc3)c3nccn3C)sc2n1,C36718583_decoy,CASP3,Decoy,0,-8.52375,-6.38,-1.74,-5.707281497303433
O=C(CN1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1C=C[C@H]2C1)Nc1nc(-c2cccs2)cs1,C36798871_decoy,CASP3,Decoy,0,-7.63606,-5.57,-3.29,-4.75813123080148
COc1cc(C)c(C)cc1S(=O)(=O)Nc1cc2c3c(c1)CCN3C(=O)CC2,C38680621_decoy,CASP3,Decoy,0,-7.44888,-7.26,-3.1,-5.233270059831463
CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)Cn2cc(NC(=O)c3ccsc3)cn2)C1,C11871608_decoy,CASP3,Decoy,0,-8.95815,-5.72,-1.99,-6.26028335006718
CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccc(N4CCCC4)cc32)cc1,C41121179_decoy,CASP3,Decoy,0,-6.81677,-6.49,-1.2,-5.65007450580706
C[C@@H](Sc1ncnc2ccsc12)C(=O)Nc1ccc2c(c1)OCCCO2,C42603422_decoy,CASP3,Decoy,0,-8.03593,-6.68,-0.54,-5.985977861125989
CC(=O)c1csc(NC(=O)c2cnn(-c3ccc(Br)cc3)c2)n1,C44361088_decoy,CASP3,Decoy,0,-6.79376,-5.24,-1.34,-6.3116448689911255
CCCNC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCCc3c(F)cc(F)cc32)C1,C51837081_decoy,CASP3,Decoy,0,-6.3306,-6.36,-0.7,-6.135976736103279
CN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1cn(CCC#N)nc1-c1ccccc1,C54428071_decoy,CASP3,Decoy,0,-8.39382,-6.06,-2.58,-5.818715100621529
CNS(=O)(=O)c1cc(C(=O)N2CCN(c3ccccc3)CC2)cc(C)c1C,C19168946_decoy,CASP3,Decoy,0,-7.60601,-5.14,-0.91,-5.449998588453965
Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H]2CCS(=O)(=O)C2)c1,C17635737_decoy,CASP3,Decoy,0,-6.25309,-7.87,-2.94,-5.546162247367176
Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2I)cn1,C57825535_decoy,CASP3,Decoy,0,-6.67993,-4.97,-2.08,-5.376763534991452
Cc1nccn1-c1ccc(CNC(=O)c2cc(Cl)c3c(c2)OCO3)cc1F,C58356527_decoy,CASP3,Decoy,0,-7.03152,-7.76,-1.17,-5.924928134754098
CC(C)c1cccc(C(C)C)c1NC(=O)N1CCN(C(=O)c2ccco2)CC1,C58828758_decoy,CASP3,Decoy,0,-7.47595,-5.55,-1.78,-5.775663829961412
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCOCC2(C)C)ccc1Cl,C60542723_decoy,CASP3,Decoy,0,-6.58695,-7.09,-2.96,-6.806782846511261
CCC(=O)N1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc3c(c2)COC3)cs1,C61337850_decoy,CASP3,Decoy,0,-7.88146,-7.88,-1.21,-6.46618501056337
O=C(Nc1nnc(C2CCC2)s1)c1cc(-c2ccncc2)nc2ccccc12,C61718441_decoy,CASP3,Decoy,0,-7.36948,-7.92,-2.32,-6.440722564310939
O=C(NC1CCCCC1)[C@@H]1CCCN1C(=O)[C@H]1CC(=O)N(C2CCCCC2)C1,C62435832_decoy,CASP3,Decoy,0,-7.46372,-7.04,-1.1,-7.714981114202024
Cc1csc(N2CCCN(C(=O)N[C@H]3CCN(CC(F)(F)F)C3)CC2)n1,C64252589_decoy,CASP3,Decoy,0,-8.02592,-6.28,-2.69,-6.038684676405801
COC(=O)[C@]1(C)N[C@@H](c2cccs2)[C@H]2C(=O)N(c3ccccc3F)C(=O)[C@H]21,C19460701_decoy,CASP3,Decoy,0,-7.1616,-5.91,-0.6,-5.148783663744781
COc1ccc([C@@H]2CC(=O)Nc3c2cnn3-c2ccc(Cl)cc2)cc1OC,C65331290_decoy,CASP3,Decoy,0,-7.37102,-6.99,-1.33,-6.712176860804683
Cc1nc(NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c2cnn(C)c2n1,C54981481_decoy,CASP3,Decoy,0,-7.91739,-6.29,-1.43,-7.201110936533731
Cc1cccc(N(C)C(=O)C(=O)N2CCC(NC(=O)c3ccc(C)s3)CC2)c1,C66219471_decoy,CASP3,Decoy,0,-8.0395,-6.91,-2.38,-5.948533581024014
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1cnn(C)c1C(F)F,C66340226_decoy,CASP3,Decoy,0,-6.88333,-6.5,-2.76,-6.059931501274085
Cc1ccccc1[C@H](C#N)NC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O,C66406365_decoy,CASP3,Decoy,0,-6.38519,-6.76,-1.88,-5.5193910477073125
CNC(=O)[C@H]1CN(S(=O)(=O)/C=C/c2ccccc2Cl)c2ccccc2O1,C66579715_decoy,CASP3,Decoy,0,-8.2998,-6.49,-1.29,-5.99836060555968
Cc1ccc(S(=O)(=O)Nc2cc(N3C(=O)CCC3=O)ccc2C)cc1Cl,C66585779_decoy,CASP3,Decoy,0,-7.93407,-5.89,-2.92,-6.271210517562612
O=C([C@H](c1ccccc1)N1CCCCC1=O)N1CCN(c2ccc(O)cc2)CC1,C66618383_decoy,CASP3,Decoy,0,-8.54483,-7.52,-2.76,-6.405332306847856
CS(=O)(=O)C1(C(=O)Nc2ccnn2[C@H]2CCCc3ccccc32)CCCC1,C66672395_decoy,CASP3,Decoy,0,-8.07033,-5.8,-1.2,-5.809021802292492
Cc1ccc(C(=O)N2CCC(NC(=O)[C@@H]3CC(c4ccccc4)=NO3)CC2)cc1,C66676868_decoy,CASP3,Decoy,0,-6.89333,-6.43,-1.54,-5.107951106421122
O=C(Nc1ccc(C(=O)N2CCC[C@@H](c3nccs3)C2)s1)c1ccco1,C67048812_decoy,CASP3,Decoy,0,-8.62948,-6.63,-1.58,-8.273847871233567
CSc1ccccc1NC(=O)C(=O)N1CCC[C@@H]1c1cccc2c1OCCO2,C67598874_decoy,CASP3,Decoy,0,-7.97912,-6.83,-2.02,-6.92490173391701
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)[O-])=C(S[C@@H]3C[NH2+][C@H](C(=O)Nc4cccc(C(=O)[O-])c4)C3)[C@H](C)[C@H]12,C03918453_decoy,CASP3,Decoy,0,-8.21316,-7.66,0.15,-6.653847169771564
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,CASP3,Decoy,0,-8.12415,-5.21,-1.87,-6.622575584026572
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,C04557127_decoy,CASP3,Decoy,0,-6.44537,-5.95,-0.97,-5.456168524201156
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,C04557129_decoy,CASP3,Decoy,0,-6.96605,-7.29,-1.99,-6.971875754524135
O=C([O-])CCCC(=O)N1CCN(C(=O)NC2CCCCC2)C[C@H]1C(=O)N[C@H]1CCCNC1=O,C05415647_decoy,CASP3,Decoy,0,-7.29513,-5.97,-0.8,-5.897019581144588
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)Cn3cc([N+](=O)[O-])c(C)n3)[C@@H]2SC1,C08815655_decoy,CASP3,Decoy,0,-5.85759,-6.95,-0.8,-5.32329137267939
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C(=O)N3C(C(=O)[O-])=C(COC(C)=O)CS[C@@H]23)n1,C09201512_decoy,CASP3,Decoy,0,-7.13861,-6.27,-1.48,-7.3297254827667455
C[C@H](C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]12)n1cc([N+](=O)[O-])cn1,C09431550_decoy,CASP3,Decoy,0,-7.94568,-7.26,-0.72,-6.54750779121939
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]12)c1csc(N)n1,C03830414_decoy,CASP3,Decoy,0,-8.16682,-6.87,-2.52,-7.988372019302465
CC(C)Cn1c(SCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)nc2cc(C(=O)[O-])ccc2c1=O,C13048754_decoy,CASP3,Decoy,0,-8.00634,-7.37,-4.1,-6.741882758709491
Cc1cc(NC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C[C@H](C)O)no1,C13051579_decoy,CASP3,Decoy,0,-8.32944,-7.64,-2.22,-7.793920884322322
C[C@H](O)Cn1c(SCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)nc2cc(C(=O)[O-])ccc2c1=O,C13051783_decoy,CASP3,Decoy,0,-8.42204,-6.47,-0.64,-7.18310320494866
C[C@@H](O)Cn1c(SCC(=O)N2CCN(c3ncccn3)CC2)nc2cc(C(=O)[O-])ccc2c1=O,C13052315_decoy,CASP3,Decoy,0,-9.40435,-6.13,-1.22,-6.693726441889934
C[C@H](O)Cn1c(SCC(=O)N2CCN(c3ncccn3)CC2)nc2cc(C(=O)[O-])ccc2c1=O,C13052316_decoy,CASP3,Decoy,0,-9.26476,-7.38,-0.8,-6.967863488295404
C[C@@H](O)Cn1c(S[C@H](C)C(=O)NC(=O)NCc2ccco2)nc2cc(C(=O)[O-])ccc2c1=O,C13052519_decoy,CASP3,Decoy,0,-8.00865,-7.54,-1.57,-6.997113866981301
Cn1c(=O)[nH]c(=O)c2c1nc(SCC(=O)[O-])n2C[C@@H](O)Cc1ccc([N+](=O)[O-])cc1,C09009238_decoy,CASP3,Decoy,0,-7.89447,-6.23,-1.46,-6.96183710236077
Cc1nc2nc(SCC(=O)NC(=O)NC(C)(C)C)nn2c(C)c1CCC(=O)[O-],C13210005_decoy,CASP3,Decoy,0,-7.59581,-6.18,-0.21,-5.929102097903461
O=C([O-])C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NC[C@H]2CCCO2)CC1,C13210841_decoy,CASP3,Decoy,0,-6.07938,-7.77,-1.74,-7.239378319771157
Cc1nc2nc(SCC(=O)Nc3cc(C(N)=O)cc(C(N)=O)c3)nn2c(C)c1CC(=O)[O-],C13445354_decoy,CASP3,Decoy,0,-8.99686,-7.68,-0.92,-6.788460558947646
CCCC(=O)Nc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2OC(=O)CCC)c(=O)[nH]1,C13515952_decoy,CASP3,Decoy,0,-6.87372,-6.97,-2.38,-6.249988811709235
NS(=O)(=O)c1ccc(CCN(C(=O)/C=C/C(=O)[O-])[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1,C03668520_decoy,CASP3,Decoy,0,-10.3963,-7.0,-2.43,-8.5383973598563
CCn1cc(Cl)c(C(=O)N[C@H]2C(=O)N3C(C(=O)[O-])=C(COC(C)=O)CS[C@@H]23)n1,C16193264_decoy,CASP3,Decoy,0,-8.49499,-5.5,-2.74,-6.211261814336835
O=C([O-])/C(=N\Nc1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H](O)[C@@H](O)[C@H](O)CO,C16384608_decoy,CASP3,Decoy,0,-5.96551,-6.12,-2.05,-4.763405019092562
CCn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(COC(C)=O)CS[C@H]12,C17103257_decoy,CASP3,Decoy,0,-7.9425,-6.41,-1.75,-6.203830827036748
Cc1csc(NC(=O)CSc2nnc(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2N)n1,C20527413_decoy,CASP3,Decoy,0,-6.74663,-5.65,-1.24,-6.335028364937363
CN(CCCNC(=O)c1nc([O-])c2ccccc2n1)C(=O)c1ccc([N+](=O)[O-])o1,C22471448_decoy,CASP3,Decoy,0,-6.14602,-5.74,-3.14,-4.9973411215069365
CC(=O)Nc1ccc([C@H](O)/C(=N\NC(=O)c2ccncc2)c2nc3ccc([N+](=O)[O-])cc3nc2[O-])cc1,C05316204_decoy,CASP3,Decoy,0,-7.25976,-7.66,-1.73,-6.750742751113061
COc1ccc([C@H]2CC(c3ccc4c(c3)OCO4)=NN2C2=NC(=O)[C@H](CC(=O)NCC(=O)[O-])S2)cc1,C28159594_decoy,CASP3,Decoy,0,-8.86827,-8.04,-1.08,-7.982585877390069
Cc1ccc([N+](=O)[O-])cc1NC(=O)/C(=N/NC(=S)NN)[C@@H]1SC(=S)N=C1[O-],C17213189_decoy,CASP3,Decoy,0,-8.4178,-6.8,-1.92,-8.385608237966398
CS(=O)(=O)[N-]/[NH+]=C1/S[C@@H](c2ccc(N)cc2)NN1CCCS(=O)(=O)[O-],C33768560_decoy,CASP3,Decoy,0,-8.98611,-7.47,-2.06,-8.23217046561414
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,CASP3,Decoy,0,-7.88521,-7.98,-1.07,-7.462529859038912
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,CASP3,Decoy,0,-8.60007,-5.79,-0.85,-5.40925746339439
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)CSc3nnc(-c4ccco4)n3N)cc2)nc(C)n1,C02374244_decoy,CASP3,Decoy,0,-7.84282,-7.42,-1.77,-5.969356141944764
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(Cn3nnc(C)n3)CS[C@H]12)c1csc(N)n1,C04215263_decoy,CASP3,Decoy,0,-8.87107,-6.29,-2.41,-6.67954335303334
CC1=C(C#N)C(=O)N(CCO)C(=O)C1=NNc1ccc(S(=O)(=O)[N-]c2nccs2)cc1,C12466074_decoy,CASP3,Decoy,0,-9.38504,-7.74,-1.81,-7.306270027318135
C=CCN1[C@@H](SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)NN[C@H]1[C@@H]1CCS(=O)(=O)C1,C39639673_decoy,CASP3,Decoy,0,-9.45647,-7.54,-3.09,-8.070885636504007
C=CCn1c(SCc2nc3c(c(=O)[nH]2)[C@H](C(=O)[O-])[C@H](C)O3)nnc1-c1ccoc1C,C39691821_decoy,CASP3,Decoy,0,-6.75165,-7.15,-0.87,-6.065500928918034
CC(C)c1nnc(SCc2nc3c(c(=O)[nH]2)[C@@H](C(=O)[O-])[C@@H](C)O3)n1Cc1ccco1,C39693252_decoy,CASP3,Decoy,0,-8.73047,-7.83,-3.2,-7.466952973229725
[NH-]C1=NC(=O)C2=N[C@@H](NCCCN3CCOCC3)N([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)C2=N1,C39939260_decoy,CASP3,Decoy,0,-7.50092,-6.38,-0.26,-6.979514932841315
NC(=O)c1cc(NC(=O)c2ccc(Sc3ncn[n-]3)c([N+](=O)[O-])c2)cc(C(N)=O)c1,C41105338_decoy,CASP3,Decoy,0,-8.25678,-6.87,-0.9,-6.304269818620732
O=C([O-])C[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2C(=O)N(CCO)C(=O)[C@H]21,C33931573_decoy,CASP3,Decoy,0,-7.55811,-6.64,-0.2,-5.578896564011494
O=C([O-])CC(=O)OC[C@@H]1O[C@@H](Oc2cccc3c(=O)c(-c4ccc(O)cc4)coc23)[C@H](O)[C@H](O)[C@@H]1O,C43214527_decoy,CASP3,Decoy,0,-6.8363,-7.34,-3.5,-6.681429318087496
O=C([O-])CC(=O)OC[C@@H]1O[C@H](Oc2cccc3c(=O)c(-c4ccc(O)cc4)coc23)[C@@H](O)[C@H](O)[C@@H]1O,C43214528_decoy,CASP3,Decoy,0,-6.46701,-7.56,-1.32,-6.269685101491395
COc1cc([C@@H](O)/C(=N\NC(=O)c2ccncc2)c2nc3ccc([N+](=O)[O-])cc3nc2[O-])ccc1O,C05316133_decoy,CASP3,Decoy,0,-8.52244,-7.87,-1.79,-7.19491648052663
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,CASP3,Decoy,0,-9.19855,-7.96,-3.09,-7.728354386101492
C[C@@H](O)[C@@H]1C(=O)N2C(C(=O)[O-])=C(S[C@H]3C[NH2+][C@@H](C(=O)Nc4cccc(C(=O)[O-])c4)C3)[C@H](C)[C@@H]12,C43769661_decoy,CASP3,Decoy,0,-8.29188,-8.29,-2.59,-7.259489595203632
N#C/C(=C/Nc1ccc(S(=O)(=O)/N=C(/N)[O-])cc1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1,C09313243_decoy,CASP3,Decoy,0,-7.58339,-6.56,-3.59,-6.358408285318146
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(COC(C)=O)CS[C@H]12)c1cnc(N)[nH]1,C32911528_decoy,CASP3,Decoy,0,-8.01239,-7.06,-1.41,-7.006773619699222
C/C(CN1C(=O)CCC1=O)=N\NC(=O)/C=C(\[O-])N/N=C(\C)CN1C(=O)CCC1=O,C59502045_decoy,CASP3,Decoy,0,-7.99056,-6.53,-1.12,-6.101698047076917
CC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C65739443_decoy,CASP3,Decoy,0,-7.09936,-5.13,-1.12,-6.614210263036737
CCOC(=O)/C(C#N)=C/c1cn(CCC(=O)[O-])nc1-c1ccc(OC)c([N+](=O)[O-])c1,C03273769_decoy,CASP3,Decoy,0,-5.5869,-7.29,-1.9,-5.245360917780032
CCN(CC)c1ccc(/N=N/c2c([N+](=O)[O-])cccc2[N+](=O)[O-])c(S(=O)(=O)[O-])c1,C04523125_decoy,CASP3,Decoy,0,-5.4562,-5.83,-2.6,-5.047801464838181
CC(=O)OC[C@H]1O[C@@H](n2cnc3c([S-])ncnc32)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C08618835_decoy,CASP3,Decoy,0,-7.22623,-5.61,-1.26,-7.205335917602608
CC(=O)OC[C@H]1O[C@@H](c2nnn[n-]2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C12339479_decoy,CASP3,Decoy,0,-5.70557,-7.29,-0.71,-8.666951054504718
COc1cc([N+](=O)[O-])cc(/C=N/N(C)C2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c1[O-],C12414071_decoy,CASP3,Decoy,0,-7.39525,-6.31,-1.09,-5.1691621085237385
Cc1oc2ncn(CC(=O)c3cc(C)n(-c4cccc([N+](=O)[O-])c4)c3C)c(=O)c2c1C(=O)[O-],C13057239_decoy,CASP3,Decoy,0,-6.56549,-8.07,-1.83,-6.399801810063232
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Oc1cccc(-n2cnnn2)c1,C13071185_decoy,CASP3,Decoy,0,-7.1086,-6.63,-1.59,-5.729230835167981
CC(=O)N1CCN(C(=O)CSc2nc3nc(C)c(CCC(=O)[O-])c(C)n3n2)CC1,C13234557_decoy,CASP3,Decoy,0,-7.25912,-6.56,-1.82,-6.232491373598794
Cn1c(C[C@@H]2CCS(=O)(=O)C2)nnc1Sc1ccc(C(=O)[O-])cc1[N+](=O)[O-],C13273457_decoy,CASP3,Decoy,0,-4.4158,-6.78,-1.23,-5.707060634389385
O=C([O-])c1ccc(-n2ncc(Sc3nnnn3C[C@H]3CCCO3)c(Cl)c2=O)cc1,C13273584_decoy,CASP3,Decoy,0,-8.08555,-6.93,-0.95,-6.363279012104213
CC(C)n1nnnc1Sc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1,C13274875_decoy,CASP3,Decoy,0,-6.99991,-5.89,-2.99,-5.842497987675786
Cc1c(-n2nnnc2SCc2occc2C(=O)[O-])c(=O)n(-c2ccccc2)n1C,C13407370_decoy,CASP3,Decoy,0,-6.64093,-6.39,-0.58,-5.614265631056136
COc1cc([C@@H]2c3cc4c(c(OS(=O)(=O)[O-])c3C[C@@H]3COC(=O)[C@H]32)OCO4)cc(OC)c1OC,C16943447_decoy,CASP3,Decoy,0,-8.35539,-6.67,-1.45,-7.109560611769347
O=c1c2cn(C[C@@H]3CCCO3)cc(/C([O-])=N/c3ncc([N+](=O)[O-])s3)c-2nn1-c1ccccc1,C10697238_decoy,CASP3,Decoy,0,-7.59287,-6.14,-1.23,-6.56982974121812
CCOc1cc(/C=C(\C#N)C(=O)[O-])ccc1OCCn1c([N+](=O)[O-])cnc1C,C23738234_decoy,CASP3,Decoy,0,-7.28295,-6.91,-1.27,-7.616918689793265
COCCCn1c([O-])nnc1SCc1cc([N+](=O)[O-])cc2c1OCOC2,C24502528_decoy,CASP3,Decoy,0,-7.32581,-5.75,-0.58,-6.25932044577154
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N3CCCN(S(C)(=O)=O)CC3)cc2)cc1[N+](=O)[O-],C25460956_decoy,CASP3,Decoy,0,-5.92521,-7.59,-1.27,-8.515277806672753
CC(=O)OC[C@H]1O[C@@H](n2ccc([O-])cc2=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C05665313_decoy,CASP3,Decoy,0,-4.92382,-4.88,-0.79,-4.931617108404503
CC(=O)OC(OC(C)=O)[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3ccc(Cl)c(C(=O)[O-])c3)C(=O)[C@@H]12,C32138824_decoy,CASP3,Decoy,0,-8.02709,-6.95,-0.52,-6.9257882211885615
O=C([O-])COCC(=O)/N=C1\S[C@H]2CS(=O)(=O)C[C@H]2N1Cc1ccc2c(c1)OCO2,C32507744_decoy,CASP3,Decoy,0,-8.41759,-5.74,-1.28,-6.576282487828802
COC(=O)c1c(C)oc(C)c1S(=O)(=O)[N-]c1cccc(-c2nnnn2C2CC2)c1,C32833848_decoy,CASP3,Decoy,0,-6.34554,-6.78,-1.4,-5.585882961335643
COCCN1C(=O)C([O-])=C(C(=O)c2c(C)nc3ccccn23)[C@H]1c1ccc([N+](=O)[O-])cc1,C33814148_decoy,CASP3,Decoy,0,-7.25832,-6.08,-3.11,-6.574455925968668
O=C([O-])CCCN1C(=O)/C(=C\c2c(N3CCC4(CC3)OCCO4)nc3ccccn3c2=O)SC1=S,C34988084_decoy,CASP3,Decoy,0,-9.11617,-5.7,-1.48,-6.010131963383551
CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc4c(c3)OCCO4)[C@H]2c2ccncc2)nc1C,C35020514_decoy,CASP3,Decoy,0,-8.53614,-6.23,-1.05,-6.676284394791389
CCN(CC)C(=O)C1=C[C@@]2([N+](=O)[O-])CN(CC(=O)[O-])C[C@@]([N+](=O)[O-])(C1)C2,C36028934_decoy,CASP3,Decoy,0,-5.22166,-6.45,-0.69,-5.939311867915721
COC(=O)CSC1=C(C#N)[C@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)OC)C([O-])=N1,C09109047_decoy,CASP3,Decoy,0,-6.36896,-5.48,-3.4,-4.178517658274043
COC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3c(C)nc4ccccn34)[C@@H]2c2cccnc2)nc1C,C33813815_decoy,CASP3,Decoy,0,-8.46119,-6.76,-1.72,-6.782135727720928
CC1=C2C(=O)N=C(CSc3nnc(C[C@H]4CCS(=O)(=O)C4)n3C)N=C2S[C@H]1C(=O)[O-],C39639672_decoy,CASP3,Decoy,0,-9.41611,-7.57,-0.68,-6.804466388639901
CC1=C2C(=O)N=C(COc3cc(C(=O)[O-])cc(C(=O)[O-])c3)N=C2S[C@H]1C(=O)[O-],C39646727_decoy,CASP3,Decoy,0,-7.3892,-7.45,0.09,-6.698495050251831
C[C@@H]1OC2=NC(CSc3nnc(COc4ccc(Cl)cc4)n3C)=NC(=O)C2=C1C(=O)[O-],C39691889_decoy,CASP3,Decoy,0,-7.95663,-7.63,-1.49,-6.246353543926051
CC(C)c1ccc(-n2nnnc2SCC2=NC(=O)C3=C(C(=O)[O-])[C@@H](C)OC3=N2)cc1,C39692700_decoy,CASP3,Decoy,0,-5.49956,-7.57,-1.15,-7.413215032106927
O=C([O-])c1ccc(OCC(=O)N(C2CC2)[C@@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])c1,C13054615_decoy,CASP3,Decoy,0,-6.71363,-6.59,-0.46,-5.269034688483036
O=C([O-])c1ccc(OCC(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])c1,C13054616_decoy,CASP3,Decoy,0,-5.71059,-6.4,-0.11,-5.37006550524267
CC(=O)OC[C@H]1O[C@@H](C(=O)[O-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44029775_decoy,CASP3,Decoy,0,-5.24107,-4.58,-1.42,-5.033616643639912
CC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C44170968_decoy,CASP3,Decoy,0,-4.85169,-5.09,-0.71,-3.7847890580757695
CC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C44964151_decoy,CASP3,Decoy,0,-4.80327,-5.15,-2.9,-3.8296570109183454
CC(=O)O[C@@H]1O[C@H](C(=O)[O-])[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44964153_decoy,CASP3,Decoy,0,-4.62242,-5.3,-2.72,-5.479662108025132
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(-n2cnnn2)cc1,C45499914_decoy,CASP3,Decoy,0,-5.59278,-6.51,-1.12,-5.17122940884382
CCCc1nnc([S-])n1CC(=O)N1CCN(S(=O)(=O)N2CCN(C)CC2)CC1,C46680568_decoy,CASP3,Decoy,0,-8.84854,-5.77,-1.67,-6.156050471586664
CCO/C([O-])=C1\C(Cn2ccnc2)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1[N+](=O)[O-],C27724655_decoy,CASP3,Decoy,0,-6.45856,-5.78,-2.35,-5.651448583797296
CCOC(=O)Cc1nnc(/N=C(\[O-])c2c(C)[n-]n3c([N+](=O)[O-])c(C)n[n+]23)s1,C12413495_decoy,CASP3,Decoy,0,-6.24292,-5.86,-1.84,-5.208813249528812
COC(=O)[C@@]1([O-])C(C(=O)c2ccc([N+](=O)[O-])cc2)=C([O-])C(=O)N1c1ccccc1,C05445582_decoy,CASP3,Decoy,0,-6.31925,-6.21,-1.56,-5.73290858435702
C/C=C/c1cn(CCC(C)C)c(=O)c(C2=NS(=O)(=O)c3cc([N-]S(C)(=O)=O)ccc3[N-]2)c1[O-],C29053100_decoy,CASP3,Decoy,0,-9.52107,-8.13,-1.9,-6.8267865405121695
O=[N+]([O-])c1ccc(CS(=O)(=O)/N=C(\[O-])c2cccc(N3CCCS3(=O)=O)c2)cc1,C59368844_decoy,CASP3,Decoy,0,-8.35484,-7.33,-1.64,-6.231070418306303
Cc1nc([N+](=O)[O-])cn1C/C([O-])=N/S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1,C62674658_decoy,CASP3,Decoy,0,-6.1253,-6.48,-0.48,-6.990515914697487
COC(CN1C[C@@]2(Cc3cc([N+](=O)[O-])ccc31)C(=O)N=C([O-])N(c1ccc(C)cc1)C2=O)OC,C09253739_decoy,CASP3,Decoy,0,-7.22703,-5.49,-1.72,-5.4425244912641615
CN(C)S(=O)(=O)/N=C(\[O-])CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21,C52770075_decoy,CASP3,Decoy,0,-5.43717,-7.18,-0.4,-6.336512579024552
COCc1nc(/C([O-])=N/S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cs1,C65042077_decoy,CASP3,Decoy,0,-7.07078,-5.22,-0.76,-4.050668873401554
COc1ccc(OC)c([N-]S(=O)(=O)c2cc(-c3nnc(C(=O)N4CCCC4)o3)cs2)c1,C65098811_decoy,CASP3,Decoy,0,-9.82707,-7.65,-1.25,-10.279790796614876
CCOC(=O)c1c(C)nn2c([O-])cc(COc3cccnc3[N+](=O)[O-])nc12,C67006189_decoy,CASP3,Decoy,0,-5.83085,-7.03,-1.5,-7.447251535599815
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nnc(C[C@@H]2CCS(=O)(=O)C2)n1C,C08825948_decoy,CASP3,Decoy,0,-7.85885,-5.97,-2.69,-5.713951137046237
CCOC(=O)c1cnc(SC)nc1N[C@H]1C(=O)N2[C@@H]1SC(C)(C)[C@H]2C(=O)[O-],C09004788_decoy,CASP3,Decoy,0,-10.4611,-5.56,-2.43,-7.290716323127191
CCn1cc(C(=O)[O-])c(=O)c2cnc(N3CCN(C(=S)N[C@H]4C[C@H]5CC[C@@H]4C5)CC3)nc21,C09192509_decoy,CASP3,Decoy,0,-8.18528,-6.35,-1.98,-6.456234530515557
O=C(CSc1nnc([C@H]2CCS(=O)(=O)C2)o1)Nc1cc(C(=O)[O-])ccc1Cl,C13036035_decoy,CASP3,Decoy,0,-8.79684,-6.39,-0.15,-5.828612142433927
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nnnn1C[C@H]1CCCO1,C13036078_decoy,CASP3,Decoy,0,-6.67509,-6.99,-0.7,-6.168062356185961
O=C([O-])c1ccc2c(=O)n(CCO)c(SCc3cc(=O)n4ccccc4n3)nc2c1,C13046669_decoy,CASP3,Decoy,0,-7.41334,-7.95,-1.97,-6.789201560614815
COc1ccccc1[C@@H]1C=C(c2ccc(O[C@H](C)C(=O)[O-])cc2)Nc2nnnn21,C13077274_decoy,CASP3,Decoy,0,-7.2039,-6.94,-2.44,-6.577546203791194
CCn1c(SCC(=O)N[C@]2(C)CCS(=O)(=O)C2)nc2cc(C(=O)[O-])ccc2c1=O,C13202516_decoy,CASP3,Decoy,0,-7.52056,-6.41,-0.59,-5.777304222031083
Cc1nc2nc(S[C@@H](C)C(=O)NC[C@@H]3CCCO3)nn2c(C)c1CC(=O)[O-],C13222047_decoy,CASP3,Decoy,0,-7.46143,-6.51,-3.47,-5.088748418241155
O=C(CSc1nnnn1C[C@H]1CCCO1)Nc1ccc(C(=O)[O-])cc1,C13234612_decoy,CASP3,Decoy,0,-7.68973,-6.49,-0.75,-6.2680997077691885
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)N[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13235458_decoy,CASP3,Decoy,0,-7.85485,-7.3,-1.35,-6.534944782795317
CCc1ccc([C@@H](C)NC(=O)Cn2cc([N+](=O)[O-])cc(C(=O)[O-])c2=O)cc1,C13316882_decoy,CASP3,Decoy,0,-6.73526,-7.98,-1.55,-8.171435563321621
O=C([O-])COc1ccc(/C=C2/SC(=S)N(Nc3ccc([N+](=O)[O-])cc3)C2=O)cc1,C16906468_decoy,CASP3,Decoy,0,-8.21473,-5.55,-0.84,-5.631475867460836
COc1cc(/C=N/n2c([S-])nnc2-c2[nH]nc3c2CCC3)cc(OC)c1OC,C05577995_decoy,CASP3,Decoy,0,-9.19794,-6.13,-1.52,-6.588089488410455
C[C@@H](Sc1nccn1C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1,C20979125_decoy,CASP3,Decoy,0,-8.16395,-6.17,-2.01,-6.174892413683401
COC(=O)c1cc(NS(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)c(F)cc1F,C24428267_decoy,CASP3,Decoy,0,-6.74885,-6.63,-1.95,-6.194434493069909
COC(=O)c1c(C)[nH]c(C(=O)C2=C([O-])C(=O)N(c3cc(C)on3)[C@@H]2c2ccc(F)cc2)c1C,C25106852_decoy,CASP3,Decoy,0,-7.38223,-5.96,-1.5,-6.223160254759934
COc1ccc(/N=C/c2cc([N+](=O)[O-])ccc2[O-])cc1NS(C)(=O)=O,C27082057_decoy,CASP3,Decoy,0,-6.91223,-5.85,-1.53,-5.323915837255334
COC(=O)C[C@H](C(=O)[O-])[C@H](OC(=O)/C=C/c1ccc(O)cc1)C(=O)[O-],C31168616_decoy,CASP3,Decoy,0,-6.98298,-5.48,-0.94,-7.716522999922612
C[C@@H](C(=O)Nc1ccc([N-]S(=O)(=O)c2cccnc2Cl)cc1)n1cncn1,C32818909_decoy,CASP3,Decoy,0,-7.32325,-5.92,-1.65,-6.179535008883712
CCC(=O)Nc1nc2c(OC)cc([N-]S(=O)(=O)c3c(C)noc3C)cc2s1,C33007900_decoy,CASP3,Decoy,0,-7.89009,-6.55,-2.35,-7.26391417360762
CCn1cc(C(=O)[O-])c(=O)c2cc(F)c(N/N=C\c3ccccc3[N+](=O)[O-])cc21,C33409579_decoy,CASP3,Decoy,0,-4.83422,-7.65,-0.84,-7.152350214580055
Cc1ccccc1[C@H]1N[C@](Cc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])[C@@H]2C(=O)N(c3ccccc3C)C(=O)[C@@H]12,C35403874_decoy,CASP3,Decoy,0,-6.00023,-7.82,-1.45,-6.450007735152584
COCc1nn(-c2ccc(Cl)cc2)c([O-])c1/C=C1\NC(=O)N(Cc2cccc(C#N)c2)C1=O,C35456325_decoy,CASP3,Decoy,0,-8.20756,-7.43,-0.94,-6.128749514228271
N#Cc1cccnc1N1CC[NH+]([C@@H](C(=O)[O-])c2cn(CC(=O)[O-])c3cc(F)ccc23)CC1,C36359418_decoy,CASP3,Decoy,0,-7.59806,-6.88,-3.23,-6.477655585710756
CN(C)C(=O)CN1CC[NH+]([C@H](C(=O)[O-])c2cn(C)c3ccc(C(=O)[O-])cc23)CC1,C36360748_decoy,CASP3,Decoy,0,-6.15298,-5.94,-1.45,-5.1382645921552825
CCOc1nc(CC)nc(N/C([O-])=N/S(=O)(=O)c2ccccc2Cl)n1,C01226895_decoy,CASP3,Decoy,0,-7.26517,-5.41,-1.73,-5.591550842062804
COc1cc(/C=N/n2c([S-])nnc2-c2cc(C)n[nH]2)cc(OC)c1OC,C05625909_decoy,CASP3,Decoy,0,-10.2954,-5.33,-1.58,-6.771996441033988
COc1cc(C(=O)NC(=S)/N=C2\C=CC3=NC([O-])=NC3=C2)cc(OC)c1OC,C39007519_decoy,CASP3,Decoy,0,-7.07849,-5.49,-3.1,-5.63394386458597
O=C([O-])[C@H]1C=N[C@H](SCC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)N1c1ccc(F)cc1,C39653214_decoy,CASP3,Decoy,0,-8.00737,-6.4,-3.04,-5.798016605771116
COc1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])[C@H]3C=C[C@@H]2C3)c([N+](=O)[O-])cc1OC,C39679669_decoy,CASP3,Decoy,0,-5.89798,-6.13,-1.3,-6.689309521323841
C[C@H]1Oc2nc(CSc3nnc(-c4cccs4)n3-c3ccccc3)[nH]c(=O)c2[C@H]1C(=O)[O-],C39690591_decoy,CASP3,Decoy,0,-8.42388,-6.55,-1.74,-7.026385042329155
C[C@H]1OC2=NC(CSc3nnc(NC(C)(C)C)s3)=NC(=O)C2=C1C(=O)[O-],C39693173_decoy,CASP3,Decoy,0,-6.7259,-6.92,-0.34,-5.843971188283921
Cc1cc(NC(=O)CN(C)C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2)no1,C40013524_decoy,CASP3,Decoy,0,-8.23667,-7.14,-1.96,-7.254128237954148
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])cc2)nc(C)n1,C32566535_decoy,CASP3,Decoy,0,-6.92438,-6.53,-2.41,-5.8378089813438905
COc1ccc2c(c1)c([C@H](C(=O)[O-])[NH+]1C[C@@H]3C[C@H](C1)c1cccc(=O)n1C3)cn2CC(=O)[O-],C44690280_decoy,CASP3,Decoy,0,-6.78474,-7.45,-4.88,-7.249205055367971
COC(=O)c1cc(S(=O)(=O)N[C@H](C)c2nnn[n-]2)c(Br)s1,C44930510_decoy,CASP3,Decoy,0,-7.43325,-6.78,-1.21,-9.420116160229338
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1ccc2c(c1)OC(F)(F)O2,C45780377_decoy,CASP3,Decoy,0,-7.76836,-5.77,-1.73,-5.543764296206331
CC(C)=NOC1(ON=C(C)C)N=C([NH-])[C@@]2(C#N)[C@H](C(=O)C(C)(C)C)[C@@]12C#N,C35323549_decoy,CASP3,Decoy,0,-7.07227,-5.19,-0.86,-6.485387335806836
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)c1,C55611169_decoy,CASP3,Decoy,0,-6.62529,-6.26,-2.94,-6.213296087800135
Cc1ccc(S(=O)(=O)/N=C(\[O-])NCCc2nnc(-c3ccccn3)o2)cc1,C41138008_decoy,CASP3,Decoy,0,-6.35368,-7.07,-0.83,-5.597313806950974
CCSC1=NC(=O)[C@@H]2C(=N1)N=C(C)/C(=C(\[O-])OC)[C@H]2c1cc(OC)c(O)c(OC)c1,C39732025_decoy,CASP3,Decoy,0,-8.1693,-5.36,-1.78,-5.96516926106449
C#CCOc1ccc([C@H]2CC(O)=Nc3c2c(C)nn3-c2ccc([O-])nn2)cc1OCC,C31817488_decoy,CASP3,Decoy,0,-9.03802,-5.77,-1.45,-5.872278290905735
COc1ccc2c(c1OC)C(=O)O[C@@H]2c1c([O-])[nH]c(=O)n(CCC2=CCCCC2)c1=O,C09409924_decoy,CASP3,Decoy,0,-7.51292,-6.74,-0.81,-5.3763350576051865
CCOC(=O)c1ccc(NC(=O)CSC2=N[C@H]3N=CN=C3C([O-])=N2)cc1,C63528737_decoy,CASP3,Decoy,0,-7.28101,-6.66,-1.33,-8.871555875508824
Cc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N-]S(C)(=O)=O,C64373925_decoy,CASP3,Decoy,0,-6.62246,-6.25,-1.57,-6.859987070375007
COC(=O)CNC(=O)C1=C(C)N=N[C@H]1S(=O)(=O)[N-]c1ccc(C)cc1,C64395702_decoy,CASP3,Decoy,0,-6.58555,-6.9,-1.61,-6.987958050889839
O=C(Nc1ccc(N2CCOCC2)c(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1)c1ccc([O-])nn1,C09130919_decoy,CASP3,Decoy,0,-9.14472,-7.33,-2.28,-6.9694080439565615
CCOC(=O)c1csc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)n1,C66247216_decoy,CASP3,Decoy,0,-6.40593,-5.59,-0.24,-5.601796853060394
O=C(Nc1ccc([N-]S(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cn1)C1CC1,C67004807_decoy,CASP3,Decoy,0,-6.07803,-5.72,-1.51,-4.295210796668556
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)COP(=O)([O-])[O-])c2cc1C,C03831427_decoy,CASP3,Decoy,0,-7.46205,-6.46,-1.28,-6.6570729774475215
O=P([O-])([O-])OC[C@H]1O[C@H](n2cnc3c(NCc4ccccc4)ncnc32)[C@H](O)[C@@H]1O,C02097409_decoy,CASP3,Decoy,0,-6.60114,-5.82,-1.72,-5.073024109503524
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@@H](O)COP(=O)([O-])[O-])c2cc1C,C08551108_decoy,CASP3,Decoy,0,-7.45769,-8.45,-0.79,-9.102417990545922
CC(=O)[C@@]1(O)CC[C@H]2[C@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])CC[C@@]4(C)[C@@H]3CC[C@@]21C,C08739737_decoy,CASP3,Decoy,0,-7.63938,-7.22,-2.74,-5.93821051749726
Cn1c(-c2ccccc2)cnc1SCC(=O)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13093405_decoy,CASP3,Decoy,0,-7.00709,-7.05,-0.75,-6.07046957596771
O=C(CSc1nnc(NCc2ccco2)s1)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13220792_decoy,CASP3,Decoy,0,-8.56317,-6.3,-1.8,-5.7079509048073165
CCCc1nnc(SCC(=O)Nc2c(Cl)cc(Cl)cc2C(=O)[O-])n1CC(=O)[O-],C13232178_decoy,CASP3,Decoy,0,-6.8977,-5.72,-1.02,-5.642700099816592
CCn1c(SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)nnc1N1CCOCC1,C13232235_decoy,CASP3,Decoy,0,-7.76452,-7.25,-1.29,-7.019802797569048
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nc2ccccc2c(=O)n1CC(=O)[O-],C13234471_decoy,CASP3,Decoy,0,-8.18802,-8.24,-0.77,-10.065620190510952
O=C(CSc1nnnn1-c1ccc(Cl)cc1)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13236199_decoy,CASP3,Decoy,0,-7.21576,-6.38,-1.45,-5.716408813266091
O=C([O-])CNC(=O)c1ccc(Oc2ccc(I)cc2C(=O)[O-])c([N+](=O)[O-])c1,C13273832_decoy,CASP3,Decoy,0,-6.43784,-6.79,-2.69,-8.67667703607704
O=C(CSc1nnc(-c2ccc3c(c2)OCO3)o1)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13341672_decoy,CASP3,Decoy,0,-7.88542,-7.73,-0.79,-5.631950681738438
CSc1nnc(SCC(=O)Nc2cc(C(=O)[O-])cc(C(=O)[O-])c2)s1,C13353969_decoy,CASP3,Decoy,0,-8.49879,-5.94,-1.34,-7.714957999645634
Cc1ccccc1-n1c(C)nnc1SCC(=O)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1,C13364311_decoy,CASP3,Decoy,0,-8.1765,-7.99,-4.28,-7.891337043130901
COc1ccc(N2C[C@H](C(=O)Nc3cc(C(=O)[O-])ccc3C(=O)[O-])CC2=O)c(OC)c1,C13392298_decoy,CASP3,Decoy,0,-6.99301,-6.88,-1.23,-6.286356674992431
COCCn1c(SCC(=O)Nc2cc(C(=O)[O-])ccc2C(=O)[O-])nc2sc(C)c(C)c2c1=O,C13393519_decoy,CASP3,Decoy,0,-8.27792,-5.95,-1.45,-6.287699148446548
Cc1cccc(-n2c(SCC(=O)Nc3cc(C(=O)[O-])ccc3C(=O)[O-])nnc2N2CCOCC2)c1,C13403916_decoy,CASP3,Decoy,0,-8.65206,-7.8,-1.9,-7.581986854447767
CC(=O)[C@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N/OCC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])CC[C@@]4(C)[C@@H]3CC[C@@]21C,C15958566_decoy,CASP3,Decoy,0,-8.30778,-8.43,-2.03,-6.600279928865271
O=C([O-])[C@@H]1[C@H](C(=O)NCCCCNC(=O)[C@@H]2[C@H](C(=O)[O-])[C@H]3C=C[C@@H]2C3)[C@H]2C=C[C@@H]1C2,C17090615_decoy,CASP3,Decoy,0,-7.71177,-7.27,-1.97,-10.268815705092235
CCCCCn1c([O-])c(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])c(=O)c2ccccc21,C18122009_decoy,CASP3,Decoy,0,-7.03472,-7.59,-5.2,-7.053459557372236
CCc1c(C)nc(SCC(=O)Nc2cc(C(=O)[O-])cc([N+](=O)[O-])c2)nc1[O-],C22134093_decoy,CASP3,Decoy,0,-6.5867,-6.27,-4.11,-5.459970459034524
Cc1ccc(S(=O)(=O)/N=C(\[O-])CSc2nc(C)c(CCO)c([O-])n2)cc1,C32522943_decoy,CASP3,Decoy,0,-8.70215,-6.18,-1.56,-6.049715356832058
CCCCCn1c(O)c(/C([O-])=N/c2nnc(S([NH-])(=O)=O)s2)c(=O)c2ccccc21,C01898178_decoy,CASP3,Decoy,0,-9.47437,-7.62,-1.56,-7.937401524456687
CC(C)(Oc1ccc([C@H](O[C@H]2O[C@H](C(=O)[O-])[C@H](O)[C@H](O)[C@H]2O)c2ccc(Cl)cc2)cc1)C(=O)[O-],C35644325_decoy,CASP3,Decoy,0,-9.13959,-6.96,-1.28,-8.623100137824487
COc1cc(/C=C2\SC(=S)N([C@H](CCC(=O)[O-])C(=O)[O-])C2=O)cc([N+](=O)[O-])c1O,C36613191_decoy,CASP3,Decoy,0,-6.79548,-7.41,-1.21,-6.996268000733629
CCn1c(SC)nc([O-])c(C(c2ccc(OC)c(O)c2)c2c([O-])nc(SC)n(CC)c2=O)c1=O,C17242717_decoy,CASP3,Decoy,0,-9.73245,-6.51,-3.24,-7.532139544047038
O=C(C[C@@H]1SC([N-]/N=C\c2cccs2)=NC1=O)Nc1ccc(C(=O)[O-])cc1,C28050440_decoy,CASP3,Decoy,0,-9.60352,-7.69,-4.24,-7.800157702553911
CCc1cc(C(=O)NNC(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)sc1C,C13235760_decoy,CASP3,Decoy,0,-7.76685,-7.35,-2.01,-7.914303495973026
O=C([O-])CCc1nnc(SCC(=O)NC2c3ccccc3-c3ccccc32)nc1[O-],C13280568_decoy,CASP3,Decoy,0,-6.59774,-8.47,-3.0,-7.185610161004391
O=C([O-])CCc1nnc(SCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)nc1[O-],C13280572_decoy,CASP3,Decoy,0,-6.84266,-7.1,-3.42,-6.12030974398632
Cc1nc(SCC(=O)NC(=O)N[C@H]2CCCC[C@H]2C)nc([O-])c1CCC(=O)[O-],C13449292_decoy,CASP3,Decoy,0,-7.98542,-5.69,-1.95,-5.777125681444864
O=C([O-])CCc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc1[O-],C13092660_decoy,CASP3,Decoy,0,-6.80797,-7.88,-0.73,-10.423582187256432
Cc1ccc(C2=NN(c3ccccc3)[C@H](NC(=O)CSc3nnc(CCC(=O)[O-])c([O-])n3)C2)cc1,C39703955_decoy,CASP3,Decoy,0,-8.24125,-7.14,-1.75,-7.610018755401986
Cc1ccc(C2=NN(c3ccccc3)[C@@H](NC(=O)CSc3nnc(CCC(=O)[O-])c([O-])n3)C2)cc1,C39703958_decoy,CASP3,Decoy,0,-7.63199,-8.03,-1.66,-7.682402688287814
O=C([O-])CCc1nnc(SCC(=O)N[C@@H]2SC3=C(CCCC3)[C@H]2C(=O)c2ccccc2)nc1[O-],C39704038_decoy,CASP3,Decoy,0,-7.97156,-8.96,-3.44,-7.588187770733958
Cc1cc(N2CCCC2)ccc1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C13218354_decoy,CASP3,Decoy,0,-7.71605,-6.0,-0.83,-5.303819684944064
COc1ccc([C@@H]2N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]3C([O-])=NC(=O)[C@H]32)c(OC)c1C,C33860912_decoy,CASP3,Decoy,0,-8.0483,-6.83,-2.23,-6.7899562761022
CC(C)[C@@H](C(=O)[O-])n1c(SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)nnc1-c1cccs1,C13234873_decoy,CASP3,Decoy,0,-9.55718,-7.45,-5.12,-8.172940921537625
O=C([O-])Cn1c(SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)nnc1-c1cccs1,C13236554_decoy,CASP3,Decoy,0,-8.66084,-7.37,-0.33,-6.406036683170726
O=C([O-])c1ccc(S(=O)(=O)[N-]c2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)cc1,C24574591_decoy,CASP3,Decoy,0,-8.8511,-7.25,-2.32,-6.605133866817756
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)c1C,C13401017_decoy,CASP3,Decoy,0,-6.85152,-6.18,-1.78,-5.588031920853193
COc1cc(/C=C/c2nc([O-])[nH]c(=O)c2[N+](=O)[O-])cc(Br)c1OCC(=O)[O-],C19635282_decoy,CASP3,Decoy,0,-6.02092,-5.68,-2.12,-7.068595721075527
Cn1ccc(C(=O)NCCOCCNC(=O)c2ccn(C)c(=O)c2[O-])c([O-])c1=O,C01652890_decoy,CASP3,Decoy,0,-5.9572,-6.86,-1.27,-9.75517407979702
CCOc1cc(/C=C2/SC([N-]c3ccc(O)cc3)=NC2=O)ccc1OCC(=O)[O-],C16916201_decoy,CASP3,Decoy,0,-6.90484,-7.27,-2.81,-6.794467616044237
Cc1ccc(NC(=O)C[C@@H]2SC([N-]c3ccc(S(=O)(=O)[N-]c4nccs4)cc3)=NC2=O)cc1,C39843637_decoy,CASP3,Decoy,0,-8.54774,-7.43,-1.49,-6.409291361950886
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1Oc1ccccc1,C60376660_decoy,CASP3,Decoy,0,-7.42269,-7.17,-3.47,-6.9376705976131525
CCCNC(=O)CN1CCN(c2ccc([N-]S(=O)(=O)CC)cc2C(=O)[O-])CC1,C33253170_decoy,CASP3,Decoy,0,-8.53247,-5.87,-2.4,-5.80040688987663
CCCCCc1cc(O[C@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)c2c(c1)OC(C)(C)[C@@H]1CCC(C(=O)[O-])=C[C@@H]21,C65748804_decoy,CASP3,Decoy,0,-7.31657,-7.09,-2.13,-6.70723464283276
COC(=O)/C([O-])=C(\C(=O)/C([O-])=N/c1cc([N+](=O)[O-])ccc1C#N)c1nc2ccccc2[nH]c1=O,C17214762_decoy,CASP3,Decoy,0,-7.59744,-6.66,-0.43,-5.062961049749374
CCNC(=O)Cn1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2C)n1,C67245186_decoy,CASP3,Decoy,0,-7.07375,-7.09,-2.64,-6.326074171099124
CCN(CC)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)N/N=C/c2ccc(S(=O)(=O)[O-])o2)cc1,C04077644_decoy,CASP3,Decoy,0,-9.47308,-6.53,-1.73,-7.778994065970937
CCc1ccc(OCc2ccc(C(=O)N[C@@H]3C(=O)N4C(C(=O)[O-])=C(COC(C)=O)CS[C@H]34)o2)cc1,C08927979_decoy,CASP3,Decoy,0,-8.00587,-6.02,-2.41,-6.17575370923946
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-],C09033574_decoy,CASP3,Decoy,0,-8.35552,-7.15,-2.24,-6.441709439018811
Cc1coc2c(C)c3oc(=O)c(CCC(=O)NCCCCCC(=O)N4CCC(C(=O)[O-])CC4)c(C)c3cc12,C09128623_decoy,CASP3,Decoy,0,-7.68244,-9.22,-3.12,-8.592132418163205
CCCC[C@@H](NC(=O)[C@@H](C)NC(=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-],C09165590_decoy,CASP3,Decoy,0,-9.31263,-7.85,-2.76,-8.436172054930756
CSCC[C@H](NC(=O)Cc1c(C)c2cc3c(C)c(C)oc3c(C)c2oc1=O)C(=O)NCCC(=O)[O-],C12888824_decoy,CASP3,Decoy,0,-7.60712,-7.36,-1.61,-6.783981381684461
C[C@@H](O)Cn1c(SCC(=O)N(Cc2ccco2)CC(F)(F)F)nc2cc(C(=O)[O-])ccc2c1=O,C13052185_decoy,CASP3,Decoy,0,-7.75891,-7.34,-1.15,-10.17374824753664
CCCN(CC(=O)Nc1ccccc1C)C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC,C13202130_decoy,CASP3,Decoy,0,-6.95805,-6.98,-2.88,-6.283787634264227
CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)Sc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-],C13205552_decoy,CASP3,Decoy,0,-7.55592,-7.81,-3.03,-6.806403101567695
CCc1ccccc1NC(=O)CN(C)C(=O)[C@@H](C)Sc1nnc(-c2cccc(C)c2)n1CC(=O)[O-],C13205713_decoy,CASP3,Decoy,0,-7.94691,-7.33,-4.08,-6.68113784691155
CCc1ccccc1NC(=O)CN(C)C(=O)[C@H](C)Sc1nc2nc(C)c(CCC(=O)[O-])c(C)n2n1,C13210239_decoy,CASP3,Decoy,0,-9.76588,-5.32,-5.59,-7.364179634906351
Cc1cccc(-c2nnc(SCC(=O)N(C)CC(=O)Nc3c(C)cccc3C)n2CCC(=O)[O-])c1,C13219795_decoy,CASP3,Decoy,0,-7.4922,-8.45,-1.76,-12.577465794984024
CCOc1cc2c(cc1CNC(=O)CSc1nnc(-c3cccc(C)c3)n1CC(=O)[O-])O[C@@H](C)C2,C13220419_decoy,CASP3,Decoy,0,-6.93502,-7.25,-2.19,-6.102744677897644
CCOCCCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3cc(C(=O)[O-])ccc3C)nnc12,C13364840_decoy,CASP3,Decoy,0,-7.82635,-7.66,-1.54,-6.427080167979521
CCOc1cc(/C=C2/SC(=S)N(Nc3ccc([N+](=O)[O-])cc3)C2=O)ccc1O[C@@H](CC)C(=O)[O-],C16918490_decoy,CASP3,Decoy,0,-7.70502,-7.9,-1.93,-9.444299677733335
O=C([O-])CCCCCN1C(=O)C(O)=C(C(=O)c2ccc(Br)cc2)[C@H]1c1ccc([N+](=O)[O-])cc1,C08892347_decoy,CASP3,Decoy,0,-7.65666,-7.05,-1.33,-7.405182263401573
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2ccccc2F)c1C,C08904955_decoy,CASP3,Decoy,0,-7.59425,-7.62,-2.55,-7.371886880228954
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2cccc(Cl)c2)c1C,C09237347_decoy,CASP3,Decoy,0,-8.43592,-6.25,-2.38,-6.527144770110372
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(Cc3cccnc3)[C@@H]2c2ccc(C(=O)OC)cc2)c1C,C09175358_decoy,CASP3,Decoy,0,-7.59682,-7.29,-2.87,-6.817529033878713
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@@H]2c2ccc([N+](=O)[O-])cc2)c1C,C08904222_decoy,CASP3,Decoy,0,-8.30431,-7.01,-3.64,-8.949781286962889
CC(C)(C)c1ccc(S(=O)(=O)NNC(=S)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)cc1,C20468241_decoy,CASP3,Decoy,0,-8.09059,-6.63,-1.21,-6.345602051593408
O=C(CCSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2[O-])n1)Nc1cccc(C(F)(F)F)c1,C20832546_decoy,CASP3,Decoy,0,-6.78753,-7.23,-2.83,-5.750262153626526
O=C(CCSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2[O-])n1)Nc1cccc(N2CCCC2=O)c1,C21075601_decoy,CASP3,Decoy,0,-7.72924,-7.41,-3.27,-6.409951156635661
COc1ccc(C(=O)N(CCCNC(=O)c2nc([O-])c3ccccc3n2)Cc2ccccc2)cc1[N+](=O)[O-],C22471990_decoy,CASP3,Decoy,0,-6.8793,-7.91,-3.4,-6.760801660289101
COc1ccc([C@@H]2CC(c3ccc(C)cc3)=NN2C2=NC(=O)[C@@H](CC(=O)NCCC(=O)[O-])S2)cc1OC,C28155895_decoy,CASP3,Decoy,0,-9.74349,-8.24,-1.37,-8.952076194862073
COc1ccc([C@@H]2CC(c3ccc(C)cc3)=NN2C2=NC(=O)[C@H](CC(=O)NCCC(=O)[O-])S2)cc1OC,C28155901_decoy,CASP3,Decoy,0,-8.36634,-8.23,-2.07,-8.984296988900502
CCOc1ccc(C2=NN(C3=NC(=O)[C@H](CC(=O)NCCC(=O)[O-])S3)[C@H](c3ccc(C)cc3)C2)cc1,C28159106_decoy,CASP3,Decoy,0,-9.73704,-6.28,-1.6,-7.607423277483489
CCOc1ccc(C2=NN(C3=NC(=O)[C@H](CC(=O)NCCC(=O)[O-])S3)[C@@H](c3ccc(F)cc3)C2)cc1,C28159150_decoy,CASP3,Decoy,0,-8.63472,-6.98,-3.13,-7.943379474241256
C[C@@]12CC[C@@H]3[C@H](CCC4=CC(=O)CC[C@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-],C34720433_decoy,CASP3,Decoy,0,-7.19534,-8.71,-1.7,-7.3453307114257695
CCCCN1C(=O)[C@H]2[C@@H](c3ccc(C(=O)OC)cc3)N[C@@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C34849085_decoy,CASP3,Decoy,0,-6.59849,-6.72,-1.12,-6.495974114748266
CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)c(OC)c2)N2C(/C=C(\[O-])NCc3ccncc3)=CSC2=N1,C35705197_decoy,CASP3,Decoy,0,-8.31161,-5.37,-4.52,-7.417565767894596
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@@H]1c1ccc(OC)cc1,C35970035_decoy,CASP3,Decoy,0,-8.93825,-6.97,-2.81,-7.867993296515586
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@@H]1c1ccccc1OC,C35970391_decoy,CASP3,Decoy,0,-10.5793,-6.66,-3.75,-7.948250791772643
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1ccc(OC)c(OC)c1,C36058898_decoy,CASP3,Decoy,0,-8.74248,-5.12,-3.46,-6.509844749444412
CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)c(OC)c2)N2C(/C=C(\[O-])NCc3cccnc3)=CSC2=N1,C36064519_decoy,CASP3,Decoy,0,-8.07533,-5.96,-3.65,-7.294129906814589
CCCCNC(=O)[C@H](c1ccc2c(c1)OCO2)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499870_decoy,CASP3,Decoy,0,-7.37966,-6.22,-5.26,-5.0204893010926
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@H]2c2cccs2)c1C,C08836937_decoy,CASP3,Decoy,0,-8.48529,-6.51,-1.56,-8.967418413944896
[H]/N=C1\[N-]C(SCC(C)=O)=NC(=O)[C@H]1[C@H](c1ccc(OC)cc1)c1c(N)[nH]c(SCC(C)=O)nc1=O,C39336722_decoy,CASP3,Decoy,0,-10.0593,-5.21,-2.21,-7.225842464913203
CCOC(=O)C1=C2CC[C@H](C)C[C@@H]2S[C@@H]1NC(=O)[C@@H](C)Sc1nnc(CCC(=O)[O-])c([O-])n1,C39703836_decoy,CASP3,Decoy,0,-9.26956,-6.85,-2.06,-7.187967668947882
CCOC(=O)C1=C(C)[C@H](C(=O)OCC)[C@@H](NC(=O)CSc2nnc3nc([O-])c4c(n23)CCC4)S1,C39733500_decoy,CASP3,Decoy,0,-8.19004,-7.15,-1.87,-6.749584642555591
CCOC(=O)C1=C(C)[C@H](C(=O)OCC)[C@@H](NC(=O)CSc2nnc3nc([O-])c4c(n23)CCCC4)S1,C39733520_decoy,CASP3,Decoy,0,-8.31255,-7.92,-2.2,-7.056894774132155
CCCOc1ccc([C@H]2C(C(=O)c3c(C)[nH]c(C)c3C)=C([O-])C(=O)N2CCN2CCOCC2)cc1OC,C41534975_decoy,CASP3,Decoy,0,-8.57904,-6.87,-2.8,-7.708206092584805
CCCC/C=C/CCN1C(=O)[C@H]2[C@@H](c3cccc(OC(F)(F)F)c3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C43218453_decoy,CASP3,Decoy,0,-8.15757,-6.92,-2.53,-6.8949413054439175
CCOC(=O)c1c(NC(=O)[C@H](C)Sc2nnc(CCC(=O)[O-])c([O-])n2)sc2c1CC[C@@H](C)C2,C13092753_decoy,CASP3,Decoy,0,-9.13713,-7.25,-4.14,-8.440824445466236
COc1nccnc1[N-]S(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C03096990_decoy,CASP3,Decoy,0,-7.30879,-8.1,-3.72,-6.553130210280711
CCOC(=O)c1ccc(/N=C2\S[C@H](C(=O)Nc3ccc(C(=O)[O-])cc3)CC(=O)N2CC(=O)OC)cc1,C58945519_decoy,CASP3,Decoy,0,-8.46917,-6.07,-1.84,-6.489584052667301
CCOC(=O)c1ccc(/N=C2\S[C@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC(=O)N2CC(=O)OC)cc1,C58945521_decoy,CASP3,Decoy,0,-7.82793,-6.94,-3.17,-7.401283686588824
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CSc1nnc(-c2cc(OC)cc(OC)c2)[n-]1,C39964928_decoy,CASP3,Decoy,0,-9.45853,-8.02,-1.01,-8.431082282128997
COC(=O)CC/C(C)=C/Cc1c(OC)c(C)c2c(c1O[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]1O)C(=O)OC2,C65743386_decoy,CASP3,Decoy,0,-6.57685,-6.75,-3.47,-6.309964697565463
COc1cc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3cccc([N+](=O)[O-])c3)cc2)ncn1,C66200694_decoy,CASP3,Decoy,0,-6.88178,-8.05,-0.8,-6.290807221658541
CO[C@]1(NC(=O)[C@H](C(=O)[O-])c2ccc(O)cc2)C(=O)N2C(C(=O)[O-])=C(C)CO[C@@H]21,C03874311_decoy,CASP3,Decoy,0,-7.94723,-6.4,-0.06,-5.931907671932715
COc1cc(C=NNc2ccc([N+](=O)[O-])cn2)ccc1OCC(=O)[O-],C04903301_decoy,CASP3,Decoy,0,-6.38208,-6.62,-1.34,-7.866547922513328
CCOc1c(O)ccc(/C=C2/C(=O)N(c3cccc(C(=O)[O-])c3)N=C2C)c1[N+](=O)[O-],C04951234_decoy,CASP3,Decoy,0,-6.95862,-6.94,-1.4,-5.952146299583849
CCOC(=O)c1ccc(N2NC(=O)/C(=C/c3cc([N+](=O)[O-])cc(C)c3[O-])C2=O)cc1,C05673022_decoy,CASP3,Decoy,0,-7.01844,-5.67,-0.95,-5.827876812025326
Cc1c(C(=O)[O-])c2cc(NS(=O)(=O)N(C)C)ccc2n1S(=O)(=O)N(C)C,C08870381_decoy,CASP3,Decoy,0,-6.95975,-5.5,-1.85,-5.612741670801977
O=C([O-])C[C@H]1S/C(=N/N=C/c2ccc([N+](=O)[O-])cc2)N(c2ccc(O)cc2)C1=O,C09013877_decoy,CASP3,Decoy,0,-7.92849,-6.0,-0.28,-5.88729551431282
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)Cn3cc(Br)c(C)n3)[C@@H]2SC1,C09431535_decoy,CASP3,Decoy,0,-7.75163,-6.19,-1.13,-6.362087433090099
Cn1nnnc1SCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)c3cc(F)c(F)cc3Cl)[C@H]2SC1,C09944315_decoy,CASP3,Decoy,0,-8.74877,-6.33,-2.15,-6.453809583459534
CCOc1cc([C@@H]2C=C(c3ccc(O[C@@H](C)C(=O)[O-])cc3)Nc3nnnn32)ccc1OC,C13077468_decoy,CASP3,Decoy,0,-6.81478,-7.93,-3.08,-6.215780759498935
CCOc1cc([C@@H]2C=C(c3ccc(O[C@H](C)C(=O)[O-])cc3)Nc3nnnn32)ccc1OC,C13077470_decoy,CASP3,Decoy,0,-8.4609,-6.51,-1.8,-6.100468239857895
CCOc1cccc([C@@H]2C=C(c3ccc(O[C@@H](C)C(=O)[O-])cc3)Nc3nnnn32)c1OC,C13077518_decoy,CASP3,Decoy,0,-7.95486,-6.66,-1.35,-9.906377775411103
CCOc1cccc([C@@H]2C=C(c3ccc(O[C@H](C)C(=O)[O-])cc3)Nc3nnnn32)c1OC,C13077520_decoy,CASP3,Decoy,0,-8.35687,-6.41,-2.51,-6.25674226538568
CN(C(=O)CN1C(=O)N[C@H](CCC(=O)[O-])C1=O)[C@H]1CCS(=O)(=O)C1,C13235151_decoy,CASP3,Decoy,0,-7.49376,-5.93,-0.52,-8.17192987624071
O=C([O-])c1cc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)[O-])cc(C(=O)[O-])c1,C04108257_decoy,CASP3,Decoy,0,-8.05359,-6.72,-1.62,-5.98689996725115
COc1cc(NC(=O)CSc2nnc(N3CCC(C)CC3)n2C2CC2)c(C(=O)[O-])cc1OC,C13408571_decoy,CASP3,Decoy,0,-7.82749,-6.94,-3.37,-6.735160437322136
CC[C@H](Oc1ccccc1/C=C1/SC(=S)N(NC(=O)c2cccc([N+](=O)[O-])c2)C1=O)C(=O)[O-],C16910942_decoy,CASP3,Decoy,0,-8.27517,-5.61,-2.11,-6.984710965361112
CCOCC(=O)Nc1cc(C)nn1-c1nc([O-])c2cnn(-c3ccc(C)cc3C)c2n1,C21011084_decoy,CASP3,Decoy,0,-8.62703,-8.42,-1.28,-10.01487764267892
Cc1cc(NC(=O)[C@H](C)Sc2nc(C3CC3)nc3c2c(=O)nc([O-])n3C2CC2)no1,C22419169_decoy,CASP3,Decoy,0,-8.23198,-7.41,-1.17,-6.95713983208193
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)CN(c3cccc(C)c3C)S(C)(=O)=O)cc2)n1,C22524225_decoy,CASP3,Decoy,0,-7.08804,-8.42,-2.65,-5.849771010546728
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)([O-])C[P@@](=O)([O-])O)[C@@H](O)[C@H]1O,C13527614_decoy,CASP3,Decoy,0,-5.51411,-8.23,-1.0,-6.673226733460931
COc1ccc(N2C(=O)C[C@@H](Nc3ccc(S(=O)(=O)[N-]c4cc(C)on4)cc3)C2=O)cc1Cl,C12605079_decoy,CASP3,Decoy,0,-7.23931,-7.29,-1.76,-5.632391381593278
Cc1cc(NC(=O)[C@@H](C)Sc2nc(C3CC3)nc3c2c(=O)nc([O-])n3C2CC2)on1,C25150074_decoy,CASP3,Decoy,0,-7.94677,-7.99,-1.27,-8.73677311921917
O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2cccc(S(=O)(=O)/N=C3/CCCN3)c2)c1,C25286327_decoy,CASP3,Decoy,0,-7.04575,-7.29,-2.8,-6.676217931676923
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(=O)(=O)[N-]c3cc(C)nc(C)n3)cc2)cc1OC,C27614708_decoy,CASP3,Decoy,0,-8.563,-6.68,-2.0,-6.373215336746111
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[P@](=O)([O-])O[P@@](=O)([O-])S)[C@@H](O)[C@H]1O,C16346988_decoy,CASP3,Decoy,0,-5.93143,-6.46,-0.73,-5.5066259750558215
Nc1nc2c(ncn2[C@@H]2O[C@@H]3CO[P@](=O)([O-])O[C@H]3[C@H]2OC(=O)CCC(=O)[O-])c(=O)[nH]1,C31490182_decoy,CASP3,Decoy,0,-6.66226,-7.95,-1.39,-6.71710839324561
Cn1nnnc1SCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]3c3ccccc3)[C@@H]2SC1,C09355869_decoy,CASP3,Decoy,0,-8.22114,-6.33,-1.57,-5.37375498894676
COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)Cn2nc(C)cc2C)c1[O-],C05111574_decoy,CASP3,Decoy,0,-7.29921,-5.47,-3.58,-5.598711571091629
CCCc1cc([O-])nc(-n2nc(C)cc2NC(=O)C[C@H]2CSc3ncc(C)c(=O)n32)n1,C38741205_decoy,CASP3,Decoy,0,-7.17118,-6.64,-2.27,-7.591350120065489
Cc1nnc(SCc2oc(-c3ccccc3)nc2CSc2nc(=O)c(C)n[nH]2)c([O-])n1,C09833539_decoy,CASP3,Decoy,0,-8.03122,-8.38,-1.66,-7.997287201977412
CC1=C(C)[C@@H](C(=O)O[C@@H](C)C(=O)/N=C2\[N-]C=NC3=NC=N[C@@H]32)[C@@H](NC(=O)C(C)(C)C)S1,C39462511_decoy,CASP3,Decoy,0,-8.48321,-6.05,-0.62,-6.52733713551903
CCOc1cc([C@@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2c2nnc(C)s2)ccc1O,C40003385_decoy,CASP3,Decoy,0,-9.43358,-7.65,-4.28,-8.739975698330031
O=C([O-])c1ccc(Nc2ncnc(N3CCC(C(=O)[O-])CC3)c2[N+](=O)[O-])cc1,C40661547_decoy,CASP3,Decoy,0,-6.39758,-6.99,-1.35,-5.884789411589576
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1csc(-c2cnccn2)n1,C44123325_decoy,CASP3,Decoy,0,-7.492,-6.74,-1.06,-5.786385701297206
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)[C@H]3[C@@H](C(=O)[O-])[C@@H]4C=C[C@H]3O4)cc2)c1C,C20343105_decoy,CASP3,Decoy,0,-7.02345,-8.33,-1.07,-7.083090696008378
Cc1ccnc([N-]S(=O)(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)n1,C44883774_decoy,CASP3,Decoy,0,-8.89078,-7.59,-1.22,-6.8560968606667405
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1cc(-c2nnc3n2CCCCC3)ccc1C,C45527443_decoy,CASP3,Decoy,0,-8.96246,-6.73,-3.96,-7.178550275431016
Cc1c(C(=O)[O-])sc2nc(CSc3nnc(C[C@H]4CCS(=O)(=O)C4)n3C)[nH]c(=O)c12,C13036001_decoy,CASP3,Decoy,0,-8.74986,-8.33,-1.18,-6.981404050809694
Cc1c(C(=O)[O-])sc2nc(CSc3nnnn3C[C@@H]3CCCO3)[nH]c(=O)c12,C13036083_decoy,CASP3,Decoy,0,-8.4375,-7.01,-1.21,-6.76158522914288
COCCn1c(SCc2nc3oc(C)c(C(=O)[O-])c3c(=O)[nH]2)nnc1-c1ccc(Cl)cc1,C13414021_decoy,CASP3,Decoy,0,-7.34223,-7.85,-1.28,-6.6723509954865134
Cc1oc2nc(CSc3nnc(COc4ccc(Cl)cc4)n3C)[nH]c(=O)c2c1C(=O)[O-],C13418055_decoy,CASP3,Decoy,0,-7.82343,-7.06,-3.36,-6.020989866945967
Cc1oc2nc(CSc3nnnn3-c3ccc(C(C)C)cc3)[nH]c(=O)c2c1C(=O)[O-],C13401071_decoy,CASP3,Decoy,0,-6.77398,-7.04,-1.06,-5.791312059805336
COC(=O)CNC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1,C55595978_decoy,CASP3,Decoy,0,-6.34109,-7.4,-1.81,-6.751806062134006
Nn1c(CSc2nccc([O-])n2)nnc1CSc1nccc([O-])n1,C58834974_decoy,CASP3,Decoy,0,-7.84087,-5.1,-1.75,-6.243090030137569
O=C1C=Cc2ccccc2/C1=N\Nc1ccc(/N=N/c2ccc(S(=O)(=O)[O-])cc2)cc1S(=O)(=O)[O-],C19594750_decoy1,CASP3,Decoy,0,-10.8777,-9.7,,-8.02762415688288
O=C([O-])CNC(=O)C[C@@H]1SC([N-]NC2=NC(=O)SC2)=NC1=O,C13523105_decoy,CASP3,Decoy,0,-6.62932,-5.22,-0.88,-5.77969648594748
COc1ccnc(N2CCC(C(=O)Nc3nc(-c4ccc([N-]S(C)(=O)=O)cc4)cs3)CC2)n1,C23129802_decoy,CASP3,Decoy,0,-10.2488,-5.78,-2.0,-5.8365949749134005
CCC(=O)N(C1CC1)[C@H]1NN=C(SCC(=O)/N=C2\O[C@@H](C)c3c(C)nnc([O-])c32)S1,C39939680_decoy,CASP3,Decoy,0,-7.6792,-6.29,-1.59,-5.279409842232819
Nc1nc(NC2CC2)c2ncn([C@@H]3C=C[C@H](COP(=O)([O-])[O-])C3)c2n1,C06585599_decoy,CASP3,Decoy,0,-6.67907,-5.72,-0.88,-6.6429630498194525
O=C([O-])[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(OS(=O)(=O)[O-])cc4)coc3c2)[C@@H](O)[C@H](O)[C@@H]1O,C65739581_decoy,CASP3,Decoy,0,-7.17537,-6.64,-1.18,-5.006092937743904
CCOc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)cc([N+](=O)[O-])c1[O-],C04902565_decoy,CASP3,Decoy,0,-8.0645,-7.57,-3.3,-7.168117557955672
O=C([O-])C[C@@H]1S/C(=N/N=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)NC1=O,C08722305_decoy,CASP3,Decoy,0,-7.44093,-6.27,-1.78,-6.699229107086249
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)c3c(Cl)c(C)nn3C)[C@@H]2SC1,C09201621_decoy,CASP3,Decoy,0,-8.2626,-5.71,-2.13,-6.381604997296436
Cn1nnnc1SCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)c3cccc(F)c3)[C@@H]2SC1,C09355865_decoy,CASP3,Decoy,0,-7.60658,-7.15,-1.1,-6.743837027197358
CC1=C(c2ccc(OCC(=O)[O-])cc2)Nc2nnnn2[C@H]1c1ccc(N2CCOCC2)cc1,C03400053_decoy,CASP3,Decoy,0,-9.09121,-5.54,-1.03,-5.858870532201292
O=C([O-])c1ccc2c(=O)n(CCO)c(SCn3nnc4ccccc4c3=O)nc2c1,C13045449_decoy,CASP3,Decoy,0,-7.08827,-7.05,-0.94,-6.210095185550713
Cc1cc(NC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2Cc2ccco2)no1,C13050775_decoy,CASP3,Decoy,0,-8.25701,-7.47,-3.65,-7.098335163843731
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H]1CCCO1)N[C@H]1CCS(=O)(=O)C1,C13053110_decoy,CASP3,Decoy,0,-7.98096,-7.37,-0.95,-6.977008840413451
Cc1cc(NC(=O)[C@H](C)Sc2nc3cc(C(=O)[O-])ccc3c(=O)n2C[C@@H]2CCCO2)no1,C13053619_decoy,CASP3,Decoy,0,-8.27234,-8.58,-0.75,-8.631136226560892
C[C@@H](Oc1ccc(C2=C[C@@H](c3ccccc3OCC#N)n3nnnc3N2)cc1)C(=O)[O-],C13077498_decoy,CASP3,Decoy,0,-6.78347,-6.21,-2.55,-5.913945390459613
C[C@@H](Oc1ccc(C2=C[C@H](c3ccccc3OCC#N)n3nnnc3N2)cc1)C(=O)[O-],C13077500_decoy,CASP3,Decoy,0,-6.84314,-7.98,-1.33,-7.081199093373149
Cc1nc2nc(SCC(=O)N[C@@]3(C)CCS(=O)(=O)C3)nn2c(C)c1CC(=O)[O-],C13222335_decoy,CASP3,Decoy,0,-7.54882,-7.22,-2.04,-7.957952221191735
CN(C(=O)CN1C(=O)N[C@H](CCC(=O)[O-])C1=O)[C@@H]1CCS(=O)(=O)C1,C13235149_decoy,CASP3,Decoy,0,-7.21321,-5.85,-0.58,-7.583914464166642
Cc1sc2ncn(CCS(=O)(=O)Nc3cc4c(cc3C(=O)[O-])OCCCO4)c(=O)c2c1C,C13269233_decoy,CASP3,Decoy,0,-8.44852,-7.29,-0.82,-6.173706132039736
Cc1cc(C)n2c(SCC(=O)Nc3cc(C(=O)[O-])cc(C(=O)[O-])c3)nnc2n1,C13342006_decoy,CASP3,Decoy,0,-8.54433,-7.66,-1.88,-8.283318408902735
CCn1cc(C(=O)N[C@@H]2C(=O)N3C(C(=O)[O-])=C(COC(C)=O)CS[C@H]23)cn1,C13960066_decoy,CASP3,Decoy,0,-6.95492,-6.16,-0.84,-7.240020101323731
O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](COP(=O)([O-])[O-])[C@H](O)[C@@H](O)[C@H]2O)cc1,C15206529_decoy,CASP3,Decoy,0,-5.03142,-6.83,-0.96,-5.176514079356322
O=C([O-])C[C@H]1S/C(=N\c2ccccc2)N(NC(=O)c2ccc([N+](=O)[O-])cc2)C1=O,C16451108_decoy,CASP3,Decoy,0,-8.13044,-6.03,-0.76,-6.526884349450442
COc1cc(/C=C2/SC(=S)N(Nc3ccc([N+](=O)[O-])cc3)C2=O)ccc1OCC(=O)[O-],C16915120_decoy,CASP3,Decoy,0,-7.70652,-5.66,-1.71,-5.703490067822159
O=C(C[C@H]1SC(=O)N(c2cccc(O)c2)C1=O)Nc1cc(C(=O)[O-])ccc1C(=O)[O-],C16925950_decoy,CASP3,Decoy,0,-7.20394,-7.84,-1.73,-6.7899247265083655
O=C([O-])COc1ccc(Br)cc1/C=C/c1nc([O-])c([N+](=O)[O-])c(=O)[nH]1,C19798898_decoy,CASP3,Decoy,0,-6.58323,-5.77,-0.47,-5.701891719318106
Cc1ccc(-c2ccc(/C=N/N=C3\NC(=O)[C@H](CC(=O)[O-])S3)o2)c([N+](=O)[O-])c1,C19883048_decoy,CASP3,Decoy,0,-6.00916,-6.23,-0.7,-4.26269031747056
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(C(=O)NC[C@@H]2CCCO2)cc1,C21005594_decoy,CASP3,Decoy,0,-7.46741,-6.5,-2.14,-5.863310303908745
CCOCC(=O)Nc1cc(C)nn1-c1nc([O-])c2cnn(-c3ccccc3F)c2n1,C21011029_decoy,CASP3,Decoy,0,-7.9885,-6.86,-1.33,-7.261431336742228
Cc1c(C(=O)N(C)CCCNC(=O)c2nc([O-])c3ccccc3n2)cccc1[N+](=O)[O-],C22471309_decoy,CASP3,Decoy,0,-4.80347,-8.24,-1.83,-7.909891712429478
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)Cn3nc(C)c(Br)c3C)[C@@H]2SC1,C22745012_decoy,CASP3,Decoy,0,-7.38468,-6.67,-1.61,-6.827760425563866
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Nc2cnc3c(c2)c(C)nn3C)c1OC,C22959354_decoy,CASP3,Decoy,0,-8.07355,-6.85,-0.87,-6.76303673792894
CC(=O)N[C@H]1[C@@H](Oc2ccccc2C(=O)/C=C/c2ccccc2)O[C@@H]2COC(C)(C)O[C@@H]2[C@@H]1OCC(=O)[O-],C27516482_decoy,CASP3,Decoy,0,-6.9069,-6.7,-2.24,-6.176081831006118
CC(C)c1ccc([C@@H]2CC(c3ccc4c(c3)OCO4)=NN2C2=NC(=O)[C@H](CC(=O)NCC(=O)[O-])S2)cc1,C28159647_decoy,CASP3,Decoy,0,-7.72766,-8.25,-4.06,-7.1847040977047545
CCOc1cc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2c2nnc(C)s2)ccc1O,C33813979_decoy,CASP3,Decoy,0,-9.19204,-6.69,-2.81,-7.643053535260856
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2[O-])c1C,C12535912_decoy,CASP3,Decoy,0,-5.55294,-7.61,-2.31,-7.334315653432017
CCOc1cc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2c2nnc(C)s2)ccc1O,C35483840_decoy,CASP3,Decoy,0,-8.66202,-7.28,-3.97,-6.708292983898357
C/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530251_decoy,CASP3,Decoy,0,-7.69886,-8.24,-1.24,-9.14568776012432
O=C1N=C([O-])/C(=C\c2ccc(OCCOc3ccc([N+](=O)[O-])cc3)cc2)C(=O)N1,C02992723_decoy,CASP3,Decoy,0,-8.45657,-7.08,-1.22,-6.628051907167769
CCCc1cc([O-])nc(-n2nc(C)cc2NC(=O)C2CCN(S(C)(=O)=O)CC2)n1,C38741244_decoy,CASP3,Decoy,0,-7.72786,-6.86,-0.32,-6.23574637614043
O=C([O-])CCc1nnc(SCC(=O)Nc2c(Cl)cc(Cl)cc2C(=O)[O-])nc1[O-],C13235707_decoy,CASP3,Decoy,0,-6.7158,-7.47,-0.98,-6.190190838832131
Cc1cc(NC(=O)CN2CCN(S(=O)(=O)c3cc(C(=O)[O-])cs3)CC2)no1,C13455093_decoy,CASP3,Decoy,0,-8.12394,-6.14,-3.17,-6.363586859051919
CCc1ccc(-n2c(SCc3nc4c(c(=O)[nH]3)[C@@H](C(=O)[O-])[C@H](C)O4)nnc2-c2ccncc2)cc1,C39691494_decoy,CASP3,Decoy,0,-7.49618,-8.44,-1.32,-7.157962917460895
C[C@@H]1Oc2nc(CSc3nnc(-c4ccco4)n3-c3ccccc3)[nH]c(=O)c2[C@@H]1C(=O)[O-],C39691638_decoy,CASP3,Decoy,0,-6.77757,-6.53,-2.37,-6.307200148284443
C[C@@H]1OC2=NC(CSc3nnc(NC[C@H]4CCCO4)s3)=NC(=O)C2=C1C(=O)[O-],C39693095_decoy,CASP3,Decoy,0,-7.85367,-7.25,-1.0,-5.466043303594958
C[C@@H]1Oc2nc(CSc3nnc(-c4ccco4)n3-c3ccc(F)cc3)[nH]c(=O)c2[C@@H]1C(=O)[O-],C39693213_decoy,CASP3,Decoy,0,-7.57817,-6.88,-2.12,-5.886436714411651
O=C1N=C([O-])[C@H]2[C@@H]1[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1ccc(N2CCCC2)cc1,C33594376_decoy,CASP3,Decoy,0,-6.89624,-6.35,-0.73,-5.665182611003591
O=C([O-])c1ccc2c(=O)[nH]c(CSc3nnnn3C[C@@H]3CCCO3)nc2c1,C13036079_decoy,CASP3,Decoy,0,-7.20899,-6.19,-0.9,-5.780406279853913
Cc1ccc(C)c(OCc2nnc(SCc3nc4oc(C)c(C(=O)[O-])c4c(=O)[nH]3)o2)c1,C13394973_decoy,CASP3,Decoy,0,-6.47665,-6.92,-2.84,-5.297839801501801
COc1cc(C)nc(N/C([O-])=N/S(=O)(=O)c2c(OC)cc(C)nc2Cl)n1,C01066566_decoy,CASP3,Decoy,0,-7.23969,-6.35,-0.98,-6.562331171055075
O=C([O-])C[C@@H]1S/C(=N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)NC1=O,C16115064_decoy,CASP3,Decoy,0,-6.93522,-7.73,-0.88,-6.118481588588978
COC(=O)CNC(=O)Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1,C58055121_decoy,CASP3,Decoy,0,-5.80401,-6.63,-1.89,-5.067256327231305
CC(C)CC[C@]1(C)CN(C2CCC2)C(=O)[C@@H](C2=NS(=O)(=O)c3cc([N-]S(C)(=O)=O)ccc3N2)C1=O,C45253576_decoy,CASP3,Decoy,0,-8.30435,-7.9,-0.76,-6.183589933974574
O=c1[nH]cnc2c1nc(Br)n2[C@H]1O[C@@H](CO[P@@](=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@@H]1O,C35077495_decoy,CASP3,Decoy,0,-6.5,-6.14,-1.71,-5.639406474080688
O=S(=O)([O-])c1ccc(N=Nc2ccc(/N=N/c3c(O)ccc4ccccc34)c(S(=O)(=O)[O-])c2)cc1,C19594750_decoy2,CASP3,Decoy,0,-11.1326,-7.78,,-6.767307154014782
O=C([O-])c1ccccc1C(=O)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2n1nnnc1Oc1ccc2c(c1)OCO2,C04259923_decoy,CASP3,Decoy,0,-6.65017,-7.05,-2.35,-5.794258003847898
O=S(=O)([O-])c1ccc(NN=C2CCC(=NNc3ccc(S(=O)(=O)[O-])cc3)CC2)cc1,C09035648_decoy,CASP3,Decoy,0,-8.88872,-6.13,-2.14,-6.961736899005869
O=C1/C(=N\Nc2ccc(S(=O)(=O)[O-])cc2)C(c2ccc([N+](=O)[O-])cc2)=NN1c1ccccc1,C09659749_decoy,CASP3,Decoy,0,-7.80909,-6.21,-3.67,-6.3262818522556685
Cc1nc(CC(=O)NNS(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)cs1,C09963744_decoy,CASP3,Decoy,0,-7.92813,-6.41,-1.07,-6.376769809296206
Cc1nc2nc(SCC(=O)N[C@@H]3CCS(=O)(=O)C3)nn2c(C)c1CC(=O)[O-],C13034738_decoy,CASP3,Decoy,0,-7.09678,-5.51,-0.51,-5.401981353300799
Cc1nc2nc(SCC(=O)NC(=O)NC(C)(C)C)nn2c(C)c1CC(=O)[O-],C13221881_decoy,CASP3,Decoy,0,-5.89143,-5.28,-0.85,-4.773054661728464
Cc1nc2nc(S[C@H](C)C(=O)NC(=O)NC(C)C)nn2c(C)c1CC(=O)[O-],C13271002_decoy,CASP3,Decoy,0,-5.23923,-6.51,-0.9,-5.428325715520548
CCn1c(CCC(N)=O)nnc1Sc1ccc([N+](=O)[O-])c(C(=O)[O-])c1,C13273371_decoy,CASP3,Decoy,0,-8.72938,-6.93,-1.33,-7.690631197208331
CC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCn3ncc([N+](=O)[O-])c3C)[C@@H]2SC1,C17080789_decoy,CASP3,Decoy,0,-6.62957,-7.81,-0.45,-9.478585752372302
Cc1nn(CCC(=O)N[C@H]2C(=O)N3[C@@H]2SC(C)(C)[C@H]3C(=O)[O-])cc1[N+](=O)[O-],C17081249_decoy,CASP3,Decoy,0,-6.15411,-6.65,-1.19,-8.825673139544099
C[C@@H](Sc1nc(C2CC2)nc2c1c(=O)nc([O-])n2C1CC1)C(=O)NC(=O)NC(C)(C)C,C22419212_decoy,CASP3,Decoy,0,-7.82638,-6.78,-1.19,-5.573087631991476
C[C@@H](Sc1nc(C2CC2)nc2c1c(=O)nc([O-])n2C1CC1)C(=O)NC(=O)NC1CC1,C22419254_decoy,CASP3,Decoy,0,-7.75954,-6.01,-1.95,-7.32404879210963
COC(=O)c1sc(NC(=O)c2nccnc2C(=O)[O-])c(C(=O)OC)c1C,C32093488_decoy,CASP3,Decoy,0,-7.54638,-5.66,-1.95,-5.936728301392547
CCOC(=O)Cc1ccc(NC(=O)Nc2c(C)nc3ncnn3c2[O-])cc1,C33266159_decoy,CASP3,Decoy,0,-7.43354,-7.3,-0.53,-6.505882005125
N#Cc1cc(C(=O)[O-])c([O-])nc1SCCSc1nc(O)c(C(=O)[O-])cc1C#N,C26770329_decoy,CASP3,Decoy,0,-8.3024,-7.97,-0.34,-9.067084426625389
O=[N+]([O-])c1ccccc1O[C@H]1O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H](O)[C@@H]1O,C35645658_decoy,CASP3,Decoy,0,-4.23948,-5.1,-1.64,-4.2057174442806735
Cc1nn(C)c(C)c1NC(=O)[C@H](C)Sc1nc(C2CC2)nc2c1c(=O)nc([O-])n2C1CC1,C14202346_decoy,CASP3,Decoy,0,-8.01175,-7.58,-2.26,-6.623278740544789
CCCC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H]2CO[P@](=O)([O-])O[C@@H]2[C@@H]1OC(=O)CCC,C03871789_decoy,CASP3,Decoy,0,-6.40568,-6.48,-0.3,-6.321090252901753
O=C1N=N[C@@H](SCc2ccccc2CSc2nnc([O-])[nH]c2=O)C(=O)N1,C38815437_decoy,CASP3,Decoy,0,-9.062,-9.07,-1.8,-12.10156480714579
O=C1N=N[C@H](SCc2ccc(CSc3nnc([O-])[nH]c3=O)cc2)C(=O)N1,C38815439_decoy,CASP3,Decoy,0,-7.67503,-7.03,-1.69,-7.882059999789548
O=C([O-])[C@H](C[C@@H]1C=[NH+]C=N1)/N=C/c1c([O-])[nH]c(=O)n(-c2ccccc2)c1=O,C39029605_decoy,CASP3,Decoy,0,-6.60923,-6.66,-1.12,-6.164349239430757
CN1C(SCc2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)=NN[C@H]1C[C@H]1CCS(=O)(=O)C1,C39639667_decoy,CASP3,Decoy,0,-8.31053,-8.46,-2.51,-7.222266309123355
Cc1oc2nc(CSc3nnnn3[C@@H]3C(=O)N(c4ccccc4)N(C)[C@H]3C)[nH]c(=O)c2c1C(=O)[O-],C39693180_decoy,CASP3,Decoy,0,-6.36862,-9.48,-2.33,-6.610228387421102
O=C([O-])c1ccc2c(=O)[nH]c(CS[C@@H]3NN=NN3Cc3ccco3)nc2c1,C39693260_decoy,CASP3,Decoy,0,-7.74605,-7.13,-1.81,-6.421330648378328
N#Cc1cnn2c([O-])cc(CSc3nnc(-c4cccs4)n3CC(N)=O)nc12,C40127872_decoy,CASP3,Decoy,0,-8.62585,-7.14,-2.79,-6.405564731639357
CCOC(=O)c1sc(NC(=O)Cc2c(C)nc3c(C#N)cnn3c2[O-])nc1C,C40140713_decoy,CASP3,Decoy,0,-8.05068,-5.56,-1.32,-6.101644881872693
CC(=O)Nc1nc([O-])c2c(ncn2[C@@H]2O[C@@H]3[C@H](OC(=O)[C@H]3OC(C)=O)[C@@H]2OC(C)=O)n1,C36644234_decoy,CASP3,Decoy,0,-7.05298,-7.55,-0.43,-8.531897666626925
COc1cc([C@H]2[C@@H]3C(=O)N=C([O-])[C@H]3ON2CC(N)=O)cc(OC)c1OC,C33629985_decoy,CASP3,Decoy,0,-9.06284,-7.3,-1.84,-9.233767661506386
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3ccc4c(c3)OCCO4)N[C@@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C33872526_decoy,CASP3,Decoy,0,-7.03349,-6.11,-3.54,-5.320454242949802
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=O)c3c(C)[n-]n4c([N+](=O)[O-])c(C)n[n+]34)cc2)n1,C12446227_decoy,CASP3,Decoy,0,-6.84538,-6.71,-3.0,-5.213544015309541
Cc1cc(C)n2nc(/N=C(\[O-])CSc3nc(C)c(CCO)c(=O)[nH]3)nc2n1,C32522945_decoy,CASP3,Decoy,0,-7.66668,-7.24,-0.98,-5.757215391987892
N#C/C(C(=O)Cn1ccc([N+](=O)[O-])n1)=C(/[O-])Nc1ccc2c(c1)OCCO2,C54461341_decoy,CASP3,Decoy,0,-6.75973,-7.1,-1.14,-6.132001212756505
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC,C55611943_decoy,CASP3,Decoy,0,-7.6919,-6.83,-3.5,-5.706952426120179
O=c1ccn([C@@H]2O[C@H](CO[P@@](=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)[nH]1,C12493522_decoy,CASP3,Decoy,0,-4.40913,-6.15,-0.9,-4.5734398793915005
O=c1[nH]cnc2c1ncn2[C@@H]1O[C@H](CO[P@@](=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O,C12405084_decoy,CASP3,Decoy,0,-5.19589,-7.27,-0.11,-8.199631743672766
Nn1c(CSc2nc([O-])cc(=O)[nH]2)nnc1CSc1nc([O-])cc(=O)[nH]1,C58834965_decoy,CASP3,Decoy,0,-7.09103,-7.45,-1.08,-7.82219709263255
Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)[nH]1,C35000839_decoy,CASP3,Decoy,0,-4.76746,-7.94,-0.68,-6.277932814884853
Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@@](=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c(=O)[nH]1,C31308651_decoy,CASP3,Decoy,0,-5.42787,-7.86,-0.23,-8.04139559221201
O=S(=O)(/N=C1/CCCN1)c1ccc([N-]S(=O)(=O)c2cccc(-n3cnnn3)c2)cc1,C60165900_decoy,CASP3,Decoy,0,-7.92004,-6.95,-1.39,-5.916714234598045
COc1cc([C@H](c2c([O-])nc(=S)[nH]c2[O-])c2c([O-])[nH]c(=S)[nH]c2=O)cc(OC)c1OC,C13452495_decoy,CASP3,Decoy,0,-9.65721,-6.76,-2.34,-8.563953254986831
C=CCN1C(=O)c2cc3c(cc2N[C@@H]1SC/C([O-])=N/c1ncn[nH]1)OCO3,C63763333_decoy,CASP3,Decoy,0,-8.18829,-5.71,0.03,-4.973732249762939
C[C@H]1C(C(=O)NCCS(=O)(=O)N2CCc3ccccc32)=CNN1c1ccc([O-])nn1,C63919524_decoy,CASP3,Decoy,0,-7.62264,-8.72,-1.66,-7.24605595670012
O=C(NCCc1nnc2n1CCC2)C1=CNN(c2ccc([O-])nn2)[C@@H]1C(F)(F)F,C64087643_decoy,CASP3,Decoy,0,-7.40355,-8.7,-2.06,-7.8531937513879955
O=C(NCCc1nnc2n1CCC2)C1=CNN(c2ccc([O-])nn2)[C@H]1C(F)(F)F,C64087644_decoy,CASP3,Decoy,0,-8.34633,-7.97,-2.09,-7.099558459773179
CN1C(=O)N(C)[C@@H](N)C(C(=O)COC(=O)C2=NN=C(c3ccccc3)C2)=C1[O-],C64148296_decoy,CASP3,Decoy,0,-7.1034,-6.92,-1.72,-5.685180131452394
CC(C)OC/C([O-])=C(\C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2,C64682142_decoy,CASP3,Decoy,0,-6.9604,-6.86,-3.01,-6.105723503987261
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)/N=C(\[O-])CNC(=O)OC(C)(C)C,C65642898_decoy,CASP3,Decoy,0,-5.37808,-6.21,-1.63,-5.388092147018618
C=CCCO[C@H](C)/C([O-])=C(/C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2,C65651541_decoy,CASP3,Decoy,0,-7.39354,-6.67,-1.27,-7.474339151164819
CS(=O)(=O)[N-]c1ccccc1CNC(=O)Nc1cccnc1-n1cncn1,C66670641_decoy,CASP3,Decoy,0,-7.42718,-5.72,-0.14,-5.7020295808054895
CN(CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1[O-])C(=O)c1ccco1,C67182519_decoy,CASP3,Decoy,0,-7.84793,-7.3,-2.24,-5.969355647248281
CC/N=c1\cc2oc3cc(NCC)c(C)cc3c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])c-2cc1C,C04235573_decoy,CASP3,Decoy,0,-9.07185,-6.22,-1.5,-7.319702417815854
CCn1cc(C(=O)[O-])c(=O)c2cnc(N3CCN(C(=S)N[C@@H]4C[C@H]5CC[C@@H]4C5)CC3)nc21,C01441600_decoy,CASP3,Decoy,0,-7.42992,-7.75,-1.18,-13.708619989592233
Cc1csc2nc(CSc3nc4cc(C(=O)[O-])ccc4c(=O)n3CCO)cc(=O)n12,C13046068_decoy,CASP3,Decoy,0,-9.69763,-6.49,-1.62,-6.578211700925271
C[C@@H](Sc1nc2cc(C(=O)[O-])ccc2c(=O)n1C)C(=O)NCc1ccc2c(c1)OCO2,C13199971_decoy,CASP3,Decoy,0,-8.07326,-4.98,-1.39,-5.899131722892556
CCn1c(SCC(=O)Nc2cc(C)on2)nc2cc(C(=O)[O-])ccc2c1=O,C13201568_decoy,CASP3,Decoy,0,-7.90333,-7.29,-1.3,-7.000584113502894
CCCc1nnc(SCC(=O)N2c3ccccc3NC(=O)C2(C)C)n1CC(=O)[O-],C13202788_decoy,CASP3,Decoy,0,-5.58292,-6.51,-2.22,-6.121700270384033
O=C([O-])c1ccc(Br)c(S(=O)(=O)N(Cc2ccco2)[C@H]2CS(=O)(=O)C[C@@H]2O)c1,C13251201_decoy,CASP3,Decoy,0,-7.705,-5.59,-2.8,-6.353466637518837
COc1cccc(O)c1/C=N/n1c(SCC(=O)[O-])nnc1-c1ccoc1C,C13459939_decoy,CASP3,Decoy,0,-9.01484,-7.23,-1.51,-8.79374271187346
Cc1ccccc1-c1nc(NCC(=O)[O-])ncc1-c1nnnn1-c1ccc(Cl)cc1,C16363057_decoy,CASP3,Decoy,0,-8.30626,-8.3,-1.46,-9.333469491857526
CC(=O)NCCN1C(=O)C([O-])=C(C(=O)c2ccccc2)[C@@H]1c1cccc([N+](=O)[O-])c1,C05562661_decoy,CASP3,Decoy,0,-7.08807,-6.56,-2.5,-7.964773519941766
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)/C=C\C(=O)[O-])cc2)c1C,C19793956_decoy,CASP3,Decoy,0,-5.76199,-6.93,-3.72,-6.320355514087857
COc1cc([C@@H](C2=C([O-])COC2=O)c2cc3c(cc2O)OCO3)cc(OC)c1OC,C06170051_decoy,CASP3,Decoy,0,-7.52092,-7.68,-1.37,-7.0630299546548425
CCCn1c(=O)n(CCC(=O)Nc2nc(C#N)c(C#N)[n-]2)c2ccccc21,C26269906_decoy,CASP3,Decoy,0,-7.12121,-8.12,-1.42,-6.257487953496113
CCn1nc(C)c2c(C(=O)Nc3ccc(S(=O)(=O)[N-]c4nccs4)cc3)cc(C)nc21,C28304158_decoy,CASP3,Decoy,0,-9.22828,-6.27,-1.87,-5.994606035811065
O=C([O-])/C=C/C(=O)Nc1ccc2[nH]cc([C@@H](C(=O)[O-])N3CCOCC3)c2c1,C31809801_decoy,CASP3,Decoy,0,-8.22993,-6.9,-1.73,-7.088210987425907
COc1cc([N-]S(=O)(=O)c2ccc(N/C=C3/CCCCC3=O)cc2)nc(OC)n1,C17952845_decoy,CASP3,Decoy,0,-8.45516,-6.31,-1.93,-6.045003428827321
Cn1cc([C@@H](C(=O)[O-])[NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)c2cc(C(=O)[O-])ccc21,C36357522_decoy,CASP3,Decoy,0,-8.09946,-6.82,-1.69,-6.427922758538091
O=C([O-])Cn1cc([C@H](C(=O)[O-])[NH+]2CCCN(c3ncccn3)CC2)c2ccccc21,C36366665_decoy,CASP3,Decoy,0,-5.75316,-7.35,-1.63,-7.12076622310995
CCOc1cc(/C=C2/C(=O)N(c3cc(OC)ccc3OC)C(=O)N=C2[O-])ccc1O,C02281554_decoy,CASP3,Decoy,0,-8.77243,-6.68,-1.38,-6.756714356316916
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)nn2)cc1,C36610971_decoy,CASP3,Decoy,0,-7.87642,-6.97,-1.17,-6.707140088662029
CCCc1cc([O-])nc(-n2nc(C)cc2NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)n1,C07420571_decoy,CASP3,Decoy,0,-8.1709,-8.5,-1.99,-10.516479423981911
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([N-]S(C)(=O)=O)c(Cl)c1,C38754531_decoy,CASP3,Decoy,0,-7.5785,-5.87,-1.92,-6.587860261560144
COc1cc(OC)c(/C=N/N2C([S-])=NN[C@@H]2[C@@H]2N=NC3=C2CCC3)c(OC)c1,C38971379_decoy,CASP3,Decoy,0,-9.24475,-6.36,-1.36,-8.805922996251553
COc1cc(OC)c(OC)cc1/C=N/N1C([S-])=NN[C@@H]1[C@H]1N=NC2=C1CCC2,C38980960_decoy,CASP3,Decoy,0,-8.75949,-5.85,-1.24,-6.474999097392211
CC(C)Cn1c(S[C@@H](C)C(=O)N2CCNC2=O)nc2cc(C(=O)[O-])ccc2c1=O,C13280372_decoy,CASP3,Decoy,0,-6.87654,-7.91,-1.78,-7.339039070059709
O=C([O-])[C@@H]1[C@H](C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)[C@@H]2C=C[C@H]1C2,C39679192_decoy,CASP3,Decoy,0,-7.47607,-6.24,-2.93,-6.985247253258683
CC(C)c1nnc(SCc2nc3c(c(=O)[nH]2)[C@@H](C(=O)[O-])[C@H](C)O3)n1C1CC1,C39693243_decoy,CASP3,Decoy,0,-7.32629,-6.84,-2.74,-6.262486737574753
O=C([O-])C[C@]1(C(=O)[O-])[NH2+][C@H](c2cccc(OC(F)(F)F)c2)[C@@H]2C(=O)N=C([O-])[C@H]21,C33919919_decoy,CASP3,Decoy,0,-6.25603,-7.01,-1.84,-5.775563772906682
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)Cn2nc([O-])c3ccccc3c2=O)c1C,C07318359_decoy,CASP3,Decoy,0,-7.55482,-7.54,-1.39,-5.793107030173381
CCc1cc2c(=O)n(CC)c(SCc3nc4oc(C)c(C(=O)[O-])c4c(=O)[nH]3)nc2s1,C13435586_decoy,CASP3,Decoy,0,-7.24334,-7.65,-2.27,-6.160343820574648
Cc1oc2nc(CSc3nnc(C4CC4)n3-c3ccccc3)[nH]c(=O)c2c1C(=O)[O-],C13417406_decoy,CASP3,Decoy,0,-6.51914,-8.19,-3.31,-6.275647875757299
CCCCS(=O)(=O)/N=C(\[O-])c1cc(C2CC2)nc2c1c(=O)[nH]c(=O)n2CC,C48556324_decoy,CASP3,Decoy,0,-8.29631,-6.19,-0.52,-6.250559803997519
[H]/N=C1C(=C\c2ccc(OCC(=O)[O-])c(OC)c2)\C(=O)N=C2SN=C(SC)N2\1,C20154781_decoy,CASP3,Decoy,0,-7.91118,-7.02,-1.08,-5.489131785643791
CN(C/C([O-])=N/c1nc(-c2ccccn2)n[nH]1)S(=O)(=O)c1ccccc1,C53527040_decoy,CASP3,Decoy,0,-6.49718,-7.1,-1.18,-4.953195831921486
Cc1c(C(=O)NCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)cnn1-c1ccc([O-])nn1,C57644082_decoy,CASP3,Decoy,0,-8.41396,-7.24,-1.93,-6.54037088671476
COc1ccc([C@H]2C[C@H](c3ccccc3)n3nc([N-]S(=O)(=O)N(C)C)nc3N2)cc1,C02399864_decoy,CASP3,Decoy,0,-6.50138,-5.39,-1.37,-5.608405616808485
CC1=c2c([O-])nn(C)c2=NC(=O)[C@@H]1CCC(=O)N(C)CC(=O)Nc1ccc(Br)cc1C,C39780506_decoy,CASP3,Decoy,0,-6.7142,-8.47,-0.92,-8.849870431646732
CCCc1cc([O-])nc(SCC(=O)NC2=C3C(=O)N=NC(C)=C3[C@H](C)O2)n1,C39789704_decoy,CASP3,Decoy,0,-9.14645,-6.82,-1.58,-7.139568337591288
O=C(Cn1cc(/C=C2/C(=O)N(c3ccccc3F)C(=O)N=C2[O-])c2ccccc21)NC[C@@H]1CCCO1,C08663736_decoy,CASP3,Decoy,0,-8.43475,-8.93,-3.34,-7.569066207830824
C=CCO/C([O-])=C1\C(C)=NC2=NC(=O)NC(=O)[C@@H]2[C@@H]1c1ccc(OC)cc1OC,C63416440_decoy,CASP3,Decoy,0,-7.80489,-5.6,-0.59,-6.160095649899564
COc1ccc(C2=NN=C3N=C(c4cc(OC)c(O)c(OC)c4)C=C(C(=O)[O-])[C@H]32)cc1,C63448144_decoy,CASP3,Decoy,0,-7.62306,-6.68,-3.14,-6.497882388289031
CN(Cc1ccc2nonc2c1)/C([O-])=N/c1nc(Cc2ccccc2)n[nH]1,C48267894_decoy,CASP3,Decoy,0,-8.0937,-6.85,-1.18,-6.20236235704738
CS(=O)(=O)[N-]c1ccc(/C=C/C([O-])=N/c2nc(-c3ccccn3)n[nH]2)cc1,C64372333_decoy,CASP3,Decoy,0,-7.55349,-6.9,0.05,-4.749345454267992
COc1ccc([N-]S(=O)(=O)[C@H]2N=NC=C2C(=O)Nc2ccc(OC)cc2F)cc1,C65055655_decoy,CASP3,Decoy,0,-7.50834,-6.47,-1.7,-6.063998917312312
CC(=O)Nc1ccc([N-]S(=O)(=O)[C@H]2C(C)=NC(C)=C2c2nc(C3CC3)no2)cc1,C65194510_decoy,CASP3,Decoy,0,-7.55961,-6.27,-1.85,-7.471027023623757
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1cccc(-n2cnnn2)c1,C65832503_decoy,CASP3,Decoy,0,-7.17767,-6.39,-1.17,-6.523413448644591
CS(=O)(=O)[N-]c1ccc(-c2csc([N-]S(=O)(=O)c3cn[nH]c3)n2)cc1,C66250559_decoy,CASP3,Decoy,0,-8.12584,-5.41,-2.12,-5.81884050203893
CC(C)NC(=O)C(=O)N[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(Cl)c1Cl,C66813768_decoy,CASP3,Decoy,0,-6.97055,-6.64,-0.56,-6.598368970828875
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2ccc(NC(=O)C3CC3)nc2)cc1C,C67004795_decoy,CASP3,Decoy,0,-6.15249,-6.5,-4.41,-4.294716440614096
CCOC(=O)C1=C(C)N(C2CCC(C(=O)[O-])CC2)C(=O)N[C@H]1c1csnn1,C67029701_decoy,CASP3,Decoy,0,-8.27548,-5.15,-0.65,-6.67735140605945
C[C@]12CC/C(=N\OCC(=O)NCCCCC(=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,C08770155_decoy,CASP3,Decoy,0,-9.56469,-7.34,-1.2,-6.888921964077446
CCCC[C@@H](NC(=O)[C@H](C)NC(=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-],C09165598_decoy,CASP3,Decoy,0,-9.23807,-7.92,-3.17,-7.149789227266943
Cc1oc2c(C)c3oc(=O)c(CC(=O)N[C@H](CCCNC(N)=O)C(=O)NCC(=O)[O-])c(C)c3cc2c1C,C12889198_decoy,CASP3,Decoy,0,-8.09679,-7.79,-1.77,-7.551855210965455
Cc1cccc(-c2nnc(SCC(=O)NNC(=O)C[C@H]3CCS(=O)(=O)C3)n2CCC(=O)[O-])c1,C13035771_decoy,CASP3,Decoy,0,-8.78403,-8.51,-4.31,-12.397255897727096
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)[O-])C3=O)c(NCCCn3ccnc3)nc12,C06143914_decoy,CASP3,Decoy,0,-8.01356,-5.57,-0.53,-6.8282184198335205
C[C@H](O)Cn1c(SCC(=O)N(Cc2ccco2)CC(F)(F)F)nc2cc(C(=O)[O-])ccc2c1=O,C13052186_decoy,CASP3,Decoy,0,-8.06531,-6.64,-1.6,-7.736527712181393
CCCOc1c(Cl)cc([C@@H]2C=C(c3ccc(O[C@@H](C)C(=O)[O-])cc3)Nc3nnnn32)cc1OCC,C13077560_decoy,CASP3,Decoy,0,-9.44514,-6.78,-1.12,-6.710054735749196
CCCOc1c(Cl)cc([C@@H]2C=C(c3ccc(O[C@H](C)C(=O)[O-])cc3)Nc3nnnn32)cc1OCC,C13077562_decoy,CASP3,Decoy,0,-10.1991,-6.43,-1.3,-6.819682558002902
CCOc1cc2c(cc1CNC(=O)CSc1nnc(-c3cccc(C)c3)n1CC(=O)[O-])O[C@H](C)C2,C13220417_decoy,CASP3,Decoy,0,-7.86268,-7.54,-0.62,-6.286569570403956
C=CCn1c(SCC(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])nnc1[C@H]1CCS(=O)(=O)C1,C13273462_decoy,CASP3,Decoy,0,-8.37304,-7.28,-1.79,-7.611800028333064
COCCOc1cc(NC(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)c(C(=O)[O-])cc1OC,C13453022_decoy,CASP3,Decoy,0,-8.62646,-6.34,-1.51,-6.362474972409013
CCOc1cc(/C=C2/SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)ccc1O[C@@H](CC)C(=O)[O-],C16918539_decoy,CASP3,Decoy,0,-8.51756,-5.44,-2.18,-6.253460022632234
O=C([O-])CCCCCN1C(=O)C(O)=C(C(=O)c2ccc(Br)cc2)[C@@H]1c1ccc([N+](=O)[O-])cc1,C08892348_decoy,CASP3,Decoy,0,-8.5121,-7.07,-2.68,-8.297582608026461
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@H]2c2ccc([N+](=O)[O-])cc2)c1C,C08838013_decoy,CASP3,Decoy,0,-8.80162,-7.84,-3.71,-8.311784837788446
CC(C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2)s1,C20832564_decoy,CASP3,Decoy,0,-10.0815,-7.89,-4.35,-8.469493726438282
CC[C@H](C)c1ccc(NC(=O)CSc2nnc(N/N=C/c3cc(OC)c([O-])c([N+](=O)[O-])c3)n2N)cc1,C21326912_decoy,CASP3,Decoy,0,-7.15566,-6.68,-4.54,-8.28327155555306
COC(=O)CC/C(C)=C/Cc1c(OC)c(C)c2c(c1O[C@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]1O)C(=O)OC2,C22063375_decoy,CASP3,Decoy,0,-6.40524,-6.5,-3.47,-6.1226774837609925
CCOc1ccc([C@@H]2CC(c3ccc(C)cc3)=NN2C2=NC(=O)[C@H](CC(=O)NCCC(=O)[O-])S2)cc1,C28155852_decoy,CASP3,Decoy,0,-8.15137,-6.33,-1.24,-8.175854745617402
COc1ccc([C@H]2CC(c3ccc(C)cc3)=NN2C2=NC(=O)[C@@H](CC(=O)NCCC(=O)[O-])S2)cc1OC,C28155899_decoy,CASP3,Decoy,0,-9.64113,-8.38,-3.89,-9.050127249876562
CCOc1ccc([C@@H]2CC(c3ccc(F)cc3)=NN2C2=NC(=O)[C@@H](CC(=O)NCCC(=O)[O-])S2)cc1,C28157362_decoy,CASP3,Decoy,0,-9.69628,-8.18,-2.66,-11.253588119544382
CCOc1ccc([C@H]2CC(c3ccc(OC)cc3)=NN2C2=NC(=O)[C@@H](CC(=O)NCC(=O)[O-])S2)cc1,C28158396_decoy,CASP3,Decoy,0,-9.05517,-5.72,-2.56,-8.474107662426302
COc1ccc(C2=NN(C3=NC(=O)[C@@H](CC(=O)NCCC(=O)[O-])S3)[C@@H](c3ccc(C(C)C)cc3)C2)cc1,C28158581_decoy,CASP3,Decoy,0,-8.74527,-8.74,-0.44,-9.35215273203503
CCOc1ccc(C2=NN(C3=NC(=O)[C@@H](CC(=O)NCCC(=O)[O-])S3)[C@@H](c3ccc(F)cc3)C2)cc1,C28159146_decoy,CASP3,Decoy,0,-9.96077,-8.44,-3.13,-8.701223109022626
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2cccc([N+](=O)[O-])c2)c1C,C33515745_decoy,CASP3,Decoy,0,-8.52546,-7.36,-4.84,-9.66116707662435
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2ccc(OC)cc2)c1C,C33515753_decoy,CASP3,Decoy,0,-8.28484,-7.32,-1.39,-7.121606330887169
O=C([O-])CCCN1C(=O)/C(=C/c2cc([N+](=O)[O-])ccc2OCC(=O)Nc2nccs2)SC1=S,C33570337_decoy,CASP3,Decoy,0,-8.5613,-6.27,-3.58,-7.177468341874855
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@H]1c1cccc(OC)c1,C34923907_decoy,CASP3,Decoy,0,-10.5766,-5.76,-4.05,-7.536300044624295
COC(=O)CC/C(C)=C/Cc1c(OC)c(C)c2c(c1O[C@@H]1O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)OC2,C35645255_decoy,CASP3,Decoy,0,-5.9441,-6.07,-3.57,-6.246480567484833
CCC1=C(C(=O)OC)[C@@H](c2cccc([N+](=O)[O-])c2)N2C(/C=C(\[O-])NCCN3CCOCC3)=CSC2=N1,C35704452_decoy,CASP3,Decoy,0,-9.86167,-6.77,-4.7,-8.129580785495703
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@H]1c1ccc(OC)cc1,C35970031_decoy,CASP3,Decoy,0,-10.1997,-5.78,-1.53,-7.307953213963683
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@H]1c1ccccc1OC,C35970388_decoy,CASP3,Decoy,0,-10.6737,-5.64,-1.12,-8.50232766054268
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@@H]1c1cccc(OC)c1OC,C36052635_decoy,CASP3,Decoy,0,-9.59144,-4.91,-2.66,-7.4727524019288305
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@@H]1c1ccc(OC)c(OC)c1,C36058893_decoy,CASP3,Decoy,0,-7.66971,-7.21,-2.49,-7.340009381902022
CCC1=C(C(=O)OC)[C@H](c2ccc(OC)c(OC)c2)N2C(/C=C(\[O-])NCc3ccccn3)=CSC2=N1,C36064516_decoy,CASP3,Decoy,0,-9.0317,-5.82,-2.36,-7.340374571937952
CCC1=C(C(=O)OC)[C@H](c2ccc(OC)c(OC)c2)N2C(/C=C(\[O-])NCc3cccnc3)=CSC2=N1,C36064518_decoy,CASP3,Decoy,0,-8.63158,-6.31,-3.31,-6.8387540764153485
CCCCNC(=O)[C@@H](c1ccc2c(c1)OCO2)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499869_decoy,CASP3,Decoy,0,-7.29436,-5.69,-1.29,-6.7146127407095495
CCN(CC(=O)NCc1cccs1)C(=O)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1,C12535927_decoy,CASP3,Decoy,0,-8.88708,-7.68,-4.01,-7.685101003545393
CCOC(=O)C1=C(C)[C@@H](C(=O)OCC)[C@H](NC(=O)CSc2nnc3nc([O-])c4c(n23)CCCC4)S1,C39733519_decoy,CASP3,Decoy,0,-7.94363,-7.46,-1.05,-5.99302197767304
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)=C([O-])C(=O)N2CCO)cc1,C40110716_decoy,CASP3,Decoy,0,-8.40172,-6.43,-1.76,-7.955303124929946
COc1cc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC(C)C)cc(OC)c1OC,C39899303_decoy,CASP3,Decoy,0,-8.44153,-5.94,-2.11,-7.614589120711447
CCOc1ccc([C@H]2C(C(=O)c3c(C)[nH]c(C)c3C)=C([O-])C(=O)N2CCN2CCOCC2)cc1OCC,C41534958_decoy,CASP3,Decoy,0,-8.48469,-6.35,-1.83,-6.948216927739065
COC(=O)c1ccc([C@H]2N[C@](Cc3ccccc3)(C(=O)[O-])[C@@H]3C(=O)N(CCNc4ccccc4)C(=O)[C@@H]23)cc1,C33899438_decoy,CASP3,Decoy,0,-6.28303,-8.35,-2.04,-7.241875233847709
COC(=O)c1ccc([C@H]2[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C(=O)N(CCSc4ccccc4)C(=O)[C@@H]23)cc1,C43218432_decoy,CASP3,Decoy,0,-7.2476,-7.35,-1.06,-6.727697522155911
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1ccc(OC)c(C)c1OC,C33860914_decoy,CASP3,Decoy,0,-7.17593,-7.84,-2.37,-6.186878982751868
CCCc1nn(C)c2c([S-])nc(-c3cc(C(=O)CN4CCN(CCO)CC4)ccc3OCC)nc12,C44136419_decoy,CASP3,Decoy,0,-11.9512,-6.11,-2.19,-7.941073579258841
O=S(=O)([O-])c1ccc2c(/N=N/c3ccc(N(CCO)CCO)cc3)ccc(/N=N\c3ccccc3)c2c1,C31351869_decoy,CASP3,Decoy,0,-10.2085,-6.83,-2.62,-8.459011811273317
CCOC(=O)c1c(NC(=O)[C@@H](C)Sc2nnc(CCC(=O)[O-])c([O-])n2)sc2c1CC[C@H](C)C2,C13092752_decoy,CASP3,Decoy,0,-9.77389,-7.4,-3.85,-7.422994160459367
COc1ccc2[nH]cc(CC[N-]/C(=N\C(=O)CSc3nc(C)cc(C)n3)Nc3nc(C)cc(C)n3)c2c1,C18063615_decoy,CASP3,Decoy,0,-9.08164,-8.37,-3.5,-7.94778276577563
CCOC(=O)C1=C(COC(=O)c2ccccc2[N-]S(=O)(=O)c2ccc(Cl)cc2)NC(=O)NC1,C26241933_decoy,CASP3,Decoy,0,-8.41572,-7.42,-2.18,-7.28330333165922
COc1cc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)ncn1,C66200699_decoy,CASP3,Decoy,0,-7.27768,-8.26,-2.8,-6.435469649250551
C=C1C(=O)[C@@]23[C@@H]4[C@H](OC(C)=O)C[C@]1(OC(C)=O)[C@H]2OC(C)(C)O[C@@H]3C[C@H]1C(C)(C)CC[C@@H](OC(C)=O)[C@@]41C,C04268192_decoy,CASP3,Decoy,0,-7.66882,-6.33,-2.47,-7.696919437455837
COC(=O)C1C(C)=NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@@H]1c1cc(OC)c(OC)cc1OC,C06137256_decoy,CASP3,Decoy,0,-8.78271,-5.51,-3.44,-6.70008487863926
COC(=O)C1C(C)=NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@@H]1c1ccc(OC)c(OC)c1OC,C06137333_decoy,CASP3,Decoy,0,-9.41489,-6.53,-1.58,-6.908490939046593
CCCCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3c(C)cccn3c2=O)SC1=S,C08858370_decoy,CASP3,Decoy,0,-9.27,-5.57,-3.3,-6.79965510390347
CCCN1C(=O)/C(=C\c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccc(C)cn3c2=O)SC1=S,C09460998_decoy,CASP3,Decoy,0,-7.68242,-6.46,-1.74,-4.738719340828418
CCCN1C(=O)/C(=C\c2c(N3CCN(c4ccc(F)cc4)CC3)nc3c(C)cccn3c2=O)SC1=S,C09461931_decoy,CASP3,Decoy,0,-8.83422,-6.07,-3.35,-5.231946312471959
CC[C@@H](C)N1C(=O)/C(=C\c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccccn3c2=O)SC1=S,C09461988_decoy,CASP3,Decoy,0,-8.01311,-8.36,-2.12,-7.122792951532896
COc1ccc(N2CCN(c3nc4c(c(=O)n(C)c(=O)n4C)n3CCSc3ccc(F)cc3)CC2)cc1,C10248742_decoy,CASP3,Decoy,0,-8.48694,-7.28,-2.52,-7.054598275794085
COc1ccc(S(=O)(=O)CCCC(=O)N(C[C@H]2CCCO2)c2nc3c(C)c(Cl)ccc3s2)cc1,C10526134_decoy,CASP3,Decoy,0,-9.30619,-6.43,-2.52,-6.873338752343447
CCN1C(=O)/C(=C/c2c(N3CCN(c4ccc(OC)cc4)CC3)nc3c(C)cccn3c2=O)SC1=S,C02321836_decoy,CASP3,Decoy,0,-8.96337,-6.34,-1.81,-8.448601392616784
COc1cc(C(=O)N2CCN(c3nc(C4CC4)nc4sc5c(c34)CC[C@H](C)C5)CC2)cc(OC)c1OC,C01377088_decoy,CASP3,Decoy,0,-8.59914,-5.82,-2.93,-6.0374388778730985
COC(=O)C1C(C)=NC2=C(C(=O)C[C@@H](c3ccc(OC)c(OC)c3)C2)[C@H]1c1ccc(OC(C)=O)c(OC)c1,C06015450_decoy,CASP3,Decoy,0,-8.58934,-7.28,-1.87,-7.278698852968799
COc1cccc(-c2nc3cc(OC)c(OC)cc3cc2CN(C[C@@H]2CCCO2)C(=O)c2cccc(F)c2)c1,C14967826_decoy,CASP3,Decoy,0,-8.72944,-7.78,-3.71,-8.082875641037088
CCCOc1ccc([C@@H]2c3c(oc4ccc(Cl)cc4c3=O)C(=O)N2CCN2CCOCC2)cc1OCC,C20352043_decoy,CASP3,Decoy,0,-9.61066,-7.25,-1.89,-6.1569111953166695
COC(=O)c1ccc(Oc2nc(N3CCCC3)c(Cl)c3c2N(C[C@H]2CCCO2)CCS3(=O)=O)cc1,C24615574_decoy,CASP3,Decoy,0,-8.71325,-6.28,-1.35,-7.110906444732104
COc1cc(/C=C2/N=C(c3ccccc3)N(c3c(C)n(C)n(-c4ccccc4)c3=O)C2=O)cc(OC)c1OC,C28617545_decoy,CASP3,Decoy,0,-8.44633,-5.98,-3.29,-6.640032178395455
C[C@H]1CN(c2cc(Cl)nc(SCC(=O)N3CCc4ccccc4C3)n2)CCN1C(=O)c1ccccc1,C00736170_decoy,CASP3,Decoy,0,-9.78628,-8.07,-4.53,-7.823058863261881
CC[C@H](C)N1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(C)c2N2CCN(c3ccccc3F)CC2)SC1=S,C33458894_decoy,CASP3,Decoy,0,-9.24276,-6.0,-2.67,-6.680893314610544
CC(=O)N1CCN(C(=O)CSc2nc(Cl)cc(N3CCN(C(=O)C4CCCCC4)[C@H](C)C3)n2)CC1,C00734390_decoy,CASP3,Decoy,0,-9.94665,-7.85,-1.96,-10.462790946776384
CCCCCCN1C(=O)/C(=C\c2c(N3CCN(C(=O)OCC)CC3)nc3ccccn3c2=O)SC1=S,C34806725_decoy,CASP3,Decoy,0,-7.28733,-6.44,-3.27,-6.547389805318585
C[C@H]1CN(C(=O)CSc2nnc(-c3cccs3)n2-c2ccccc2)CCN1C(=O)c1ccc(F)cc1,C00744136_decoy,CASP3,Decoy,0,-9.9444,-7.02,-1.11,-7.296974328969025
C[C@H]1CN(C(=O)CSc2nnc(-c3cccs3)n2-c2ccccc2)CCN1C(=O)c1ccccc1F,C35173903_decoy,CASP3,Decoy,0,-10.8006,-6.71,-3.42,-6.973885208674346
CCOC(=O)c1c(C)nc(-c2ccccc2)nc1C(=O)N1CCN(C(=O)c2ccc3ccccc3c2)[C@H](C)C1,C35175415_decoy,CASP3,Decoy,0,-7.78816,-6.95,-1.47,-6.795611473547605
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)C(c3ccccc3)c3ccccc3)[C@@H](C)C2)c1C(=O)OCC,C35176053_decoy,CASP3,Decoy,0,-10.0351,-8.01,-4.27,-8.385705586425187
COc1ccc(CCN(C)C(=O)CSc2nc(Cl)cc(N3CCC4(CC3)OCCO4)n2)cc1OC,C35307411_decoy,CASP3,Decoy,0,-9.14925,-7.89,-1.75,-6.878257302479152
Cc1c(CN(C(=O)C[C@@H]2OC(=O)c3ccccc32)[C@H]2CCCc3ccccc32)c(=O)n(-c2ccccc2)n1C,C35496970_decoy,CASP3,Decoy,0,-8.15293,-7.11,-2.48,-6.573817910244143
COc1ccc(-c2ccc(N3CCN(C(=O)CN(CC(C)C)C(=O)c4ccc(Cl)cc4)CC3)nn2)cc1,C35705474_decoy,CASP3,Decoy,0,-9.08139,-6.61,-1.49,-9.019256499254142
CCC(=O)N1CCc2ccc(OCc3nc(C(=O)N4CCN(C(C)=O)CC4)co3)cc2[C@@H]1c1cccc(C)c1,C35863354_decoy,CASP3,Decoy,0,-7.48065,-7.61,-2.45,-7.26274126906629
CCN1CCN(C(=O)Cc2csc3nc(C)c(-c4cc(C)n(-c5cc(Cl)ccc5C)n4)c(=O)n23)CC1,C35911985_decoy,CASP3,Decoy,0,-8.89966,-6.54,-1.71,-6.452856248685089
COCc1nc(N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c2c(C)nn(-c3cccc(Cl)c3)c2n1,C36019740_decoy,CASP3,Decoy,0,-9.49802,-7.03,-1.6,-6.6658179401882505
COc1ccc(-c2ccc(N3CCN(C(=O)CN(Cc4ccco4)C(=O)c4ccccc4C)CC3)nn2)cc1,C36064209_decoy,CASP3,Decoy,0,-7.40739,-6.92,-3.64,-5.116908891454297
CCCN(CC(=O)N1CCN(c2ccc(-c3ccc(OC)c(OC)c3)nn2)CC1)C(=O)c1ccccc1F,C36072859_decoy,CASP3,Decoy,0,-9.38164,-6.61,-4.22,-6.835417304708225
O=C(CN(CC1CC1)C(=O)c1cccc(F)c1)N1CCCN(c2ccc(-c3ccccc3Cl)nn2)CC1,C36082473_decoy,CASP3,Decoy,0,-8.32471,-6.6,-2.59,-7.999160689586631
COc1ccccc1OC[C@H]1c2ccsc2CCN1C(=O)CN(C[C@H]1CCCO1)C(=O)c1cccs1,C36118173_decoy,CASP3,Decoy,0,-10.742,-6.87,-4.86,-8.431542634586934
CC(=O)N1CCN(C(=O)CN2C(=O)CS[C@H](c3ccsc3)c3c(C(C)(C)C)nn(C(C)(C)C)c32)CC1,C37264057_decoy,CASP3,Decoy,0,-8.60886,-7.05,-3.27,-9.561250300361156
CCOC(=O)[C@@H]1CCCN(C(=O)CN2C(=O)COc3ccc(C(=O)COc4cc(C)cc(C)c4C)cc32)C1,C37519830_decoy,CASP3,Decoy,0,-9.13615,-7.94,-4.33,-7.035416616368394
COc1ccc([C@H](c2nnnn2Cc2ccccc2)N2CCN(c3nc4ccccc4s3)CC2)cc1OC,C13111083_decoy,CASP3,Decoy,0,-8.24627,-7.06,-2.23,-6.795755508477447
CCn1c(N2C[C@@H](C)O[C@H](C)C2)c(/C=C2\SC(=S)N([C@H](C)c3ccccc3)C2=O)c(C)c(C#N)c1=O,C38182750_decoy,CASP3,Decoy,0,-9.31147,-6.55,-1.44,-8.184590836278081
CCSc1ccc(-c2nn(-c3ccccc3)cc2/C=C2/C(=O)N(C[C@@H]3CCCO3)C(=O)C(C#N)=C2C)cc1,C38607047_decoy,CASP3,Decoy,0,-8.43203,-7.06,-3.01,-8.018266828372836
CCSc1ccc(-c2nn(-c3ccccc3)cc2/C=C2/C(=O)N(C[C@H]3CCCO3)C(=O)C(C#N)=C2C)cc1,C38607048_decoy,CASP3,Decoy,0,-8.46494,-8.05,-2.44,-7.416683913903726
CCCCOc1ccc([C@H]2c3c(oc4c(C)cc(C)cc4c3=O)C(=O)N2[C@H]2CCS(=O)(=O)C2)cc1OC,C38648883_decoy,CASP3,Decoy,0,-8.35583,-7.35,-2.54,-6.725782465756833
CCOc1cccc2sc(N(CCCN3CCOCC3)C(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)nc12,C36706556_decoy,CASP3,Decoy,0,-8.07319,-6.75,-2.82,-7.002654422898691
CCn1c2c(c3ccccc31)CCn1c-2nc2cc(S(=O)(=O)C(C)C)c(S(=O)(=O)C(C)C)cc2c1=O,C39541265_decoy,CASP3,Decoy,0,-6.93393,-5.96,-5.46,-5.128750694028726
CCCn1c(N2CCC(C(=O)OCC)CC2)c(/C=C2/SC(=S)N([C@H](C)CC)C2=O)c(C)c(C#N)c1=O,C39770240_decoy,CASP3,Decoy,0,-8.85001,-5.45,-2.95,-7.2205622073094595
CCCCn1c(N2CCOCC2)c(/C=C2/SC(=S)N([C@@H](C)c3ccccc3)C2=O)c(C)c(C#N)c1=O,C39770461_decoy,CASP3,Decoy,0,-8.27716,-5.34,-1.61,-6.436869403743247
CCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(CC(C)C)s2)cc1OCC,C39840666_decoy,CASP3,Decoy,0,-8.27089,-6.0,-4.57,-6.548511969378613
CCCCn1c(N2C[C@H](C)C[C@H](C)C2)c(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)c(C)c(C#N)c1=O,C39990483_decoy,CASP3,Decoy,0,-9.67433,-7.32,-5.46,-7.930662878222376
CCCCn1c(N2CCN(c3ccc(F)cc3)CC2)c(/C=C2\SC(=S)N(C)C2=O)c(C)c(C#N)c1=O,C39991276_decoy,CASP3,Decoy,0,-9.29136,-7.0,-0.87,-7.171390861145302
N#C[C@](c1ccc(Cl)cc1)(c1ccc([C@@](C#N)(c2ccc(Cl)cc2)N2CCOCC2)nn1)N1CCOCC1,C12957551_decoy,CASP3,Decoy,0,-9.12254,-6.17,-2.24,-8.447955583640073
CCCN1CCN(C(=O)c2cn(CCC)nc2S(=O)(=O)N2CCN(c3ccc(Cl)cc3)CC2)CC1,C67337847_decoy,CASP3,Decoy,0,-9.4171,-5.36,-3.22,-6.802523683165028
Cc1ccc2cccc(Oc3nc(C)nc4sc5c(c34)CCC5)c2n1,C00038156_decoy,CASP3,Decoy,0,-7.6051,-8.31,-1.54,-5.950471481698871
CSc1nnc2ccc(-c3ccc(Br)cc3)nn12,C04376644_decoy,CASP3,Decoy,0,-7.18522,-5.04,0.14,-4.148457427434585
Cc1cc(C)nc(SN=C2C=C(Cl)C(=O)C(Cl)=C2)n1,C00447158_decoy,CASP3,Decoy,0,-7.70855,-5.61,-2.02,-5.57329155259743
Cc1cn2nc(CN3CCCc4ccccc43)n3c2c1CCCC3,C03200202_decoy,CASP3,Decoy,0,-7.56966,-6.28,-1.0,-5.123004303658399
CCSc1nnc2c3c4c(sc3nc(C3CC3)n12)CCCC4,C00413649_decoy,CASP3,Decoy,0,-7.7371,-5.44,-1.06,-5.53824516920735
CSc1nc(N2CCCC2)c2c3c(sc2n1)COC(C)(C)C3,C00553419_decoy,CASP3,Decoy,0,-8.75347,-4.75,-0.72,-5.454641865572096
O=c1cc(COc2cc(Cl)cc(Cl)c2)nc2sccn12,C05038276_decoy,CASP3,Decoy,0,-8.40921,-5.65,-1.74,-6.513203045085098
Cc1ccc(-c2nnc3sc(Cc4cccs4)nn23)cc1,C00530310_decoy,CASP3,Decoy,0,-6.18475,-5.11,-0.25,-3.8599766546819487
CCSC1=N/C(=C\c2cc3c(cc2Cl)OCO3)C(=O)S1,C05102072_decoy,CASP3,Decoy,0,-7.35115,-5.57,-0.83,-5.94493900539908
Cc1cccc(-c2nc3s/c(=C/c4cccc(F)c4)c(=O)n3n2)c1,C06202292_decoy,CASP3,Decoy,0,-7.38026,-5.99,-0.89,-4.239482996371092
C[C@@H]1CCc2c(-c3nnc(S)n3C[C@@H]3CCCO3)csc2C1,C06250343_decoy,CASP3,Decoy,0,-8.39367,-5.34,-0.65,-6.360662892072346
CCCc1nnc2sc(-c3ccc(Br)cc3)nn12,C06669718_decoy,CASP3,Decoy,0,-6.79386,-5.57,-0.23,-4.329879059168798
Cc1ccc(-c2csc3ncnc(Sc4ncccn4)c23)cc1,C03354001_decoy,CASP3,Decoy,0,-8.25441,-6.14,-1.94,-6.835923135011131
O=C(/C=C/c1ccco1)N1CCc2nc(-c3ccccc3)sc2C1,C06758622_decoy,CASP3,Decoy,0,-7.37145,-5.91,-2.14,-5.545511804329183
Cc1cc2c(cc3c(SCc4ccccc4F)nnc(C)n32)o1,C06894156_decoy,CASP3,Decoy,0,-6.65885,-6.17,-2.68,-4.709098304861082
O=C1C[C@@H](c2cccs2)Cc2c1cnn2-c1nc2ccccc2s1,C10157232_decoy,CASP3,Decoy,0,-8.50708,-5.71,-1.45,-5.391474986461104
Cc1nn(-c2ccccn2)c2nc(-c3ccc(Cl)cc3)ccc12,C06820316_decoy,CASP3,Decoy,0,-6.87253,-6.33,-1.32,-5.258988529102316
Cc1ccc(-n2cc(-c3ccccc3)c3c(N(C)C)ncnc32)cc1,C08412665_decoy,CASP3,Decoy,0,-6.63867,-5.78,-1.53,-5.044941695654599
CC1(C)Cc2c(C#N)c(N3CCCCC3)nc(-c3ccccc3)c2CO1,C19118147_decoy,CASP3,Decoy,0,-7.40854,-6.42,-1.12,-5.361096016325068
Cc1c(C(=O)N(C)c2ccccc2)cnn1-c1ccc(Cl)cc1,C25181799_decoy,CASP3,Decoy,0,-6.50611,-7.13,-1.69,-5.8827734782792
c1ccc2oc(N3CCC(c4nc5ccccc5s4)CC3)nc2c1,C25249681_decoy,CASP3,Decoy,0,-7.48817,-6.12,-0.9,-5.055399518354721
CC(C)=C[C@H]1[C@H](C(=O)N2CCN(c3nccs3)CC2)C1(C)C,C25468083_decoy,CASP3,Decoy,0,-8.53041,-5.23,-2.26,-6.279556553553091
CCCSc1nc2sc3c(c2c2nnc(C)n12)[C@@H](C)CCC3,C34788981_decoy,CASP3,Decoy,0,-9.10805,-5.97,-2.0,-5.9387589929420415
C[C@@H]1CCN(C(=O)c2ccc(-n3cccn3)cc2)c2ccccc2S1,C36619855_decoy,CASP3,Decoy,0,-6.20827,-5.63,-4.15,-4.717214137356216
c1ccc(N2CCN(c3ncnc4sc5c(c34)CCC5)CC2)cc1,C00447038_decoy,CASP3,Decoy,0,-8.62384,-5.94,-0.76,-5.674470619846721
CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@H]4CCC(=O)O[C@@]4(C)CC[C@@H]32)C1,C05632086_decoy,CASP3,Decoy,0,-7.3838,-5.76,-3.68,-4.883646350156358
CC1=N[C@H]2C=CC([C@@H]3N=NC(=S)N3Cc3ccccc3)=CC2=C1C,C39960562_decoy,CASP3,Decoy,0,-6.3983,-5.75,,99.0
Cc1nn(C)c(=O)c(-c2nc(-c3ccc(Cl)s3)cs2)c1C,C40071790_decoy,CASP3,Decoy,0,-7.06808,-5.13,-2.19,-4.901834403895143
Cc1cc(C)c([C@H](C)Sc2nnc3cc(C)nc(C)n23)c(C)c1,C40157837_decoy,CASP3,Decoy,0,-6.60063,-6.55,-0.4,-6.223891363840709
CC(C)(C)n1cc(C#N)c2c(C(F)(F)F)nc(C(F)(F)F)nc21,C40566633_decoy,CASP3,Decoy,0,-4.81215,-5.68,-4.71,-4.053150783868148
O=C(Cc1cn2cc(Cl)ccc2n1)N1CCCc2ccccc21,C41283674_decoy,CASP3,Decoy,0,-5.51379,-6.5,-1.51,-5.899453218052172
C[C@@H]1CCC(=O)[C@H](Cc2ccc([N+](=O)[O-])cc2Br)C1,C43652206_decoy,CASP3,Decoy,0,-5.86227,-4.95,-1.06,-4.591481053713247
O=C(Oc1ccc2c(c1)OCO2)c1csc(Br)c1,C45158231_decoy,CASP3,Decoy,0,-6.34483,-4.8,-0.59,-3.871669649633872
Cc1ccc2c(c1)S[C@@H](C(=O)Oc1ccc3c(c1)OCO3)C2,C45726227_decoy,CASP3,Decoy,0,-7.51759,-6.71,-1.48,-4.691542572348449
Cc1ccc(S(=O)(=O)Cc2cc(Cl)c3c(c2)OCO3)c(C)c1,C47654850_decoy,CASP3,Decoy,0,-7.47558,-6.65,-2.05,-4.5702129047831015
Cc1cc(-n2nc(-c3ccccc3)c(CCl)c2Cl)ncn1,C49960849_decoy,CASP3,Decoy,0,-6.45294,-5.73,-1.8,-4.859912210456477
O=C(Oc1ccccc1Br)c1cnc2ccccc2n1,C21901366_decoy,CASP3,Decoy,0,-7.6834,-5.34,-3.42,-3.9084532082600862
Cc1ccc(-n2nnnc2S[C@@H]2CCCc3ccccc32)cc1,C58986263_decoy,CASP3,Decoy,0,-5.56867,-5.6,-0.63,-5.034468133571025
N#Cc1cccc(C(=O)/C=C/c2cc(Cl)c3c(c2)OCO3)c1,C59270147_decoy,CASP3,Decoy,0,-6.70399,-6.34,-1.53,-4.511170687542141
Cc1cc(OC(=O)c2cn3c(C)cccc3n2)cc(C)c1Cl,C59281613_decoy,CASP3,Decoy,0,-6.0678,-6.62,-4.93,-5.103658077505752
Brc1cccc(/C=N/c2nnc(-c3ccccc3)o2)c1,C59501930_decoy,CASP3,Decoy,0,-7.14056,-6.2,-1.36,-5.243229973565573
N#Cc1c(-c2ccc(F)cc2)nc2sc(C3CCCCC3)nn12,C62394982_decoy,CASP3,Decoy,0,-7.9136,-6.1,-1.9,-4.5783156526933695
CCCc1nn2c(C#N)c(-c3ccc4ccccc4c3)nc2s1,C62395012_decoy,CASP3,Decoy,0,-5.16726,-5.79,-1.96,-4.115642511998745
Cc1cc(-c2cc(C#N)nn2-c2cccc3cccnc23)ccc1F,C62399095_decoy,CASP3,Decoy,0,-6.61456,-7.39,-3.27,-5.621361108624818
CC1=C2[C@H](N=N1)C(=O)N(c1ccc(C)cc1)[C@H]2c1ccc(F)cc1,C01260941_decoy,CASP3,Decoy,0,-6.51377,-5.85,-0.48,-5.13543399084583
Cc1ccc(-c2nc(C(=O)N3C[C@H](C)OC(C)(C)C3)cs2)cc1,C65609590_decoy,CASP3,Decoy,0,-6.83834,-5.65,-2.13,-4.917360855431088
Clc1cc2c(cc1SCc1nnsc1Cl)OCCO2,C66262444_decoy,CASP3,Decoy,0,-9.2811,-5.47,-1.69,-8.29097836367327
Cc1cc(F)cc2c1N(C(=O)[C@H]1CCCN(C(=O)C(C)C)C1)CCC2,C66786337_decoy,CASP3,Decoy,0,-5.84523,-6.1,-2.23,-4.620362859343478
CC(C)(C)C(=O)N1CCCN(c2nc3ccccc3s2)CC1,C66816302_decoy,CASP3,Decoy,0,-5.43718,-5.78,-1.45,-5.012432528903978
Clc1ccc(-c2cc3c(N4CCCCC4)nccn3n2)cc1,C67284741_decoy,CASP3,Decoy,0,-5.77894,-5.3,-1.63,-5.298696091958627
Cc1nn(-c2ccc(C(C)(C)C)cc2)c(=O)c2noc(C)c12,C00119514_decoy,CASP3,Decoy,0,-6.43337,-6.63,-2.43,-5.102732758690833
O=Cc1ccc(N2CCc3ccccc3C2)c([N+](=O)[O-])c1,C04342757_decoy,CASP3,Decoy,0,-5.03301,-6.04,-0.28,-4.967146407080414
CC(C)[C@H]1CC[C@H](C)[C@@H](C(C#N)(C#N)C(C#N)C#N)C1=O,C04481968_decoy,CASP3,Decoy,0,-6.03868,-4.86,-1.69,-3.407837567110467
C(=N/n1cnc2ccccc21)\c1ccc2c(c1)OCO2,C04566749_decoy,CASP3,Decoy,0,-6.57194,-6.21,-1.21,-5.860047949547088
Clc1cccc2nnc(-c3ccc4c(c3)OCO4)n12,C00091004_decoy,CASP3,Decoy,0,-6.52177,-6.68,-0.9,-5.390334902671169
Cc1ccc(-c2nnc(S)n2/N=C\c2ccncc2)cc1,C04754975_decoy,CASP3,Decoy,0,-6.37499,-4.73,0.61,-4.574823467026287
Cn1c(/C=N/c2nc3ccccc3n2C)nc2ccccc21,C00437857_decoy,CASP3,Decoy,0,-6.48127,-5.78,-0.69,-4.595959266588255
C[C@@H]1CN(C(=S)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1,C00616404_decoy,CASP3,Decoy,0,-6.19986,-5.24,-1.95,-5.182709296762388
CCN(CC)c1nc2sc3c(c2c2ncnn12)CCCC3,C05557451_decoy,CASP3,Decoy,0,-8.35604,-5.04,-1.12,-5.6637757769564585
c1csc(-c2nnsc2-n2nnc3ccccc32)c1,C05778292_decoy,CASP3,Decoy,0,-7.65343,-5.12,-1.96,-5.2946523639698
Cc1ccc(C2=NO[C@H](Cn3nnc4ccccc43)C2)cc1,C05928729_decoy,CASP3,Decoy,0,-5.70411,-6.15,-1.69,-4.044651225630675
Cc1nnc2c(SCc3ccco3)nc3ccccc3n12,C06703044_decoy,CASP3,Decoy,0,-6.71215,-6.35,-2.88,-4.7686265405111055
c1ccc2nc(-c3nc4c5ccccc5ncn4n3)ccc2c1,C06760716_decoy,CASP3,Decoy,0,-6.32315,-6.02,-1.48,-4.17044863632523
Fc1cccc(-c2nnc3sc(-c4cccnc4)nn23)c1,C12428792_decoy,CASP3,Decoy,0,-6.69968,-5.39,-1.78,-3.716050476730585
O=C1C[C@H](c2ccc(Cl)cc2)Cc2nc3ncnn3cc21,C12653464_decoy,CASP3,Decoy,0,-6.60987,-5.02,-0.64,-3.933045421162431
CCc1cc(-n2ccnc2)n2c(nc3ccccc32)c1C#N,C08778673_decoy,CASP3,Decoy,0,-5.34005,-5.42,-1.94,-4.377711555714016
Clc1ccc(Sc2ccc3nnnn3n2)cc1,C14728739_decoy,CASP3,Decoy,0,-6.20101,-7.43,-0.96,-6.682349022159394
O=c1oc2cc(Oc3ccc(Cl)nn3)ccc2s1,C19814295_decoy,CASP3,Decoy,0,-7.60691,-5.34,-3.23,-5.399671902775871
C[C@@H](C#N)c1c(-c2ccc3c(c2)OCO3)nc2ccccn12,C31915665_decoy,CASP3,Decoy,0,-6.88344,-7.0,-1.02,-5.703668408972477
Cc1cccc2nc(-c3ccc4c(c3)OCO4)c(CC#N)n12,C31916121_decoy,CASP3,Decoy,0,-6.68823,-7.07,-1.81,-5.474710961332259
Cc1cn2c(CC#N)c(-c3ccc4c(c3)OCO4)nc2s1,C36256955_decoy,CASP3,Decoy,0,-6.99038,-5.94,-0.29,-5.031997106240083
Cc1cc(=O)n2nc(Oc3cccc(C)c3C)sc2n1,C36392653_decoy,CASP3,Decoy,0,-6.79342,-5.75,-4.38,-4.658921475757904
O=[N+]([O-])c1ccc(Sc2nsnc2Cl)cc1,C37372590_decoy,CASP3,Decoy,0,-5.99766,-4.5,-0.58,-3.5407132605758944
N#C[C@@H]1CCCC[C@H]1Sc1nnnn1C1CCCC1,C37155279_decoy,CASP3,Decoy,0,-7.78074,-6.62,0.21,-6.285768930411475
N#Cc1onc2ccc3c(ncn3Cc3ccccc3)c12,C40177412_decoy,CASP3,Decoy,0,-7.00398,-5.81,-1.4,-5.811235418118856
Fc1ccccc1-c1nnc2sc(-c3ccncc3)nn12,C40286503_decoy,CASP3,Decoy,0,-6.84307,-5.62,-0.09,-5.784999670718385
O=[N+]([O-])c1cc(Br)cnc1OC1CCCC1,C42388918_decoy,CASP3,Decoy,0,-4.9129,-4.57,-0.96,-2.70695822004121
C/C(=C\c1sc(N2CCCCC2)nc1C)[N+](=O)[O-],C42905693_decoy,CASP3,Decoy,0,-6.2816,-5.27,-0.24,-4.580272781102095
Clc1ccc2nnc(-c3nccc4ccccc34)n2n1,C43512874_decoy,CASP3,Decoy,0,-7.00736,-6.8,-1.14,-5.191534017759088
O=C1OC(c2ccccc2)=N/C1=C\c1cccc2c1OCO2,C44252312_decoy,CASP3,Decoy,0,-6.45825,-6.47,-0.82,-4.45002700659849
Cc1cccc(N2C[C@@H](c3nc(C(C)(C)C)no3)CC2=O)c1,C44434988_decoy,CASP3,Decoy,0,-5.78504,-6.38,-0.89,-4.778713318049839
Cc1ccc(-n2nnnc2N(C)C2CCCCC2)cc1,C48607704_decoy,CASP3,Decoy,0,-6.69969,-5.46,-0.37,-4.938398864896529
O=[N+]([O-])c1c(F)cccc1-n1ccc(C(F)(F)F)n1,C54269770_decoy,CASP3,Decoy,0,-3.54784,-5.21,-1.03,-3.5570517840430167
Cc1nc2sccn2c1/C=C(\c1ccccc1)[N+](=O)[O-],C54684991_decoy,CASP3,Decoy,0,-7.5414,-5.49,-0.71,-6.53553746467695
Cc1ccc([C@@H]2CC(c3cccs3)=Nc3nnnn32)cc1,C00221929_decoy,CASP3,Decoy,0,-6.98449,-6.68,0.02,-6.302926565910986
C[C@@H](C#N)Cn1c(-c2ccncc2)nc2cc(Cl)cnc21,C57831950_decoy,CASP3,Decoy,0,-6.54306,-5.16,-0.95,-4.911915428509334
Cc1ccc2c(c1)nnn2C(=O)c1ccc(N(C)C)cc1,C58902182_decoy,CASP3,Decoy,0,-5.28871,-5.3,0.13,-3.829564548807359
Cc1ccc2c(c1)nnn2C(=O)c1cccc(N(C)C)c1,C58902219_decoy,CASP3,Decoy,0,-5.25057,-6.93,-0.69,-4.950925379626945
COc1nc(Cl)nc(N2Cc3ccccc3C2)n1,C61515181_decoy,CASP3,Decoy,0,-6.5955,-5.12,-0.86,-4.750300252260719
CN(C[C@@H]1CCCCO1)c1nc(Cl)nc(Cl)n1,C61518528_decoy,CASP3,Decoy,0,-7.15798,-4.91,-0.5,-4.95677268042992
Clc1nc(Cl)nc(-n2ncc3ccccc32)n1,C61519307_decoy,CASP3,Decoy,0,-6.26083,-5.86,-1.58,-4.257991308170699
CN(c1nc(Cl)nc(N2CCCCC2)n1)C1CC1,C61537015_decoy,CASP3,Decoy,0,-7.04942,-4.75,-2.47,-5.248369554066063
Clc1nc(Sc2cccs2)nc(-n2cccn2)n1,C61543303_decoy,CASP3,Decoy,0,-7.63577,-4.45,-0.91,-5.277336353567225
COc1ccc(-c2c(C#N)nnn2-c2ccccc2C)cc1,C62244496_decoy,CASP3,Decoy,0,-5.82595,-5.69,-0.27,-5.256307782236642
COc1ccc(-c2c(C#N)nnn2-c2ccc(C)cc2)cc1,C62247916_decoy,CASP3,Decoy,0,-5.85655,-5.29,-0.62,-4.75143993768196
Cc1csc(-n2nnc(C#N)c2Cc2ccccc2)n1,C62425853_decoy,CASP3,Decoy,0,-6.98397,-6.36,-1.15,-4.0544637690195096
Cn1ncc2c(Cl)nc(COC3CCCCCC3)nc21,C63078857_decoy,CASP3,Decoy,0,-7.33935,-5.58,-0.7,-5.161174864924143
Cc1ccc([C@H](C)N(C)c2ncnc3c2cnn3C)c(C)c1,C65410982_decoy,CASP3,Decoy,0,-6.41489,-5.9,-0.69,-6.2798386960071095
Clc1cccc2c1cnn2-c1cccc(-n2cnnc2)c1,C65469334_decoy,CASP3,Decoy,0,-6.4536,-6.25,-0.22,-5.102474744136228
N#Cc1ccc(OC(=O)c2cn3ccccc3n2)cc1F,C66804375_decoy,CASP3,Decoy,0,-5.91681,-6.02,-1.81,-4.651742502363702
CCc1nnc2c3cc(-c4ccccc4)sc3ncn12,C00091902_decoy,CASP3,Decoy,0,-5.49019,-4.97,-1.82,-3.854296636009107
O=C(/C=C/c1ccc2c(c1)OCO2)N1CCc2ccccc21,C00068264_decoy,CASP3,Decoy,0,-6.59402,-6.54,-0.84,-5.571643667365638
N#C/C(=C/c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1,C02549009_decoy,CASP3,Decoy,0,-6.22526,-6.52,-3.34,-5.409680427154544
C/C(=N/N1CCN(c2ccc(Cl)cc2)CC1)c1ccco1,C00473185_decoy,CASP3,Decoy,0,-7.15197,-5.64,-1.84,-4.123872584007984
CN(C)c1ccc(/C=N/c2ccc3oc(=O)ccc3c2)cc1,C00289174_decoy,CASP3,Decoy,0,-6.45494,-5.21,-1.13,-5.230975753806167
O=[N+]([O-])c1ccc2c3c1[C@H]1C=CC[C@@H]1CN3C[C@@H]1CC=C[C@H]21,C05390784_decoy,CASP3,Decoy,0,-5.20402,-6.01,0.02,-3.234449460560936
CCc1cc2c(=O)n(/N=C/c3ccc(C)cc3)cnc2s1,C05911273_decoy,CASP3,Decoy,0,-6.70065,-5.8,-1.64,-4.577756466120657
Cc1cccc(CSc2nnc3nc(C)cc(C)n23)c1,C06326450_decoy,CASP3,Decoy,0,-6.17066,-6.13,-0.16,-5.391916339777999
Clc1ccc2c(Sc3nnc4ccccn34)ccnc2c1,C07982247_decoy,CASP3,Decoy,0,-6.68964,-6.14,-2.14,-4.788809146354146
C[C@H]1C[C@@H]1c1ccc(/C=C2\N=C(c3cccs3)OC2=O)o1,C08111619_decoy,CASP3,Decoy,0,-7.38417,-5.32,-1.36,-4.045588001488422
C[C@H]1C[C@H]1c1ccc(/C=C2\N=C(c3cccs3)OC2=O)o1,C08111631_decoy,CASP3,Decoy,0,-7.43898,-5.26,-0.41,-5.537233469938017
N#Cc1ccccc1Oc1ncnc2sc3c(c12)CCC3,C08177773_decoy,CASP3,Decoy,0,-7.48929,-7.1,-0.98,-5.761563293451177
Cc1cc(C)n2nc(S[C@@H](C)c3ccc(F)cc3)nc2n1,C08621581_decoy,CASP3,Decoy,0,-7.44613,-5.55,-3.05,-5.432439542160124
N#CCCSc1nc2ccccc2c2nc3ccccc3n12,C08760756_decoy,CASP3,Decoy,0,-5.42116,-5.66,-1.09,-4.916609390393532
CCc1nnc2sc(-c3ccc(Br)cc3)nn12,C13945090_decoy,CASP3,Decoy,0,-7.07795,-4.64,-1.35,-4.611607876697756
C=C1CC[C@H]([C@@H]2CC(=O)OC2=O)C(=O)CC[C@H]2[C@H]1CC2(C)C,C15449181_decoy,CASP3,Decoy,0,-7.57439,-5.27,-0.16,-3.584448514730725
O=Cc1ccc(Oc2ccc3sc(=O)oc3c2)c(F)c1,C20079287_decoy,CASP3,Decoy,0,-7.27903,-7.0,-1.07,-6.233549678633271
COc1ccc(N2C=Nc3ccc(C)c4nc(C)cc2c34)cc1,C22078744_decoy,CASP3,Decoy,0,-5.9944,-5.43,-3.71,-4.219247898966911
CC(C)(C)c1nn2c(C=O)c(-c3cccs3)nc2s1,C31974638_decoy,CASP3,Decoy,0,-7.55519,-6.0,-2.2,-5.24976431371101
Cc1cccc2nc(-c3ccc4c(c3)OCO4)c(CCl)n12,C31914851_decoy,CASP3,Decoy,0,-7.27604,-5.98,-0.61,-5.08573650725466
N#Cc1ccccc1Cn1c(-c2ccncc2)nc2ccccc21,C31936523_decoy,CASP3,Decoy,0,-7.10536,-6.85,-2.7,-6.42480889314388
O=C(c1ccn(C2CCCC2)n1)N1CCCc2ccccc21,C32611583_decoy,CASP3,Decoy,0,-6.04836,-6.93,-1.42,-5.281284786984837
COc1ccc(-c2csc3nc(C)c(CC#N)n23)cc1C,C36255872_decoy,CASP3,Decoy,0,-7.37955,-4.92,-1.95,-5.350123906063822
CC(C)(C)c1nc2scc(-c3ccncc3)n2c1CC#N,C36256068_decoy,CASP3,Decoy,0,-7.16434,-4.45,-3.06,-5.201935331729573
N#C[C@@H]1CCCCC[C@H]1Sc1nnc2n1CCCCC2,C37155231_decoy,CASP3,Decoy,0,-7.40329,-6.24,-0.07,-5.822095440701421
Clc1cc2c(c(Cn3cnc4ccccc43)c1)OCOC2,C00108780_decoy,CASP3,Decoy,0,-6.38353,-6.8,-2.32,-5.081556079113038
CSc1nc2cc(C)nn2c(-c2ccccc2Cl)c1C#N,C00094791_decoy,CASP3,Decoy,0,-8.61189,-4.93,-1.83,-5.362205406946375
CCC[C@@H]1Cc2nc(N3CCCCC3)c(C#N)cc2CO1,C19873267_decoy,CASP3,Decoy,0,-6.64726,-5.06,-1.6,-4.708048134804742
CCc1cnn2c1N=C(C1Cc3ccccc3C1)CC2=O,C39955944_decoy,CASP3,Decoy,0,-6.23161,-7.43,0.12,-6.422830348028377
Clc1cccc(N2CCN(c3nccnc3Cl)CC2)c1,C43537029_decoy,CASP3,Decoy,0,-7.48177,-5.39,-1.28,-6.749307437068162
Cc1csc(Sc2ncnc3c2oc2ccccc23)n1,C46229640_decoy,CASP3,Decoy,0,-7.31021,-6.27,-0.87,-5.169258297824404
ClCc1c(-n2ncc3ccccc32)nc2ccccn12,C50526453_decoy,CASP3,Decoy,0,-6.13954,-5.44,-2.25,-4.621150672063364
Clc1nnc(-n2cc(Br)cn2)c2ccccc12,C50530602_decoy,CASP3,Decoy,0,-6.58701,-5.54,-3.33,-4.314474401769798
Clc1ccc([C@H]2CC(c3cccs3)=Nc3ncnn32)cc1,C00222025_decoy,CASP3,Decoy,0,-6.93494,-5.56,-1.92,-5.453546079551816
CC[C@@H]1CO[C@@H](C)CN1c1nc2c(s1)C(=O)CC(C)(C)C2,C54863498_decoy,CASP3,Decoy,0,-7.9998,-5.17,-2.88,-4.951588611245202
C[C@@H]1CN(c2nc(C(C)(C)C)c(C=O)s2)C[C@H](C)O1,C54967148_decoy,CASP3,Decoy,0,-6.87169,-4.29,-2.66,-4.481679153440354
C[C@H]1CN(c2nc(C(C)(C)C)c(C=O)s2)C[C@H](C)O1,C54967149_decoy,CASP3,Decoy,0,-6.59972,-5.8,-0.41,-5.418997665328524
Cc1c2c(cc3c4c(c(=O)oc13)CCCC4)CN(C1CC1)CO2,C57134939_decoy,CASP3,Decoy,0,-6.99218,-6.04,-0.36,-4.5765590294041045
Cc1cccc(-c2nc3cc(Cl)cnc3n2CCC#N)c1,C57792757_decoy,CASP3,Decoy,0,-7.78238,-5.38,-3.14,-5.812381368668077
Cc1cnc2c(c1)nc(-c1ccccc1F)n2C[C@H](C)C#N,C57831684_decoy,CASP3,Decoy,0,-5.99377,-5.26,-1.81,-3.8308080486523775
Cc1sc2ncnc(Sc3ncc4ccccn34)c2c1C,C18901210_decoy,CASP3,Decoy,0,-8.34392,-5.31,-1.45,-5.576902294864357
Cc1cccc(-c2nnc(S[C@@H]3CCCCC3=O)o2)c1,C04926558_decoy,CASP3,Decoy,0,-6.72873,-5.66,-1.13,-5.267299484860259
Cc1ccn2c(/N=C/c3ccncc3)c(-c3ccoc3)cc2c1,C59434517_decoy,CASP3,Decoy,0,-6.75566,-5.35,-4.41,-5.353650761569611
O=Cc1c(N2CCC3(CCCCC3)CC2)nc2sccn12,C61820441_decoy,CASP3,Decoy,0,-9.16563,-5.78,-0.44,-6.227933237053644
Cc1ccccc1Cn1nnc(C#N)c1-c1ccc(F)c(F)c1,C62287577_decoy,CASP3,Decoy,0,-6.28527,-5.93,-1.26,-5.157577045071539
C[C@H](Br)Cc1ccc2scnc2c1[N+](=O)[O-],C63044422_decoy,CASP3,Decoy,0,-7.43584,-3.84,-4.38,-3.575987273898418
Cc1cc(C)c2c(c1)N=C(C(=O)/N=c1/sccn1C)C2,C29650044_decoy,CASP3,Decoy,0,-6.52693,-5.7,-1.25,-4.854616385832169
CCC1=C(C)[C@H](CN2CCC3=Nc4ccccc4[C@@H]3C2)N=N1,C39536937_decoy,CASP3,Decoy,0,-6.41,-5.79,-1.3,-4.94716968592061
Cc1ccc(/C=C(/C#N)c2nnc(-c3ccccc3)n2C)s1,C66408215_decoy,CASP3,Decoy,0,-5.87812,-5.38,-1.29,-4.100381728461892
Cc1ccc(F)c2c1N(C(=O)c1ccc3nccn3c1)CCC2,C66786897_decoy,CASP3,Decoy,0,-4.667,-5.95,-4.98,-4.790638033879518
CSc1nnc(N(C(=O)c2c(F)cccc2F)C(=O)N(C)C)s1,C01045830_decoy,CASP3,Decoy,0,-3.70133,-5.17,-0.48,-4.589271450134938
Cc1nc(N2CCN(C=O)CC2)nc2c1C(=O)C[C@@H](c1cccs1)C2,C05274322_decoy,CASP3,Decoy,0,-8.57372,-5.5,-0.93,-5.206097332616215
CN(C)c1ccc(N2/C(=N/C(=O)C3CC3)S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1,C05246050_decoy,CASP3,Decoy,0,-7.77135,-5.53,-1.35,-6.190762889281188
Cc1c(Cl)c(C(F)F)nn1[C@H](C)C(=O)N1CCC2(CC1)OCCO2,C02774971_decoy,CASP3,Decoy,0,-6.96771,-6.3,-2.96,-5.3561989416867055
Cc1ccc([C@H]2[C@@H]3C(=O)C[C@H](c4ccco4)CC3=Nc3nc(C)nn32)cc1,C09171048_decoy,CASP3,Decoy,0,-8.38027,-7.04,-0.56,-6.568729603977442
O=c1c2c3c(sc2ncn1Cc1cc(=O)n2ccccc2n1)CCC3,C10497772_decoy,CASP3,Decoy,0,-8.3378,-6.9,-1.62,-5.652901200739248
O=C(c1ccc(Br)o1)N1CCC[C@@H](c2nnc3ccccn23)C1,C12323109_decoy,CASP3,Decoy,0,-6.53465,-6.49,-1.31,-4.555941881753177
CC(=O)N1CCCN(C(=O)c2csc3nc(-c4ccccc4C)cn23)CC1,C12316178_decoy,CASP3,Decoy,0,-6.73875,-6.0,-1.78,-5.73085443491425
O=C(/C=C/c1ccc(Br)o1)N1CCN(C(=O)c2ccco2)CC1,C12789807_decoy,CASP3,Decoy,0,-6.36446,-5.98,-2.43,-4.611791663220189
CC(C)c1ccc(N2/C(=N/C(=O)CC#N)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1,C06658864_decoy,CASP3,Decoy,0,-8.68296,-5.2,-1.69,-5.723615289849619
Cn1ccc(C(=O)N2CCN(c3nc4c(F)cc(F)cc4s3)CC2)n1,C13667602_decoy,CASP3,Decoy,0,-7.9656,-6.83,-0.72,-4.747971940522466
CN(c1cnn([C@H]2CCS(=O)(=O)C2)c(=O)c1Cl)C1CCCCC1,C14183587_decoy,CASP3,Decoy,0,-7.36999,-5.66,-1.53,-5.859299576558359
O=C(c1ccc(N2C(=O)CCS2(=O)=O)cc1)N1CCCc2ccccc21,C19797391_decoy,CASP3,Decoy,0,-5.37882,-7.12,-1.48,-5.0068416325453455
COc1c2c(cc3c1[C@@H](C#CCN1CCOCC1)N(C)CC3)OCO2,C20113186_decoy,CASP3,Decoy,0,-7.53268,-5.74,-3.82,-5.100407454088808
Cc1nc2ncnn2c(C)c1CCC(=O)N1CCCSc2ccccc21,C24550266_decoy,CASP3,Decoy,0,-6.58951,-6.02,-1.36,-5.288913544748482
Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)N1CCC2(CC1)OCCO2,C28023922_decoy,CASP3,Decoy,0,-6.56405,-7.14,-2.77,-5.129954734170501
CC(=O)N(C(C)=O)c1c(C#N)c2ccccc2n1C(=O)c1ccccc1,C28535238_decoy,CASP3,Decoy,0,-5.30562,-6.24,-1.14,-6.002033154756711
O=C([C@@H]1CCCN(c2nc3ncccc3n3cccc23)C1)N1CCCC1,C33018730_decoy,CASP3,Decoy,0,-6.26512,-6.22,-1.61,-4.58506310015443
O=C([C@@H]1C[C@@H]1c1ccccc1)N1CCN(c2nc3cccnc3o2)CC1,C33027264_decoy,CASP3,Decoy,0,-7.00661,-6.02,-0.92,-5.14124475104666
CC1CCC2(CC1)OC[C@H](C(=O)N1CCN(C)CC1)N2C(=O)CC(C)(C)C,C34854635_decoy,CASP3,Decoy,0,-6.76157,-5.64,-1.47,-5.400533771274791
C[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1I,C35776310_decoy,CASP3,Decoy,0,-5.55813,-4.82,-0.7,-4.4684067605850055
CC(=O)N1CCN(C(=O)c2cc3sccc3n2C[C@@H]2CCCCO2)CC1,C35811126_decoy,CASP3,Decoy,0,-8.53687,-5.36,-1.94,-6.4691238811006455
COCc1nc(N2CCN(C(C)=O)CC2)c2c3c(sc2n1)CCCC3,C35848949_decoy,CASP3,Decoy,0,-7.9565,-5.9,-1.02,-8.080653905572719
O=C1[C@@H]2[C@@H](C(=O)N1c1ccn(Cc3ccc(Cl)cc3)n1)[C@H]1CC[C@@H]2O1,C13960407_decoy,CASP3,Decoy,0,-8.07479,-7.92,-2.49,-7.427239463249784
CC(C)N1CCN(S(=O)(=O)c2c(Cl)nc3sccn23)CC1,C37555885_decoy,CASP3,Decoy,0,-8.59301,-5.73,-0.61,-6.269085797790128
C[C@@H]1C[C@H](C)CN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)C1,C34872636_decoy,CASP3,Decoy,0,-7.83914,-6.55,-0.79,-6.826666399938832
O=C(c1ccco1)N1CCN(C2=NN=C(c3cccs3)CS2)CC1,C36709959_decoy,CASP3,Decoy,0,-8.12062,-5.51,-2.18,-5.032563196355505
O=C(/N=C1\N=N[C@H](C2CC2)S1)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1,C38581089_decoy,CASP3,Decoy,0,-6.76141,-5.68,-1.03,-4.8006270242933295
CCn1c([C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)nc2ccccc21,C40182478_decoy,CASP3,Decoy,0,-7.51481,-7.09,-1.22,-6.515240608637699
Cc1ccc(C)c(-c2cc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)nn2C)c1,C41211799_decoy,CASP3,Decoy,0,-7.11876,-6.67,-0.69,-5.483043867198574
Cc1ccc(C(=O)N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc1C,C41246485_decoy,CASP3,Decoy,0,-6.19495,-7.11,-1.37,-4.793879547188057
Cc1cccc(C(=O)N2CCN([C@H](C#N)c3ccc4c(c3)OCO4)CC2)c1,C41260606_decoy,CASP3,Decoy,0,-7.97439,-6.21,-3.72,-5.086710948969153
Cc1ccc(-n2nc(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)cc2C)cc1C,C41455838_decoy,CASP3,Decoy,0,-7.40239,-7.13,-1.06,-6.018485309057183
C[C@H]1Cc2nnc(SCC3=NC(=O)[C@H]4SC=CC4=N3)n2-c2ccccc21,C44662686_decoy,CASP3,Decoy,0,-7.56446,-7.02,-1.08,-5.816592160209883
Cc1cc(=O)c(C(=O)N2C[C@@H](C)OC[C@H]2C)nn1-c1ccccc1F,C44909512_decoy,CASP3,Decoy,0,-6.86824,-6.68,-1.8,-6.625077038832547
C[C@@H]1CN(C(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C[C@H](C)O1,C46698326_decoy,CASP3,Decoy,0,-6.67186,-7.57,-2.24,-7.74252531881837
Cn1c(=O)c2sccc2n2c(CN3CCc4sccc4C3)nnc12,C47279925_decoy,CASP3,Decoy,0,-8.43056,-5.59,-0.24,-6.048701448572472
O=C(c1ccc(Cl)s1)N1CCC(n2cc(-c3ccccn3)nn2)CC1,C48302712_decoy,CASP3,Decoy,0,-7.91217,-5.9,-0.06,-5.128223857126289
Cc1cccc2nc(Cn3nc(-c4ccccc4)ccc3=O)cc(=O)n12,C48375203_decoy,CASP3,Decoy,0,-5.99229,-7.67,-1.07,-6.097716778042528
CN(C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)c1ccc(F)c(F)c1,C56227615_decoy,CASP3,Decoy,0,-8.09362,-6.86,-3.85,-6.012539241803854
Cc1ccccc1CC(=O)N1CCN(C(=O)c2cn3c(C)cccc3n2)CC1,C58354841_decoy,CASP3,Decoy,0,-6.25465,-6.15,-2.27,-4.774698517140869
CC(=O)C1=NN(c2ccc(C)cc2)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12,C04281866_decoy,CASP3,Decoy,0,-7.34667,-5.89,-0.5,-7.477718652208672
O=C([C@H]1CCC(=O)N1c1ccccc1)N1CCc2cc3c(cc2C1)OCO3,C62217820_decoy,CASP3,Decoy,0,-6.37689,-6.65,-4.41,-5.239838869462169
C[C@@H]1CC(=O)N(C(=O)c2cc([N+](=O)[O-])ccc2I)C1,C62817873_decoy,CASP3,Decoy,0,-4.94259,-5.19,-2.14,-4.470952639548815
CC(=O)N(C)c1nc(/C=C2\N=C(c3cc(F)cc(F)c3)OC2=O)cs1,C63439579_decoy,CASP3,Decoy,0,-7.29205,-6.56,-0.18,-6.2666051105882445
Cc1cccc(N2CCN(C(=O)c3cnc4scc(C)n4c3=O)C[C@@H]2C)c1,C64979069_decoy,CASP3,Decoy,0,-6.42408,-5.53,-0.27,-4.586418800673588
Cc1noc([C@H]2CCCN(C(=O)c3sccc3-n3c(C)ccc3C)C2)n1,C54122165_decoy,CASP3,Decoy,0,-8.10286,-6.91,-1.18,-6.562056610734079
O=C(c1ccccc1)N1CCCN(c2nnc3ccc(Cl)cn23)CC1,C65313129_decoy,CASP3,Decoy,0,-6.50737,-7.09,-0.49,-5.607661541904164
O=C(c1ccc(F)c(F)c1)N1CCN(c2nnc3ccc(Cl)cn23)CC1,C65313283_decoy,CASP3,Decoy,0,-5.39104,-6.41,-0.86,-4.235248327773632
O=C1c2ccccc2CCC[C@@H]1Sc1nnnn1C1CCOCC1,C67430118_decoy,CASP3,Decoy,0,-7.36714,-6.8,-1.83,-5.665381017666539
C[C@@H]1CN(C(=O)c2cc3c(=O)n4ccccc4nc3s2)C[C@@H](C)O1,C00426848_decoy,CASP3,Decoy,0,-6.5844,-6.15,-0.93,-4.399344569019564
Cc1nc2c(c(N3CCC(C)CC3)n1)CN(C(=O)N(C)C)CC2,C04709513_decoy,CASP3,Decoy,0,-5.95289,-5.82,-1.75,-5.068763874457554
CC(=O)N(/C=C1\N=C(c2ccccc2)OC1=O)C1=NCCS1,C01392415_decoy,CASP3,Decoy,0,-5.71969,-5.8,0.46,-3.863497558499843
O=[N+]([O-])c1cccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@H]32)c1,C04883586_decoy,CASP3,Decoy,0,-5.9305,-6.06,0.01,-4.95952538188332
O=[N+]([O-])c1ccccc1N1C(=S)S[C@H]2CS(=O)(=O)C[C@@H]21,C05616643_decoy,CASP3,Decoy,0,-6.70162,-6.39,-0.6,-5.415790309923539
CC1=C2[C@H](CCS2(=O)=O)CC2(C1)C(=O)OC(C)(C)OC2=O,C04337539_decoy,CASP3,Decoy,0,-5.86377,-6.08,-0.43,-3.136730445760296
CC(=O)N1CCN(c2nc3c(S(C)(=O)=O)cccc3s2)CC1,C07599438_decoy,CASP3,Decoy,0,-7.47817,-5.23,-1.37,-6.052053435231995
Cn1nc(C(=O)N2CCC3(CC2)OCCO3)c2c1-c1ccsc1CC2,C09687529_decoy,CASP3,Decoy,0,-7.99201,-6.02,-0.68,-6.693843647174414
N#Cc1ccc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1,C11546947_decoy,CASP3,Decoy,0,-5.95346,-6.37,-1.08,-5.0289770534450975
Cc1nc2n(c(=O)c1C)[C@@H](CC(=O)N1C[C@@H](C)O[C@H](C)C1)CS2,C14034774_decoy,CASP3,Decoy,0,-6.67002,-5.96,-2.68,-4.070270665296903
Cn1ncc(N2CCN(C(=O)c3csc4c3CCCC4)CC2)cc1=O,C20541249_decoy,CASP3,Decoy,0,-7.73641,-6.19,-3.01,-5.209506015018925
CN1CCN(C(=O)C[C@H]2CSc3nc4c(c(=O)n32)CCCC4)CC1,C22768917_decoy,CASP3,Decoy,0,-6.62813,-6.45,-1.79,-5.507759293973129
CC(=O)N1CCN(Cc2cc(=O)n3cc(Br)ccc3n2)CC1,C23584785_decoy,CASP3,Decoy,0,-6.26487,-5.37,-1.65,-5.348995248444059
Cc1nc2ncnc(N3CCN(c4ccccc4)CC3)c2nc1C,C27818130_decoy,CASP3,Decoy,0,-7.16497,-6.16,-1.59,-5.497425826844244
Cc1csc(N2CCN(c3nn4cc(C)nc4s3)CC2)n1,C29585798_decoy,CASP3,Decoy,0,-7.84022,-5.04,-1.58,-4.402925112385693
C[C@@H]1Oc2ccc(-c3csc4ncc(C=O)n34)cc2N(C)C1=O,C31975451_decoy,CASP3,Decoy,0,-6.69463,-7.13,-1.14,-6.671514781487108
Cc1nc(C(=O)/N=c2/sccn2C)nn1-c1ccc(F)cc1,C32808657_decoy,CASP3,Decoy,0,-6.99366,-6.43,-2.61,-5.222816757485235
C[C@H]1COCCN1C(=O)c1cc(Cl)c(Cl)c([N+](=O)[O-])c1,C35236947_decoy,CASP3,Decoy,0,-5.83656,-4.89,-1.71,-4.387890770640549
O=C1[C@@H]2[C@H](C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1C=C[C@H]2CC1,C04110787_decoy,CASP3,Decoy,0,-5.66583,-6.2,-1.65,-4.7773263403862245
C[C@@H]1CN(C(=O)c2cc(Cl)c(Cl)c([N+](=O)[O-])c2)CCO1,C37250455_decoy,CASP3,Decoy,0,-5.70307,-5.22,-0.2,-4.513288682821612
O=C1CN([C@H]2CCS(=O)(=O)C2)C(=O)N1c1ccc(Cl)cc1,C37606556_decoy,CASP3,Decoy,0,-7.0283,-5.28,-0.53,-5.615666580635322
C1CC[C@@H]2OCCOCCO[C@@H]3CCCC[C@@H]3OCCOCCO[C@H]2C1,C12243843_decoy,CASP3,Decoy,0,-6.95862,-5.82,-1.63,-3.57822990337895
C[C@@H]1N=NC=C1c1nnnn1-c1ccc(I)cc1,C39273595_decoy,CASP3,Decoy,0,-6.44999,-4.71,-0.67,-4.862493677988785
Cc1cc(C(=O)N2CCC3=NN=C(c4cccs4)[C@H]3C2)no1,C39405054_decoy,CASP3,Decoy,0,-8.08673,-6.2,-0.78,-5.4988682619889975
C[C@@H]1C=C(c2nn3c(-c4cccc(F)c4F)nnc3s2)N=N1,C39606186_decoy,CASP3,Decoy,0,-7.28856,-7.27,-0.68,-5.765951278505018
CC(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(C)c(C)c3)n2)CC1,C41455819_decoy,CASP3,Decoy,0,-6.8006,-6.24,-1.78,-5.499574158886705
O=C([C@H]1CCC(=O)N1C1CCCC1)N1CCC2(CC1)OCCO2,C00219924_decoy,CASP3,Decoy,0,-7.13635,-5.46,-1.89,-5.684308405099572
Cc1ncsc1C(=O)N1CCC[C@@H](c2nnc3n2CCCCC3)C1,C44939973_decoy,CASP3,Decoy,0,-7.57273,-7.72,-1.94,-7.034729686085919
C[C@H]1CCc2c(sc3ncnc(N4CCN(C(=O)N(C)C)CC4)c23)C1,C46720123_decoy,CASP3,Decoy,0,-7.7502,-6.58,-3.23,-5.781029843993359
Brc1cnc(N2CCN(c3ncccn3)CC2)nc1,C48559496_decoy,CASP3,Decoy,0,-6.36206,-4.57,-0.22,-3.5169245324545466
O=CN1CCN(C(=O)c2nn(-c3ccccc3)c3c2CCC3)CC1,C49679967_decoy,CASP3,Decoy,0,-6.4413,-6.14,-1.65,-5.165672840556597
N#CC(C#N)=c1s/c(=C\c2cccc3c2OCO3)c(=O)n1C1CC1,C55789297_decoy,CASP3,Decoy,0,-7.47475,-6.4,-1.73,-6.600693589316128
Clc1ccc([C@@H]2CC(c3cccnc3)=Nc3nnnn32)cc1,C07167291_decoy,CASP3,Decoy,0,-5.86699,-5.57,-0.14,-4.583707911782736
Cn1c(C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)cc2ccccc21,C55039278_decoy,CASP3,Decoy,0,-7.05475,-6.57,-2.76,-4.980289683994799
Cc1cc(=O)oc2c3c(ccc12)OCN([C@H]1CCS(=O)(=O)C1)C3,C61966147_decoy,CASP3,Decoy,0,-7.62261,-7.22,-1.06,-5.667451177598459
C/C(=C\C(=O)N1CCN(c2nnc(C)o2)CC1)c1ccccc1,C62107006_decoy,CASP3,Decoy,0,-6.84301,-7.57,0.25,-5.9050741954395205
CC[C@@H]1CN(C(=O)c2cnn(C)c2-n2c(C)ccc2C)CCO1,C63734294_decoy,CASP3,Decoy,0,-6.68127,-5.46,-2.5,-6.4844516619801285
Cc1ccn2c(=O)cc(CN3C(=O)[C@H]4CC=CC[C@H]4C3=O)nc2c1,C36773201_decoy,CASP3,Decoy,0,-6.27999,-6.01,-1.46,-3.997651121903695
Cc1ccc(-n2ccn3c(SCC#N)nnc3c2=O)cc1C,C46047415_decoy,CASP3,Decoy,0,-5.91734,-6.37,-1.96,-4.807314000579085
O=C([C@@H]1CCCN(c2cnc3nccnc3c2)C1)N1CCCC1,C65227141_decoy,CASP3,Decoy,0,-7.6186,-7.28,-1.52,-5.629680212593141
Cc1ccc(C(=O)N2CCC3=Nc4ccnn4C(=O)[C@H]3C2)s1,C65260617_decoy,CASP3,Decoy,0,-7.955,-5.14,-0.44,-4.602870707476417
CN1CCN2CCN(C(=O)c3csc(-c4cccs4)n3)C[C@H]2C1=O,C65405832_decoy,CASP3,Decoy,0,-8.34948,-5.49,-0.92,-5.415554869289716
N#Cc1cccnc1N1CCCN(C(=O)[C@H]2Cc3ccccc3O2)CC1,C56352783_decoy,CASP3,Decoy,0,-6.82826,-7.13,-1.69,-6.986029324384422
Cc1cnc(C(=O)N2CCN(C(=O)CC3CCCC3)CC2)cn1,C65532179_decoy,CASP3,Decoy,0,-6.10236,-5.11,-0.65,-4.31985136095271
C[C@H]1CN(C(=O)[C@@H]2Cc3ccccc3CN2S(C)(=O)=O)CC(C)(C)O1,C65620432_decoy,CASP3,Decoy,0,-5.4829,-5.68,-1.79,-4.633267755536988
Cc1nc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cs1,C66311237_decoy,CASP3,Decoy,0,-8.70499,-8.0,-2.49,-12.9033178490579
Cc1nc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)ccc1C#N,C66770413_decoy,CASP3,Decoy,0,-7.08629,-6.19,-2.84,-5.449975332659139
Cc1cc(F)cc2c1N(C(=O)C1=CC=CN3CCS(=O)(=O)N=C13)CCC2,C66786068_decoy,CASP3,Decoy,0,-5.83194,-7.67,-1.16,-5.103723723464516
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H](C(=O)N3C[C@H](C)OC[C@@H]3C)C2)[C@@H](C)CO1,C67037298_decoy,CASP3,Decoy,0,-7.66072,-5.98,-1.03,-6.044766819269531
C[C@@H]1CC[C@@H]2[C@H](CCCN2C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)C1,C67517581_decoy,CASP3,Decoy,0,-7.63823,-6.0,-1.01,-5.497539925829419
C=C1[C@@H]2CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)C[C@]13O[C@H]1C[C@H](OC(C)=O)C(C)(C)[C@H](CC(=O)OC)[C@]12C,C03978929_decoy,CASP3,Decoy,0,-8.79628,-6.17,-1.51,-7.554330630437518
COc1c(Cl)cc(Cl)cc1/C=C/C(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCOCC3)c2)CC1,C04125279_decoy,CASP3,Decoy,0,-8.21908,-7.91,-1.3,-6.723209317451492
COc1ccc(-n2nc(-c3ccc([N+](=O)[O-])cc3)cc2C(=O)N2CCN(c3ccccc3OC)CC2)cc1,C04186625_decoy,CASP3,Decoy,0,-8.11531,-6.37,-1.8,-5.8844018939407565
Cc1cccc(N2CCN(C(=O)c3ccc(S(=O)(=O)c4ccccc4Cl)c([N+](=O)[O-])c3)[C@@H](C)C2)c1,C03020381_decoy,CASP3,Decoy,0,-7.77584,-7.25,-4.26,-7.985496297854905
Cc1c(C(=O)/N=c2\sn(-c3ccc(Cl)cc3)nc2C(=O)N2CCCC2)nnn1-c1ccc(F)cc1,C08770667_decoy,CASP3,Decoy,0,-7.86753,-6.58,-2.54,-5.0466540976464165
COc1ccc(CN2CC(=O)N3[C@@H](c4ccccc4OC)c4[nH]c5ccccc5c4C[C@H]3C2=O)cc1OC,C02122972_decoy,CASP3,Decoy,0,-6.58537,-7.25,-2.54,-5.2354112091651
CC(=O)N1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCCc5ccccc54)cc3)c2C#N)C1,C09391477_decoy,CASP3,Decoy,0,-9.22557,-6.99,-3.98,-6.342412632792025
COc1ccc([C@H]2[C@H](C(C)=O)N3N=Cc4ccccc4[C@@H]3C23C(=O)OC2(CCCCC2)OC3=O)cc1OC,C09424853_decoy,CASP3,Decoy,0,-8.6834,-6.95,-1.94,-6.137273033663856
COc1ccc(-c2nn(-c3ccccc3)cc2/C=C2\N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cc1OC,C12618203_decoy,CASP3,Decoy,0,-6.90054,-8.4,-2.01,-6.215744114894534
Cc1cccc(-n2ncc3c(=O)n4c(nc32)SC[C@@H]4CC(=O)N2CCN(c3ccccc3Cl)CC2)c1,C12663915_decoy,CASP3,Decoy,0,-9.04752,-8.16,-0.99,-6.952291773251973
COc1ccccc1OCc1nc2c3c(ncn2n1)Oc1c(c(C)nn1-c1ccccc1)[C@H]3c1ccccc1,C13778577_decoy,CASP3,Decoy,0,-6.9928,-6.67,-2.24,-5.389135437710256
COc1ccc(CN2CC(=O)N3[C@H](c4ccccc4OC)c4[nH]c5ccccc5c4C[C@@H]3C2=O)cc1OC,C15956299_decoy,CASP3,Decoy,0,-7.66195,-7.77,-5.27,-6.66444173220707
CCOC(=O)C1=C(C)N(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C(=O)C[C@@H]1c1cccc(C)c1,C16611683_decoy,CASP3,Decoy,0,-8.29043,-6.54,-2.96,-5.602104692833769
CCC[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5(C)[C@@H]4[C@@H](OC(C)=O)C[C@@]3(C)[C@]2(C(=O)COC(C)=O)O1,C16946112_decoy,CASP3,Decoy,0,-8.68668,-7.88,-4.39,-8.216684227632404
CC[C@@H]1N[C@@]2(C(=O)N(CC(=O)N3CCc4ccccc43)c3ccccc32)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12,C15320397_decoy,CASP3,Decoy,0,-6.93913,-8.97,-2.58,-6.992987096164179
Cc1cc(C)c2[nH]c(=O)c([C@H](c3nnnn3C3CCCCC3)N3CCN(c4ccccc4F)CC3)cc2c1,C19940287_decoy,CASP3,Decoy,0,-9.08915,-7.34,-1.82,-7.103129548794472
Cc1cc2cc([C@@H](c3nnnn3C3CCCCC3)N3CCN(c4ccc(F)cc4)CC3)c(=O)[nH]c2cc1C,C19940781_decoy,CASP3,Decoy,0,-8.43717,-9.05,-1.75,-7.414612584983737
Cc1onc(-c2ccccc2Cl)c1C(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCOCC3)c2)CC1,C20076490_decoy,CASP3,Decoy,0,-7.1971,-7.33,-1.89,-6.449421505611593
COc1c2c(cc3c1[C@H](c1c([O-])n(-c4ccccc4)c(=S)n(-c4ccccc4)c1=O)[NH+](C)CC3)OCO2,C20411669_decoy,CASP3,Decoy,0,-8.14748,-6.98,-3.55,-6.228877017037166
Cc1cccc(N2C[C@H](C(=O)Nc3nnc([C@@H]4CC(=O)N(c5ccc(Cl)cc5)C4)s3)CC2=O)c1C,C20584965_decoy,CASP3,Decoy,0,-7.59743,-6.36,-1.2,-4.940116316395093
Cn1c(=O)c2c(nc(N3CCN(C(=O)/C=C/c4ccccc4)CC3)n2Cc2ccc(Cl)cc2)n(C)c1=O,C21314815_decoy,CASP3,Decoy,0,-7.83039,-6.37,-1.59,-5.571743261876721
Cc1cc(Cl)c(N2CCN(CC3=NS(=O)(=O)c4cc(Cl)ccc4N3)CC2)cc1S(C)(=O)=O,C24897516_decoy,CASP3,Decoy,0,-9.56379,-7.79,-1.64,-6.209326463887654
CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C[C@H]2CCCO2)/c1=N\C(=O)c1ccc2c(c1)OCO2,C11691254_decoy,CASP3,Decoy,0,-7.40921,-6.61,-0.77,-6.8401331508500585
CC(C)(C)[C@H]([C@@H](Oc1ccc(Cl)cc1)n1cncn1)n1nnnc1C1(N2CCOCC2)CCCCC1,C33371591_decoy,CASP3,Decoy,0,-6.8152,-6.34,-3.1,-6.5433410012224
CCOc1ccc(-c2nn(-c3ccccc3)cc2/C=c2\sc3nc(-c4cccnc4)nn3c2=O)cc1F,C35004745_decoy,CASP3,Decoy,0,-9.60824,-6.35,-3.12,-7.138159708216782
Cc1cccc([C@@H]2c3cc(OCc4nc(C(=O)N5CCCC5)co4)ccc3CCN2C(=O)c2ccco2)c1,C35863340_decoy,CASP3,Decoy,0,-9.23015,-6.41,-2.29,-6.352392189745266
O=C(c1ccoc1)N1CCCN(c2nc3cc(Cl)ccc3c3nnc(-c4ccccc4[N+](=O)[O-])n23)CC1,C35889584_decoy,CASP3,Decoy,0,-7.01455,-6.2,-1.29,-5.281113080125572
C[C@@H]1CN(c2nc3ccccc3c3nnc(-c4ccccc4[N+](=O)[O-])n23)CCN1C(=O)c1ccccc1F,C35889865_decoy,CASP3,Decoy,0,-6.61067,-7.08,-2.27,-5.590793292443961
CC(=O)Oc1ccccc1C(=O)N1CCN(c2nc3ccccc3c3nnc(C4CCCCC4)n23)C[C@@H]1C,C35890325_decoy,CASP3,Decoy,0,-7.3387,-7.79,-1.5,-7.09075076477372
C[C@H]1CN(c2nc3ccccc3c3nnc(C4CCCCC4)n23)CCN1S(=O)(=O)c1ccccc1C#N,C35890504_decoy,CASP3,Decoy,0,-7.92329,-6.91,-3.34,-7.567289259279944
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ncnc3c2c(-c2ccccc2)cn3-c2ccc(F)cc2)CC1,C36628298_decoy,CASP3,Decoy,0,-6.73755,-6.88,-1.98,-5.774275756558632
CCC(=O)N1CCc2ccc(OCc3nc(C(=O)N(C)Cc4ccco4)co3)cc2[C@@H]1c1cccc(C)c1,C37608671_decoy,CASP3,Decoy,0,-6.86808,-7.99,-2.13,-5.941435045432761
CCC[C@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@H]4[C@H](OC(C)=O)C[C@]3(C)[C@]2(C(=O)COC(C)=O)O1,C08427565_decoy,CASP3,Decoy,0,-8.53467,-6.16,-2.0,-7.471322616842843
COc1ccc(C(c2c(C)n(C)n(-c3ccccc3)c2=O)c2c(C)n(C)n(-c3ccccc3)c2=O)cc1O,C08590059_decoy,CASP3,Decoy,0,-8.26668,-6.58,-1.55,-6.727151436616678
O=C(Nc1c2c(nn1-c1nc3ccccc3s1)CCC2)[C@H]1CCCCN1S(=O)(=O)c1cccs1,C38884726_decoy,CASP3,Decoy,0,-10.3416,-7.22,-2.38,-7.781412429774127
CCCc1nnc(N2C(=O)c3oc4ccc(CC)cc4c(=O)c3[C@@H]2c2cc(OC)c(OC)c(OC)c2)s1,C40038766_decoy,CASP3,Decoy,0,-8.30667,-6.8,-1.62,-6.5015521998973815
COc1cc([C@H]2c3c(oc4cc(C)cc(C)c4c3=O)C(=O)N2c2nnc(C(C)C)s2)cc(OC)c1OC,C40058252_decoy,CASP3,Decoy,0,-8.08804,-7.88,-3.47,-6.682046070054415
C=C1C[C@H]2[C@@]3(C)[C@@H](OC(C)=O)CC(=O)OC(C)(C)[C@H]3C[C@@H](OC(C)=O)[C@@]2(C)[C@@H]2C(=O)O[C@H](C)C(=O)[C@@]12C,C35465709_decoy,CASP3,Decoy,0,-7.19995,-6.34,-1.89,-5.696734655628784
CCOc1cc([C@@H]2C3=C(CCCC3=O)Nc3nnnn32)cc(Br)c1OCc1ccc(C)cc1,C40917312_decoy,CASP3,Decoy,0,-7.36857,-6.61,-4.6,-4.836639825537466
Cc1ccccc1S(=O)(=O)N1CCN(Cc2cc(=O)n3nc(-c4ccc(Cl)cc4)sc3n2)CC1,C41077508_decoy,CASP3,Decoy,0,-9.22956,-9.67,-1.8,-6.641226416570922
CCC[C@@H]1O[C@@H]2C[C@@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5(C)[C@@H]4[C@H](OC(C)=O)C[C@@]3(C)[C@@]2(C(=O)COC(C)=O)O1,C43896068_decoy,CASP3,Decoy,0,-8.28069,-5.64,-1.35,-7.426633283634469
O=C(c1cccc([N+](=O)[O-])c1)[C@H]1[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2[C@@H]2c3ccccc3C=CN12,C33920791_decoy,CASP3,Decoy,0,-7.41033,-10.27,-3.37,-7.133988769580561
Oc1c([C@@H](c2cccc(Br)c2)N2CCC3(CC2)OCCO3)sc2nc(-c3ccco3)nn12,C22852043_decoy,CASP3,Decoy,0,-8.44384,-7.88,-2.66,-6.822214333186294
Cc1ccc(-c2cc(C(=O)Nc3nc4ccccc4s3)c3c(C)nn([C@H]4CCS(=O)(=O)C4)c3n2)cc1,C57311189_decoy,CASP3,Decoy,0,-7.7982,-9.6,-1.45,-7.008260847120343
CC1=NN=C2Oc3ncn4nc(-c5ccnn5COc5ccc(Cl)cc5)nc4c3[C@H](c3cnn(C)c3)[C@@H]12,C22839325_decoy,CASP3,Decoy,0,-8.633,-6.79,-1.66,-6.700720750574917
COc1ccc(OCc2ccc(-c3nc4c5c(ncn4n3)OC3=NN=C(C)[C@H]3[C@H]5c3cnn(C)c3)cc2)cc1,C22844751_decoy,CASP3,Decoy,0,-9.21825,-6.51,-2.32,-6.123714539141481
CCc1ccc([C@H]2OC3(C(=O)c4ccccc4C3=O)[C@@H]3C(=O)N(c4ccc([N+](=O)[O-])cc4C)C(=O)[C@@H]23)cc1,C18249463_decoy,CASP3,Decoy,0,-7.84872,-7.52,-1.47,-5.8330283995141805
COc1ccc(N2C(=O)C3=CN=NC3=N[C@@H]2SCc2cc(=O)n3cc(Br)ccc3n2)cc1,C63710202_decoy,CASP3,Decoy,0,-8.51558,-8.15,-4.48,-9.473353278981152
N#C[C@@H]1C(=O)N=C(SCCSC2=NC(=O)[C@H](C#N)C3(CCCCC3)[C@H]2C#N)[C@@H](C#N)C12CCCCC2,C57054397_decoy,CASP3,Decoy,0,-10.2874,-7.61,-2.45,-9.285358291926835
COc1ccccc1N1CCN(C(=O)CN2C(c3ccc(C)cc3)=C[C@@H](c3ccccc3)n3nnnc32)CC1,C64792810_decoy,CASP3,Decoy,0,-9.41686,-6.41,-1.44,-6.283724608319353
O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1,C08825983_decoy,CASP3,Decoy,0,-5.48793,-8.99,-0.92,-5.978042141676914
CC(=O)[C@@H](Sc1nc(-c2ccc(Cl)cc2)nc2c1c(=O)n(C)c(=O)n2C)C(=O)N(C)C,C08898226_decoy,CASP3,Decoy,0,-7.88813,-7.41,-1.6,-6.953854397808903
CC(=O)CN1N=C(c2ccc(Cl)cc2)Cn2c1nc1c2c(=O)n(CC(C)=O)c(=O)n1C,C09292061_decoy,CASP3,Decoy,0,-8.47098,-6.23,-2.26,-7.347051361924028
CCOC(=O)C1=NN(N=O)[C@@]2(CC(=O)N(c3ccc(I)cc3)C2=O)C1,C09462733_decoy,CASP3,Decoy,0,-7.77029,-5.59,-0.52,-5.428476270629086
CCn1cc(C(=O)N2CCN(C(=O)c3ccco3)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C09661391_decoy,CASP3,Decoy,0,-7.37097,-6.85,-2.53,-6.301411670405416
O=C(Cn1nnc(-c2cccs2)n1)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1,C09671736_decoy,CASP3,Decoy,0,-8.69635,-6.56,-0.22,-6.114257936205841
O=C([C@@H]1CCCN(S(=O)(=O)c2cccc3nsnc23)C1)N1CCN(c2ncccn2)CC1,C09838147_decoy,CASP3,Decoy,0,-9.06594,-7.24,-1.87,-6.3435906362543
CN(C(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)[C@@H]1CCS(=O)(=O)C1,C10042965_decoy,CASP3,Decoy,0,-7.82315,-6.56,-1.79,-6.316002920032803
O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCN(c2ncnc3c2nnn3-c2cccc(F)c2)CC1,C10256389_decoy,CASP3,Decoy,0,-7.34732,-8.66,-1.12,-5.232576948812817
O=C(c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)N1CCN(C(=O)c2ccco2)CC1,C12003324_decoy,CASP3,Decoy,0,-7.44166,-6.72,-2.87,-6.027889426119219
O=C(c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)N1CCN(c2ncccn2)CC1,C12003333_decoy,CASP3,Decoy,0,-7.09735,-5.43,-0.61,-6.0158319076954445
O=C(c1ccco1)N1CCN(C(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2Cl)CC1,C12003507_decoy,CASP3,Decoy,0,-7.30782,-7.06,-2.23,-6.582175335029725
COc1ccc2c(c1)-c1nc(-n3ncc(C(=O)N4CCN(C(C)=O)CC4)c3C3CC3)ncc1CC2,C12039696_decoy,CASP3,Decoy,0,-8.55223,-6.88,-1.49,-6.431626517687249
O=C(c1ccc(N2CCCS2(=O)=O)cc1)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1,C12916738_decoy,CASP3,Decoy,0,-7.93527,-6.55,-1.48,-5.742174513465679
O=C(C1=CC=CN2CCS(=O)(=O)N=C12)N1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1,C13095156_decoy,CASP3,Decoy,0,-7.9191,-8.27,-2.12,-6.270588148724814
Cn1nnc2c(N3CCN(C(=O)[C@H]4CC(=O)N(c5ccc(Cl)cc5)C4)CC3)ncnc21,C13532858_decoy,CASP3,Decoy,0,-8.3786,-6.99,-1.34,-6.006084016111477
CCn1nnc2c(N3CCN(C(=O)[C@@H]4CC(=O)N(c5cccc(OC)c5)C4)CC3)ncnc21,C13533494_decoy,CASP3,Decoy,0,-7.64375,-7.02,-2.41,-8.845176300284443
CCn1nnc2c(N3CCN(C(=O)[C@H]4CC(=O)N(c5ccc(OC)cc5)C4)CC3)ncnc21,C13533498_decoy,CASP3,Decoy,0,-8.00363,-6.83,-0.98,-4.859272451674556
CCn1nnc2c(N3CCN(C(=O)[C@@H]4CC(=O)N(c5ccc(OC)cc5)C4)CC3)ncnc21,C13533502_decoy,CASP3,Decoy,0,-8.39251,-6.99,-0.78,-6.298077294345719
O=C([C@@H]1CN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c2ccccc2O1)N1CCOCC1,C16964585_decoy,CASP3,Decoy,0,-7.38196,-6.45,-2.52,-5.69451989724074
C[C@@H]1CN(C(=O)c2nc3sccn3c2CN2CCN(c3ncccn3)CC2)C[C@H](C)O1,C19789178_decoy,CASP3,Decoy,0,-9.39044,-5.96,-1.81,-6.449954166417247
CC(=O)N1CCC2(CC1)OC(=O)C(C)=C2C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C20531841_decoy,CASP3,Decoy,0,-6.91477,-8.82,-0.66,-6.686314305610232
COc1ccc(-c2cc(C(=O)N3CCN(C)CC3)c3c(C)nn([C@H]4CCS(=O)(=O)C4)c3n2)cc1,C16992831_decoy,CASP3,Decoy,0,-9.22167,-6.07,-4.04,-6.357759087870757
O=C([C@@H]1CC(=O)N(c2cccc(F)c2)C1)N1CCN(Cc2nnnn2-c2cccc(F)c2)CC1,C23232717_decoy,CASP3,Decoy,0,-8.49706,-7.13,-2.51,-5.843977888825268
Cc1ccc(N2C[C@@H](C(=O)N3CCN(Cc4nnnn4-c4ccc(C)cc4)CC3)CC2=O)cc1,C23232982_decoy,CASP3,Decoy,0,-8.18871,-6.61,-1.42,-6.066872464168115
Cc1c(C(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)cccc1[N+](=O)[O-],C23233165_decoy,CASP3,Decoy,0,-5.88791,-8.55,-2.8,-6.346186906706067
COc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccc(Br)o3)CC2)cc1,C23233532_decoy,CASP3,Decoy,0,-7.0533,-6.39,-2.03,-5.947520430410715
Cc1cc(=O)n2nc(CN3CCN(c4cnn(-c5ccccc5)c(=O)c4Cl)CC3)sc2n1,C23703216_decoy,CASP3,Decoy,0,-8.85175,-6.93,-1.95,-5.516024536105218
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)[C@H]1CN(S(C)(=O)=O)c2ccccc2O1,C30947494_decoy,CASP3,Decoy,0,-7.27537,-6.0,-1.42,-5.785003518045884
Cn1c(=O)c2c(nc(Cl)n2CC(=O)N(c2ccccc2)[C@H]2CCS(=O)(=O)C2)n(C)c1=O,C13117569_decoy,CASP3,Decoy,0,-9.38045,-8.11,-2.02,-7.783180848800623
CC(C)CN1Cc2c(n(CC(=O)N3CCN(C)CC3)c3cc(C(C)(C)C)nn3c2=O)C1=O,C35617541_decoy,CASP3,Decoy,0,-7.66836,-7.01,-1.4,-6.778737740481111
CC(=O)N1CCN(C(=O)c2nn(-c3ccc(C)cc3)c(=O)n(Cc3ccccc3C)c2=O)CC1,C35715524_decoy,CASP3,Decoy,0,-7.21175,-5.93,-3.7,-5.257203288813423
CN1C(=O)N(C)C(=O)C2(Cc3ccccc3N3CCN(Cc4ccc5c(c4)OCO5)C[C@H]32)C1=O,C35877154_decoy,CASP3,Decoy,0,-8.19506,-7.48,-1.24,-5.939419703166157
CCN1CCN(C(=O)Cn2c3c(c(=O)n4nc(C(C)(C)C)cc24)CN(C(C)C)C3=O)CC1,C35943925_decoy,CASP3,Decoy,0,-8.01984,-7.09,-4.23,-6.58692975050498
CC(=O)Oc1c(C2=NN(C(C)=O)[C@@H](c3ccc(Cl)cc3)O2)cc(Cl)cc1[N+](=O)[O-],C37009156_decoy,CASP3,Decoy,0,-7.00636,-5.48,-1.27,-4.925037852458289
O=C1CCCC(=O)N1c1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c([N+](=O)[O-])c1,C08683123_decoy,CASP3,Decoy,0,-5.94808,-6.16,-1.09,-4.749525628513588
COc1ccccc1N1CCN(C(=O)[C@H]2CCCN(C3=NC(Cl)=NC4=NC=N[C@@H]43)C2)CC1,C39041155_decoy,CASP3,Decoy,0,-9.37211,-8.65,-1.03,-8.634390947132422
CCN(CC)C(=O)CN1C(=O)C2(OCC(Br)([N+](=O)[O-])CO2)c2ccccc21,C39409922_decoy,CASP3,Decoy,0,-5.64308,-6.76,-1.51,-5.27074410165053
Cc1ccnn1-c1cc(Oc2ccc(C(=O)N3CCN(C(=O)c4ccco4)CC3)cc2)ncn1,C40855670_decoy,CASP3,Decoy,0,-8.02231,-6.88,-1.88,-6.107502404270233
COc1ccc(-c2ccc(N3CCC(C(=O)N4CCN(C=O)CC4)CC3)nn2)cc1OC,C40920531_decoy,CASP3,Decoy,0,-8.17891,-7.01,-0.61,-8.271001237381217
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C,C45715305_decoy,CASP3,Decoy,0,-6.71535,-7.69,-1.6,-8.109630722129952
O=C([C@@H]1CCCN(C(=O)N2CCCC2)C1)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1,C46904679_decoy,CASP3,Decoy,0,-6.9924,-7.55,-1.72,-5.942202858592148
COc1cccc2cc(C(=O)N3CCN(c4c(C)nn([C@@H]5CCS(=O)(=O)C5)c4C)CC3)oc12,C56936095_decoy,CASP3,Decoy,0,-7.85951,-7.51,-1.63,-6.035588005782227
Cc1ccc(N2C[C@@H](C(=O)N3CCN(c4c(C)nn([C@H]5CCS(=O)(=O)C5)c4C)CC3)CC2=O)cc1,C56936678_decoy,CASP3,Decoy,0,-9.40272,-7.73,-1.57,-7.238571454051851
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1N1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1,C56936700_decoy,CASP3,Decoy,0,-8.45407,-7.97,-1.63,-6.433221145512093
Cc1cc(=O)c(C(=O)N2CCN(c3nnnn3-c3ccccc3)CC2)nn1-c1ccccc1,C24776633_decoy,CASP3,Decoy,0,-7.63185,-9.76,-1.39,-6.505070718090109
CC1=C(c2nnc(CN3CCN(CC4=NC(=O)C5=C(C)[C@@H](C)SC5=N4)CC3)o2)C[C@H](C)O1,C39792842_decoy,CASP3,Decoy,0,-9.26456,-7.14,-0.57,-5.835984813867055
CN1C(=O)[C@H]2C(=NC(c3ccc(Cl)cc3)=C2c2c(-n3cccc3)n(C)c(=O)n(C)c2=O)N(C)C1=O,C20896806_decoy,CASP3,Decoy,0,-7.20734,-6.42,-1.85,-5.997002904558391
O=C(C1CCN(S(=O)(=O)[C@H]2C=C[C@@H]([C@@H]3C=CN=N3)O2)CC1)N1CCN(c2ccccc2)CC1,C64710751_decoy,CASP3,Decoy,0,-7.79534,-6.78,-1.24,-5.631108386689737
CCS(=O)(=O)c1ccc2c(c1)N(Cc1nc(-c3ccc4c(c3)OCO4)no1)C(=O)CO2,C64999126_decoy,CASP3,Decoy,0,-8.54128,-6.47,-1.99,-6.506403424054905
CS(=O)(=O)Oc1nn2cc(-n3cc([N+](=O)[O-])cn3)cnc2c1Br,C03097409_decoy,CASP3,Decoy,0,-5.73162,-4.68,-1.23,-4.150770001941975
COc1cc(-n2nnn([C@H]3CC(=O)[C@@H]4OC[C@H]3O4)c2=S)c(OC)cc1Cl,C06659555_decoy,CASP3,Decoy,0,-8.0579,-7.12,-0.8,-8.175988640262531
COc1cc(=O)n(-c2ccccc2)nc1C(=O)N1CCN(C(=O)c2ccco2)CC1,C07455324_decoy,CASP3,Decoy,0,-7.10041,-6.93,-3.22,-6.474591891195981
O=C([C@H]1CCCN(c2nnc(N3CCCC3=O)s2)C1)N1CCC2(CC1)OCCO2,C09287626_decoy,CASP3,Decoy,0,-9.2341,-7.64,-3.79,-6.4494400334028565
O=C([C@@H]1CCCN(c2nnc(N3CCCC3=O)s2)C1)N1CCC2(CC1)OCCO2,C09287629_decoy,CASP3,Decoy,0,-8.72427,-6.32,-2.91,-5.883551530460086
Cn1cnc2c1c(=O)n(CCCSc1nnnn1C[C@H]1CCCO1)c(=O)n2C,C09156707_decoy,CASP3,Decoy,0,-7.6727,-6.14,-3.69,-5.345852208950258
O=C(c1cccc(-n2cnnn2)c1)N1CCN(S(=O)(=O)c2cccs2)CC1,C09714134_decoy,CASP3,Decoy,0,-6.78582,-6.05,-2.08,-5.3366061139125645
COCCn1cc(C(=O)N2CCN(C(=O)C3CC3)CC2)c2nn(-c3ccccc3)c(=O)c-2c1,C11666208_decoy,CASP3,Decoy,0,-7.7285,-5.93,-1.24,-7.022003311251454
C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)N3CCN(C(=O)c4ccco4)CC3)c2)C1=O,C12004925_decoy,CASP3,Decoy,0,-7.79218,-7.54,-2.18,-8.00514459110907
C[C@@H]1CS(=O)(=O)N(c2ccc(C(=O)N3CCN(c4ncccn4)CC3)cc2)C1=O,C12005941_decoy,CASP3,Decoy,0,-7.03094,-5.97,-1.1,-6.775213762278016
O=C(c1cccc(-n2cnnn2)c1)N1CCC(n2nnc3ccccc3c2=O)CC1,C12145867_decoy,CASP3,Decoy,0,-7.1118,-7.88,-3.06,-5.643353245630062
Cc1c(C(=O)N(C)Cc2nccs2)cnn1-c1nccc(-c2ccc3c(c2)OCO3)n1,C12455238_decoy,CASP3,Decoy,0,-7.17717,-6.89,-2.24,-4.7152721735466505
C=CCn1c(SCc2nnc(-c3ccco3)o2)nnc1[C@@H]1CCS(=O)(=O)C1,C12569524_decoy,CASP3,Decoy,0,-9.2705,-7.33,-1.12,-7.531422875362763
Cn1ncc2c(N3CCN(C(=O)Cn4c(=O)cnc5ccccc54)CC3)ncnc21,C12775693_decoy,CASP3,Decoy,0,-6.98255,-7.01,-1.39,-5.591978599009866
CN(C)N(C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1,C12607513_decoy,CASP3,Decoy,0,-6.75909,-5.81,-1.12,-5.345249386648594
CCn1nnc2c(N3CCN(C(=O)c4cc5ccccc5oc4=O)CC3)ncnc21,C13533441_decoy,CASP3,Decoy,0,-7.31137,-7.37,-1.38,-6.761928351584894
O=C(C1CCN(c2nc3nonc3nc2N2CCSCC2)CC1)N1CCOCC1,C15061662_decoy,CASP3,Decoy,0,-7.64058,-7.26,-0.56,-6.091732196005907
CCn1c(=O)c(N2CCN(C(=O)[C@@H](C)Cn3ccnc3C)CC2)c(C)n(-c2ccccc2)c1=O,C15863314_decoy,CASP3,Decoy,0,-7.87723,-6.29,-4.01,-7.436598972679241
CCOc1ccc(-n2nnc3c(N4CCN(S(C)(=O)=O)CC4)ncnc32)cc1,C15884191_decoy,CASP3,Decoy,0,-6.35863,-6.01,-1.0,-4.406322064215214
Cc1nn(C(F)F)cc1S(=O)(=O)N(Cc1cnn(C)c1)Cc1cnn(C)c1,C20602623_decoy,CASP3,Decoy,0,-6.34544,-6.21,-1.36,-6.329115302186579
Cc1noc(C)c1C(=O)N1CCN(Cc2nnnn2-c2ccc(F)c(F)c2)CC1,C23134816_decoy,CASP3,Decoy,0,-6.26435,-6.88,-0.75,-5.820467783567191
Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1,C23232876_decoy,CASP3,Decoy,0,-6.75987,-6.81,-1.34,-5.332710425966111
Cc1ccc(-n2nnnc2CN2CCN(C(=O)c3ccccc3S(C)(=O)=O)CC2)cc1,C23233041_decoy,CASP3,Decoy,0,-7.87442,-6.22,-2.5,-6.214129852752576
CC(C)(C)n1nnnc1SCC(=O)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1,C24503209_decoy,CASP3,Decoy,0,-7.31121,-5.28,-2.48,-5.288583334129406
CC(C)(C)n1nnnc1SCC(=O)N1CCN([C@H]2CCS(=O)(=O)C2)CC1,C24503214_decoy,CASP3,Decoy,0,-7.93954,-7.34,-1.01,-6.268671711898514
C=CCn1c(SCc2nnnn2-c2ccccc2)nnc1[C@@H]1CCS(=O)(=O)C1,C24712369_decoy,CASP3,Decoy,0,-7.74588,-5.96,-1.53,-6.656098860888259
Cc1ccc(-c2noc(CN3CCN(C(=O)c4cnc5n(c4=O)CCS5)CC3)n2)cc1,C25069713_decoy,CASP3,Decoy,0,-8.17467,-6.39,-1.51,-4.8889531083119095
Cc1nn(Cc2ccccc2Cl)c(C)c1CN(C)S(=O)(=O)c1cn(C)c(=O)n(C)c1=O,C30497783_decoy,CASP3,Decoy,0,-6.43397,-6.53,-2.52,-5.625994602680167
CC(=O)Oc1ccc(Br)cc1C1=NN(C(C)=O)[C@H](c2ccc([N+](=O)[O-])cc2)O1,C37009129_decoy,CASP3,Decoy,0,-5.89369,-7.39,-1.83,-5.710695666679898
CC[C@H](C)N(C(=O)COC(=O)c1nc2nc(C)cc(C)n2n1)[C@@H]1CCS(=O)(=O)C1,C24772252_decoy,CASP3,Decoy,0,-8.32841,-7.07,-1.34,-7.932360581309394
COc1cc(/C=N/N2C(=O)N=C3C(=Nc4ccc(F)cc43)C2=O)cc(OC)c1OC,C38605424_decoy,CASP3,Decoy,0,-6.74842,-7.11,-3.08,-4.890688225208758
COc1ccc(-c2c3c(=O)n(-n4c(C)nnc4C)ccc3nc3nc(C)nn23)cc1,C38828784_decoy,CASP3,Decoy,0,-6.78228,-5.98,-1.31,-5.306699662451488
CC1=C2C(=O)N=C([C@@H](C)OC(=O)CCCN3C(=O)CN(C)C3=O)N=C2S[C@@H]1C,C39460374_decoy,CASP3,Decoy,0,-7.35773,-7.03,-1.28,-5.596577334468072
CCOC(=O)C1=C(C)N=C(C(=O)C(=O)N2CCN(C=O)CC2)[C@H]1c1ccc(OC)cc1,C39705128_decoy,CASP3,Decoy,0,-7.94891,-5.45,-0.9,-7.508137798100728
CC1(C)O[C@H]2O[C@H]([C@H]3COC(C)(C)O3)[C@H](OCCCN3C(=O)CCC3=O)[C@H]2O1,C39715727_decoy,CASP3,Decoy,0,-6.0156,-7.1,-2.82,-5.512864501252306
CC1CCN(C(=O)CO/N=C2\C(C(C)C)=CN=C3[C@H]2C(=O)N(C)C(=O)N3C)CC1,C39728703_decoy,CASP3,Decoy,0,-6.97887,-6.27,-2.89,-5.324154535207758
CN1CCN(S(=O)(=O)N2CCN(C(=O)c3cc(C4CC4)nn3C(C)(C)C)CC2)CC1,C40121116_decoy,CASP3,Decoy,0,-8.39156,-7.3,-2.07,-6.063795418663212
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)c3cn4cccnc4n3)CC2)C[C@@H](C)O1,C40153922_decoy,CASP3,Decoy,0,-7.62444,-6.97,-2.42,-5.999995998330237
CSc1nc2nc(C)c(CC(=O)OCc3cc(=O)n(C)c(=O)n3C)c(C)n2n1,C45660594_decoy,CASP3,Decoy,0,-7.4402,-6.04,-1.6,-5.661699410705961
CC(=O)N1CCc2cc(C(=O)N3CCN(C(=O)c4ccc([N+](=O)[O-])s4)CC3)ccc21,C46757335_decoy,CASP3,Decoy,0,-5.8633,-6.89,-2.97,-6.042815968610459
CCCn1c(=O)n(C)c(=O)c2c(S[C@@H](C)c3nnc(C)o3)nc(C(C)C)nc21,C48186651_decoy,CASP3,Decoy,0,-9.36731,-5.73,-2.05,-6.8222988164382725
CN(C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)S(=O)(=O)c1ccc2c(c1)OCCO2,C59369060_decoy,CASP3,Decoy,0,-7.74419,-8.34,-1.95,-6.402642928733522
C[C@@H](OC(=O)c1ccc(N2CCCC2)nn1)C(=O)N1CCN(c2ncccn2)CC1,C60378400_decoy,CASP3,Decoy,0,-7.53735,-7.19,-2.59,-6.350071144030214
CS(=O)(=O)N1CCN(C(=O)[C@H]2CCCN(c3ccc(-n4cccn4)nn3)C2)CC1,C62022811_decoy,CASP3,Decoy,0,-7.32565,-7.24,-1.55,-5.399457450805612
CS(=O)(=O)N1CCC(C(=O)N2CCC(c3nn4cnnc4s3)CC2)CC1,C62027298_decoy,CASP3,Decoy,0,-8.86483,-5.74,-1.73,-7.854045056514468
Cc1cc(C(=O)N2CCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)CC2)no1,C62612395_decoy,CASP3,Decoy,0,-6.76536,-5.58,-2.37,-4.865049788275448
CC1=NC(C)=C(C(=O)N2CCCC2)[C@H]1S(=O)(=O)N1CCN(c2ncccn2)CC1,C63652283_decoy,CASP3,Decoy,0,-6.77574,-6.26,-1.77,-6.091304112181024
COc1ccccc1N1CCN(S(=O)(=O)[C@@H]2C=NC(c3nnc(C)o3)=C2)CC1,C64923448_decoy,CASP3,Decoy,0,-7.8794,-7.64,-0.64,-6.328627446816747
O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCN(C(=O)[C@@H]2C=C(c3cccnc3)N=N2)CC1,C64965229_decoy,CASP3,Decoy,0,-7.34514,-6.54,-1.49,-6.134835475924074
CN1C(=O)C[C@H](N2CCCN(C(=O)[C@@H]3C=C(c4cccs4)N=N3)CC2)N(C)C1=O,C65024327_decoy,CASP3,Decoy,0,-8.43576,-6.35,-1.65,-5.837047602722202
CCOC(=O)CNC(=O)CSc1nnc(Cn2c(=O)sc3ccccc32)n1-c1cccc(Cl)c1,C09278739_decoy,CASP3,Decoy,0,-7.96456,-7.82,-2.37,-6.606316214140693
COc1ccc(N2CCN(c3nc4c(c(=O)[nH]c(=O)n4C)n3CCCSc3ccc(C)cc3)CC2)cc1,C10248962_decoy,CASP3,Decoy,0,-10.5693,-7.98,-2.45,-9.985628912171034
Cc1nnc(SC[C@@H](C)Cn2c(N3CCC(Cc4ccccc4)CC3)nc3c2c(=O)[nH]c(=O)n3C)s1,C10249310_decoy,CASP3,Decoy,0,-9.54987,-8.19,-2.88,-8.644127009517552
CCOC(=O)c1sc2nc(NC(=O)c3ccc(S(=O)(=O)N(C)C[C@H]4CCCO4)cc3)sc2c1C,C11883231_decoy,CASP3,Decoy,0,-10.2901,-6.46,-1.88,-6.794307461039715
COc1ccccc1N(C(=O)Cn1nnc2ccccc21)[C@H](C(=O)NC[C@@H]1CCCO1)c1ccc(F)cc1,C12481066_decoy,CASP3,Decoy,0,-6.10061,-5.92,-1.56,-6.435004656528601
CC(=O)c1ccc(N(C(=O)Cn2nnc3ccccc32)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(C)cc2)cc1,C12481409_decoy,CASP3,Decoy,0,-8.36416,-8.14,-3.05,-8.170471933306356
CC(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C[C@@H]2CCCO2)C(=O)Cn2nnc3ccccc32)cc1,C12481920_decoy,CASP3,Decoy,0,-9.36084,-8.36,-3.31,-9.9727830716694
CCOc1c(OC)cccc1[C@H]1CN2C(=O)CN(CCCn3ccnc3)C(=O)[C@]2(C)c2[nH]c3ccccc3c21,C08918550_decoy,CASP3,Decoy,0,-8.63193,-7.06,-2.73,-6.986225645207862
CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccncc3)n2-c2ccc(OC)cc2)sc(C)c1C,C06089462_decoy,CASP3,Decoy,0,-8.95697,-7.56,-2.16,-7.659981177719555
CC(C)(C)c1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCN(S(=O)(=O)c4cccs4)CC3)C2=O)cc1,C14185127_decoy,CASP3,Decoy,0,-7.95822,-6.43,-0.7,-5.828786921041611
COc1ccc(N2CCN([C@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3Cc3ccccc3)CC2)cc1,C19826346_decoy,CASP3,Decoy,0,-8.03029,-6.49,-1.95,-6.248369654574479
Cc1ccc2cc([C@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(c4ccccc4F)CC3)c(=O)[nH]c2c1C,C19826586_decoy,CASP3,Decoy,0,-7.90104,-6.63,-2.49,-5.064143992995307
Cc1ccc2cc([C@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccc(F)cc4)CC3)c(=O)[nH]c2c1C,C19826609_decoy,CASP3,Decoy,0,-8.60569,-7.45,-1.51,-6.253444905849468
CCCCN1C(=O)[C@@]2(C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCC[NH+](C)C)c2ccccc21,C19897764_decoy,CASP3,Decoy,0,-8.73886,-6.35,-0.99,-7.399974871975321
Cc1ccc(C)c2[nH]c(=O)c([C@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(c4ccccc4F)CC3)cc12,C19940898_decoy,CASP3,Decoy,0,-7.57604,-8.5,-1.26,-7.072614358597438
Cc1cc(C)c2cc([C@@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccccc4F)CC3)c(=O)[nH]c2c1,C19940977_decoy,CASP3,Decoy,0,-8.88805,-8.34,-1.33,-7.934875014915545
Cc1cc(C)c2cc([C@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4ccc(F)cc4)CC3)c(=O)[nH]c2c1,C19940980_decoy,CASP3,Decoy,0,-9.82248,-7.29,-1.82,-9.768443203062802
CCc1ccc2[nH]c(=O)c([C@@H](c3nnnn3C[C@H]3CCCO3)N3CCN(c4cc(C)ccc4C)CC3)cc2c1,C19941428_decoy,CASP3,Decoy,0,-8.53201,-8.12,-2.57,-9.517330913060484
Cc1cccc(N2CCN([C@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)c1C,C19941556_decoy,CASP3,Decoy,0,-8.21137,-7.95,-2.93,-6.3244393679004105
Cc1cc2cc([C@H](c3nnnn3C[C@@H]3CCCO3)N3CCN(c4cccc(C)c4C)CC3)c(=O)[nH]c2cc1C,C20079836_decoy,CASP3,Decoy,0,-8.39552,-7.36,-2.27,-6.900000842446318
Cc1cc(C)c2[nH]c(=O)c([C@@H](c3nnnn3C(C)(C)C)N3CCN(Cc4ccc5c(c4)OCO5)CC3)cc2c1,C20083126_decoy,CASP3,Decoy,0,-9.01801,-6.95,-2.03,-6.747540637909151
COCCn1nnnc1[C@H](c1cc2cc(C)cc(C)c2[nH]c1=O)N1CCN(Cc2ccccc2Cl)CC1,C20083208_decoy,CASP3,Decoy,0,-8.75206,-5.78,-2.17,-6.757134396429959
COCCn1nnnc1[C@H](c1cc2c(C)cc(C)cc2[nH]c1=O)N1CCN(c2cc(Cl)ccc2C)CC1,C20083530_decoy,CASP3,Decoy,0,-8.84974,-7.54,-2.64,-8.281651511401465
Cc1ccc(C)c2[nH]c(=O)c([C@H](c3nnnn3Cc3ccco3)N3CCN(c4ccc(F)cc4)CC3)cc12,C01382041_decoy,CASP3,Decoy,0,-7.99096,-7.84,-3.42,-7.094330494514385
COc1ccc([C@@H]2CC(=O)C3=C(C2)Nc2nc(C(F)(F)F)nn2[C@H]3c2ccc([N+](=O)[O-])cc2)cc1OC,C22839803_decoy,CASP3,Decoy,0,-6.38551,-6.67,-1.95,-4.90344516389569
CCN1C(=O)/C(=C\c2cnn(C)c2C)N=C1SCC(=O)Nc1sc2c(c1C(=O)OC)CCCCC2,C22840240_decoy,CASP3,Decoy,0,-9.59906,-6.88,-1.31,-6.657012416820649
O=C(Cn1c(=O)n2nc(-c3ccncc3)nc2c2c(-c3ccc(Cl)cc3)csc21)NCc1ccco1,C28443962_decoy,CASP3,Decoy,0,-7.65677,-6.76,-2.57,-7.837265065880104
COc1ccc(/C=N\Nc2nc(-c3cccc(S(=O)(=O)N4C[C@H](C)O[C@@H](C)C4)c3)cs2)c(OC)c1,C32636420_decoy,CASP3,Decoy,0,-7.90068,-6.65,-5.12,-6.12489712673556
COc1ccccc1Cn1c(CNC(=O)[C@@H]2O[C@H]3OC(C)(C)O[C@@H]3[C@H]3OC(C)(C)O[C@H]32)nc2ccccc21,C33697872_decoy,CASP3,Decoy,0,-6.44124,-7.69,-3.53,-5.027233025694956
COc1cccc(/C=N/Nc2nc(-c3cccc(S(=O)(=O)N4C[C@H](C)O[C@@H](C)C4)c3)cs2)c1OC,C33960247_decoy,CASP3,Decoy,0,-9.51872,-7.39,-2.48,-9.838619933801812
COc1ccccc1N1CCN(C(=O)CN2CCN(C(=O)c3csc(NC4CCCCC4)n3)CC2)CC1,C35939220_decoy,CASP3,Decoy,0,-9.72647,-6.37,-1.88,-6.237822190653047
COCCNC(=O)c1coc(COc2ccc3c(c2)[C@@H](c2cccc(C)c2)N(C(=O)c2ccco2)CC3)n1,C37608396_decoy,CASP3,Decoy,0,-10.1134,-9.01,-3.46,-10.261942985625405
CCCn1c(N2CC[NH+](C)CC2)c(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33812629_decoy,CASP3,Decoy,0,-9.49971,-4.67,-1.12,-6.280503435211272
Cc1cccc(O[C@@H](C)c2nnc(SCC(=O)Nc3sc(C(=O)N(C)C)c(C)c3C#N)n2C)c1C,C39972634_decoy,CASP3,Decoy,0,-8.31409,-7.48,-1.38,-7.331044515121446
CCOC(=O)C1=C(CN2CCN(C(=O)COC)[C@H](C)C2)N(C)C(=O)N[C@H]1c1cccc(Cl)c1Cl,C40392148_decoy,CASP3,Decoy,0,-9.05875,-6.9,-2.89,-7.785885762261129
CC[C@H](c1nnnn1C(C)(C)CC)N(Cc1ccc(F)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C01325141_decoy,CASP3,Decoy,0,-8.57042,-7.7,-1.37,-7.51173015969269
CC[C@H](c1nnnn1Cc1ccccc1)N(Cc1ccc(C)cc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C01374829_decoy,CASP3,Decoy,0,-7.78964,-7.12,-1.4,-6.369852159359542
CC[C@H](c1nnnn1Cc1ccco1)N(Cc1ccc(OC)cc1)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13495180_decoy,CASP3,Decoy,0,-7.80713,-8.18,-4.05,-9.229431021483554
COc1ccc2cc(CN(Cc3ccc(F)cc3)[C@@H](c3nnnn3Cc3ccco3)C(C)C)c(=O)[nH]c2c1,C13498761_decoy,CASP3,Decoy,0,-8.09596,-8.31,-2.92,-8.176650723837126
CCC[C@@H](c1nnnn1C1CCCC1)N(Cc1cccs1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13499396_decoy,CASP3,Decoy,0,-9.71767,-8.72,-2.25,-8.783266996918139
C=CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1[C@H]1CCCN1C(=O)c1ccc(C)cc1,C59179928_decoy,CASP3,Decoy,0,-7.9282,-6.39,-3.48,-5.897258080399584
COC(=O)[C@@]1(c2ccccc2)N[C@H](c2ccc(N(C)C)cc2)[C@H]2C(=O)N(c3ccc4c(c3)OCCO4)C(=O)[C@@H]21,C20150760_decoy,CASP3,Decoy,0,-9.27888,-8.09,-1.38,-6.92449706876575
COc1ccc(CNC(=O)c2cnn3c(C(F)(F)F)cc(-c4cc(OC)c(OC)c(OC)c4)nc23)cc1,C59421672_decoy,CASP3,Decoy,0,-8.01088,-6.65,-1.72,-6.465007509510476
[H]/N=C1C(=C/c2ccc(OC(=O)c3ccccc3F)c(OCC)c2)/C(=O)N=C2SC(c3cccnc3)=NN2/1,C09185414_decoy,CASP3,Decoy,0,-9.51647,-6.72,-1.11,-9.802919629152246
[H]/N=C1C(=C\c2ccc(OCc3ccccc3Cl)c(OCC)c2)\C(=O)N=C2SN=C(S(C)(=O)=O)N2\1,C20205783_decoy,CASP3,Decoy,0,-9.52706,-6.91,-1.22,-6.88364389486339
[H]/N=C1C(=C/c2ccc(OCCCOc3ccc(C)cc3)cc2)/C(=O)N=C2SC(S(=O)(=O)CC)=NN2/1,C41084058_decoy,CASP3,Decoy,0,-9.24262,-6.89,-1.71,-9.477674997925256
COC(=O)C1=C(C)[C@H](C(=O)C2=C([O-])C(=O)N(CCCn3cc[nH+]c3)[C@H]2c2ccc(C(C)(C)C)cc2)C(C)=N1,C08827111_decoy,CASP3,Decoy,0,-7.46295,-7.19,-4.41,-6.656413837779734
O=C(NCCN1CCN(c2ccccc2)CC1)[C@@H]1CCCN(S(=O)(=O)c2cccc3nsnc23)C1,C63478912_decoy,CASP3,Decoy,0,-8.49186,-8.43,-2.88,-6.741030843816261
[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,CASP3,Decoy,0,-7.91177,-7.24,-2.45,-5.8946461368968
CCOC(=O)C1=C(C)N=C(C)[C@H]1S(=O)(=O)N1CCC[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1,C63698445_decoy,CASP3,Decoy,0,-10.0054,-5.7,-2.48,-6.859732869656157
COc1cc(CNc2nc3c(N)cc(C(F)(F)F)cc3nc2-c2ccccc2)cc(OC)c1OC,C01629842_decoy,CASP3,Decoy,0,-8.57708,-6.74,-4.35,-7.279387384187565
O=C(NC(=S)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1sc2ccccc2c1Cl,C03207157_decoy,CASP3,Decoy,0,-10.1126,-7.29,-1.71,-6.099846598123743
CN(N/C(=C/C#N)NC(=O)Nc1cccc(C(F)(F)F)c1)c1ncc(C(F)(F)F)cc1Cl,C03134981_decoy,CASP3,Decoy,0,-8.5994,-5.6,-1.31,-6.339628273789464
NS(=O)(=O)c1ccc(CCNC(=O)CSc2nc(-c3ccccc3)c(-c3ccccc3)o2)cc1,C09390398_decoy,CASP3,Decoy,0,-10.0425,-8.05,-3.23,-8.640133426533595
Cc1ccc2nc(-c3ccc(NC(=O)Cc4csc(NC(=O)NCc5ccco5)n4)cc3)sc2c1,C09785809_decoy,CASP3,Decoy,0,-8.76241,-6.57,-1.56,-7.301538616285442
CCCOc1ccc(C(=O)NC(=S)NNC(=O)[C@@H](C)Oc2ccc(C)c(C)c2)cc1Br,C10154310_decoy,CASP3,Decoy,0,-8.17227,-7.37,-2.04,-6.480352168582571
O=C(NCCc1c[nH]c2ccc(Cl)cc12)c1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1,C10462861_decoy,CASP3,Decoy,0,-8.737,-8.36,-2.63,-6.7822243606863255
CC(=O)Nc1ccc(/C=N/NC(=O)c2ccc(NS(=O)(=O)c3ccc(Br)cc3)cc2)cc1,C12586200_decoy,CASP3,Decoy,0,-8.29489,-5.83,-4.33,-6.201129322119548
COc1ccc(/C=C(\NC(=O)c2cccc(Br)c2)C(=O)NCCc2nc3ccccc3[nH]2)cc1,C09192932_decoy,CASP3,Decoy,0,-6.72477,-7.21,-4.84,-6.244159561934305
CC(C)(C)c1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1Br,C13977100_decoy,CASP3,Decoy,0,-7.69417,-7.15,-2.85,-8.960351679927683
CCCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2cc(C)cc(C)c2)cc1Br,C14041426_decoy,CASP3,Decoy,0,-8.98992,-7.49,-2.84,-7.118029730621824
CCOc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)c1ccc(OCC(C)C)cc1,C14655807_decoy,CASP3,Decoy,0,-8.14916,-5.86,-1.07,-6.083185561644071
CC(C)NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cc(Br)ccc2OC(C)C)cc1,C14668474_decoy,CASP3,Decoy,0,-9.33252,-7.34,-2.17,-7.863255085779556
C=CCNS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cc(Br)ccc2OC(C)C)cc1,C14668502_decoy,CASP3,Decoy,0,-9.34544,-6.86,-2.89,-7.67432211746139
CCCCN(C(=O)c1cccc(I)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C03565626_decoy,CASP3,Decoy,0,-7.03298,-6.61,-2.92,-6.822439184104026
Cc1cc(C)c(NC(=O)CNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(C)c3)cc2)c(C)c1,C15621046_decoy,CASP3,Decoy,0,-6.89178,-7.27,-3.16,-6.257256341047357
CC(C)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)C[C@H](C)C3)c2)cc1,C15885945_decoy,CASP3,Decoy,0,-8.98059,-8.23,-5.96,-7.087254245345292
C[C@@H](Sc1nnc(C2CCCCC2)n1N)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1,C03408426_decoy,CASP3,Decoy,0,-8.45291,-7.34,-0.99,-5.957093815787967
CCOC(=O)c1sc(N)c(C#N)c1CSc1nnc(Nc2cccc(Br)c2)s1,C16543268_decoy,CASP3,Decoy,0,-10.1115,-6.49,-1.43,-6.894695860675687
O=C(CSc1nnc(Nc2cccc(Br)c2)s1)NC(=O)NCCc1cccs1,C16543337_decoy,CASP3,Decoy,0,-12.2082,-6.55,-1.89,-7.44033829194769
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3sccc3C(N)=O)n2-c2ccc(Cl)cc2)cc1,C17059780_decoy,CASP3,Decoy,0,-8.51459,-7.12,-2.85,-6.792840317997304
Cc1cc(C)cc(OCc2nnc(S[C@@H](C)C(=O)Nc3ccc(Br)cc3F)n2N)c1,C18744527_decoy,CASP3,Decoy,0,-7.10614,-5.61,-1.5,-4.7118242079309525
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CSc2c(C)cc(C)cc2C)c(=O)[nH]c1=O,C19181967_decoy,CASP3,Decoy,0,-7.26654,-7.07,-2.55,-7.073545087447024
O=C(NNC(=S)NCCCN1CCOCC1)c1cccc(COc2ccc(Br)cc2)c1,C13959895_decoy,CASP3,Decoy,0,-10.4942,-6.93,-1.33,-7.085260510320151
Cc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)nnc1-c1ccc(Cl)cc1,C21227221_decoy,CASP3,Decoy,0,-6.87698,-8.87,-1.95,-6.963600103741702
C[C@H](Sc1nnc(-c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)n1C)C(=O)Nc1ccc(C(N)=O)cc1,C21276379_decoy,CASP3,Decoy,0,-10.1452,-7.23,-2.57,-6.788447517196477
CC(C)Cn1c(N)c([C@H](c2ccc(-c3ccccc3)s2)N2CCN(c3ccccc3)CC2)c(=O)[nH]c1=O,C13030091_decoy,CASP3,Decoy,0,-8.57006,-6.88,-1.57,-6.341536981868277
C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1ccc(C(N)=O)cc1,C22556040_decoy,CASP3,Decoy,0,-9.41323,-8.4,-1.84,-7.705632979239096
CCc1cccc2c(C(=O)[C@H](OC(=O)c3cc(S(N)(=O)=O)ccc3F)c3ccccc3)c[nH]c12,C23593789_decoy,CASP3,Decoy,0,-10.9212,-7.47,-1.54,-7.051454738501117
O=C(COC(=O)c1ccc([C@H]2Nc3cc(C(F)(F)F)ccc3S(=O)(=O)N2)cc1)NC1CCCCC1,C32986910_decoy,CASP3,Decoy,0,-9.23282,-7.66,-1.77,-7.982584097917815
Cc1cc(C)cc(OCc2nc(C(=O)N[C@@H]3CCCC[C@@H]3NC(=O)Nc3ccccc3F)cs2)c1,C34906233_decoy,CASP3,Decoy,0,-8.40575,-8.25,-2.1,-6.47856395650087
CCOc1cc([C@@H]2C3=C(CC(C)(C)CC3=O)Nc3nc(SCCC(C)C)[nH]c(=O)c32)ccc1O,C35450703_decoy,CASP3,Decoy,0,-10.2992,-7.02,-1.77,-7.491927688930848
CCCCNC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502206_decoy,CASP3,Decoy,0,-7.85124,-7.67,-4.88,-9.2525524233106
CCCN(C(=O)c1cccc(O)c1O)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(N(C)C)cc1,C36571445_decoy,CASP3,Decoy,0,-8.49995,-6.47,-3.18,-7.512592725117007
O=c1cc(C[C@H]2NN=C(SCc3cccc(C(F)(F)F)c3)N2c2ccc(F)cc2)[nH]c(=O)[nH]1,C39362932_decoy,CASP3,Decoy,0,-7.90103,-8.85,-2.81,-10.198293630666752
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=S)N[C@H](C)c3ccc4c(c3)OCO4)cc2)c(C)c1,C39974283_decoy,CASP3,Decoy,0,-8.08472,-7.79,-4.19,-8.190545451835126
Cc1cccc(OC[C@H](O)CNc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@H](C(C)(C)C)C3)c1,C40313307_decoy,CASP3,Decoy,0,-10.0804,-7.45,-2.97,-8.874594780332366
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc(C)c2)N2C(/C=C(\[O-])NCC[NH+](C)C)=CSC2=N1,C40400624_decoy,CASP3,Decoy,0,-7.9304,-6.24,-5.08,-6.1475581749972905
CCSc1nc2n(n1)[C@@H](c1ccc(OCc3ccc(Br)cc3)cc1)C(C(N)=O)=C(C)N2,C41004968_decoy,CASP3,Decoy,0,-7.58008,-7.13,-3.3,-5.8870879509551575
CCSc1nc2n(n1)[C@@H](c1cc(Br)ccc1OCc1ccccc1C)C(C(N)=O)=C(C)N2,C41004981_decoy,CASP3,Decoy,0,-9.28971,-6.24,-3.54,-7.197674430266252
NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1Nc1ccc(OCc3ccccn3)cc1CC2,C45336726_decoy,CASP3,Decoy,0,-8.55152,-7.78,-4.4,-6.294045952660357
C[C@@H](Sc1nnc(Nc2ccc(SC(F)F)cc2)s1)C(=O)NC(=O)NCC(F)(F)F,C45898855_decoy,CASP3,Decoy,0,-8.36692,-5.87,-1.81,-7.913940255958563
CC(=O)Nc1cccc(Nc2nnc(SCC(=O)Nc3sc4c(c3C#N)CCCCC4)s2)c1,C46587671_decoy,CASP3,Decoy,0,-9.35655,-8.44,-1.26,-7.344137112457667
O=C(Nc1cccc(-c2cn3ccnc3c(NCc3ccncc3)n2)c1)Nc1ccccc1C(F)(F)F,C49034825_decoy,CASP3,Decoy,0,-7.90184,-6.87,-3.6,-6.384485088345693
CCC[C@@H](NC(=O)[C@@H](C)Sc1nnc(COc2cc(C)ccc2C(C)C)n1N)c1ccccc1,C57783692_decoy,CASP3,Decoy,0,-8.56098,-6.01,-3.52,-6.980813587800561
Nn1c(SCCCC(=O)N/N=C/C=C/c2ccccc2)nnc1-c1ccc(Br)cc1,C58989856_decoy,CASP3,Decoy,0,-9.3308,-6.47,-1.52,-6.716715414350428
C/C(=N/Nc1nc(SCC(=O)NCCc2ccc(Cl)cc2)n[nH]1)c1ccc(Br)cc1,C59020938_decoy,CASP3,Decoy,0,-8.97608,-5.67,-2.04,-6.373362517757454
O=C(CC1=c2ccccc2=[NH+]C1)NNC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c1,C63205661_decoy,CASP3,Decoy,0,-8.57696,-8.72,-4.68,-8.585678298894125
CSc1nn(CC(=O)Nc2cccc(C(F)(F)F)c2)c(N)c1S(=O)(=O)c1ccc(Cl)cc1,C45986968_decoy,CASP3,Decoy,0,-9.39413,-6.64,-2.37,-7.07533171802943
C=CCn1c(SCC(=O)Nc2ccc(Cl)c(Cl)c2)nnc1-c1sc2ncccc2c1N,C64794655_decoy,CASP3,Decoy,0,-9.10977,-7.07,-1.15,-7.112170652349548
O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC(=S)N1[C@@H]1CCS(=O)(=O)C1,C02069455_decoy,CASP3,Decoy,0,-7.92619,-6.78,-1.21,-5.841003106382804
O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC(=S)N1[C@H]1CCS(=O)(=O)C1,C08435055_decoy,CASP3,Decoy,0,-6.5709,-9.18,-1.05,-6.206466834836031
COc1ccccc1N1CCN2c3cc(Cl)ccc3CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]2C1,C08773680_decoy,CASP3,Decoy,0,-7.70665,-6.64,-1.44,-7.1126079300329454
Cc1cc(/C=C/C(=O)N2CCN(C(=O)c3ccco3)CC2)c(C)n1-c1ccc2c(c1)OCO2,C09221175_decoy,CASP3,Decoy,0,-7.50833,-6.34,-2.14,-5.506752991942858
Cc1ccc(-n2nnc3c(N4CCN(C(=O)c5c(F)cccc5Cl)CC4)ncnc32)cc1,C11665806_decoy,CASP3,Decoy,0,-7.32045,-7.79,-1.77,-5.083205635245737
Cc1cccc(N2CCN(S(=O)(=O)c3ccc(N4C(=O)CCS4(=O)=O)cc3C)CC2)c1,C11904036_decoy,CASP3,Decoy,0,-7.44378,-6.44,-2.24,-5.657503661049916
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)n1cc(I)cn1,C12372258_decoy,CASP3,Decoy,0,-5.71493,-5.8,-1.05,-5.0448093030464936
O=C(c1ccc(Br)o1)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1,C12391701_decoy,CASP3,Decoy,0,-9.27343,-6.81,-1.56,-6.921792022224769
O=C(c1ccc(-c2ccccc2F)cc1)N1CCC(n2cc(C(=O)N3CCOCC3)nn2)CC1,C12450641_decoy,CASP3,Decoy,0,-5.92726,-7.96,-2.32,-4.384332530750527
CC(C)C(=O)N1CCN(C(=O)c2cc3c(cc2Cl)N2CCCCCC2=NS3(=O)=O)CC1,C12607876_decoy,CASP3,Decoy,0,-6.99869,-6.61,-0.59,-5.118086563933041
COc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2cc(C)on2)cc1OC,C13556351_decoy,CASP3,Decoy,0,-7.50299,-6.29,-1.36,-5.892636468904204
COc1cccc([C@@H]2OCCn3c(-c4ccccc4)c4c(=O)n(C)c(=O)n(C)c4c32)c1OC,C13576044_decoy,CASP3,Decoy,0,-7.12962,-5.69,-1.37,-5.331456221963063
COc1ccc(N2C(=O)C(C)(C)CS2(=O)=O)cc1S(=O)(=O)N1CCc2ccccc2C1,C13684527_decoy,CASP3,Decoy,0,-7.4219,-7.5,-0.72,-5.877120033153536
Cc1ccc(-n2ncc3c(=O)n4c(nc32)SC[C@H]4CC(=O)N2C[C@@H](C)O[C@H](C)C2)c(C)c1,C14013785_decoy,CASP3,Decoy,0,-9.83795,-7.75,-1.8,-6.6604493002735214
Cc1noc2ncnc(N3CCC(C(=O)N4CCN(c5ccc(Cl)cc5)CC4)CC3)c12,C15728875_decoy,CASP3,Decoy,0,-7.84304,-6.61,-1.72,-5.481159918237461
O=C(Cc1cccs1)N1CCN(c2ncnc3c2nnn3-c2ccc(Cl)cc2)CC1,C15884026_decoy,CASP3,Decoy,0,-7.85024,-8.09,-2.35,-6.984885931082624
CSc1ccccc1C(=O)N1CCN(c2ncnc3c2nnn3-c2ccc(Cl)cc2)CC1,C15884030_decoy,CASP3,Decoy,0,-6.81615,-7.67,-1.01,-7.0344783722374284
Cc1c(C(=O)N(C)C)sc2ncn3nc(-c4nn(C)c(C)c4Br)nc3c12,C02790310_decoy,CASP3,Decoy,0,-6.86555,-6.13,-4.09,-5.1675742675098375
CN(C(=O)CN1N=C(C(C)(C)C)Cn2c(cc3ccccc32)C1=O)[C@@H]1CCS(=O)(=O)C1,C19082243_decoy,CASP3,Decoy,0,-6.53079,-7.39,-3.68,-5.5160925924796365
O=C(c1nc2sccn2c1CN1CCN(c2cnccn2)CC1)N1CCCCCCC1,C20204879_decoy,CASP3,Decoy,0,-8.0186,-6.68,-2.93,-5.919700329412364
Cc1cccc(N2CCN(C(=O)[C@@H]3CCCN3c3nnc(N4CCCC4=O)s3)CC2)c1C,C21927028_decoy,CASP3,Decoy,0,-8.77922,-6.52,-1.41,-5.905104528818323
Cc1nc2ncnn2c(N2CCN(C(=O)c3cccc(C#N)c3)CC2)c1Cc1ccccc1,C23461419_decoy,CASP3,Decoy,0,-6.98647,-8.01,-3.05,-6.227952703871915
O=C([C@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)c2ccccc2O1)N1CCOCC1,C24707644_decoy,CASP3,Decoy,0,-6.68504,-7.55,-2.5,-5.648337327469407
O=S(=O)(c1ccccc1F)N1CCN(c2nc3nccc(-c4cccs4)n3n2)CC1,C25146686_decoy,CASP3,Decoy,0,-8.999,-6.12,-0.82,-6.0868047056619945
Cc1nc(N2CCN(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)CC2)c2c3c(sc2n1)CCCC3,C26776520_decoy,CASP3,Decoy,0,-8.69205,-7.03,-5.27,-6.094795671055281
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCC(c3nnc4ccccn34)CC2)o1,C28735191_decoy,CASP3,Decoy,0,-7.17676,-7.18,-3.82,-5.429795755168016
Cc1noc2nc(-c3cccs3)cc(C(=O)N3CCC[C@@H](c4nnc5ccccn45)C3)c12,C32888486_decoy,CASP3,Decoy,0,-8.53395,-9.66,-1.55,-9.049377109665851
Cc1cc(C(=O)N2CCN(c3c(-c4ccccc4)cnc4ncnn34)CC2)cc(Cl)n1,C34915700_decoy,CASP3,Decoy,0,-6.70618,-7.78,-1.39,-6.224506974389088
C[C@@H]1CN(Cc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccc(Cl)cc2)C[C@@H](C)O1,C20533337_decoy,CASP3,Decoy,0,-8.39584,-7.93,-1.92,-7.873438906518396
C[C@H]1O[C@@H](c2cc3c(cc2Cl)OCO3)N=C1CN1CC[C@H]2N=CN=C2[C@@H]1c1ccccn1,C39500541_decoy,CASP3,Decoy,0,-8.38506,-7.89,-1.7,-6.173267721229998
COc1cc(/C=C(/C(=O)N2CCCC2)C2=NC(=O)C3=C(C)[C@@H](C)SC3=N2)cc2c1OCO2,C39731541_decoy,CASP3,Decoy,0,-8.71981,-7.01,-1.05,-6.890421737842581
CC1=C2C(=O)N=C([C@@H](C)OC(=O)c3ccc4c(=O)n5c(nc4c3)CCC5)N=C2S[C@H]1C,C39733625_decoy,CASP3,Decoy,0,-7.28078,-7.71,-0.71,-6.290646766531195
C[C@@H]1C[C@H](C)CN(S(=O)(=O)N2CCCN(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)C1,C13004278_decoy,CASP3,Decoy,0,-8.49339,-7.27,-1.37,-7.307349315276991
O=C(c1ccc2nsnc2c1)N1CCN(C(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCO3)CC1,C44448123_decoy,CASP3,Decoy,0,-9.43574,-7.39,-2.32,-7.23263036178683
O=C(c1ccc2nsnc2c1)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCO3)CC1,C44448125_decoy,CASP3,Decoy,0,-9.05369,-6.54,-0.89,-6.423668496946711
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCN(c2oc(C3CC3)nc2C#N)CC1,C46623052_decoy,CASP3,Decoy,0,-7.78495,-6.66,-3.25,-5.936359471906051
COc1ccc(-c2cc3ccc4c(c3oc2=O)CN([C@@H]2CCS(=O)(=O)C2)CO4)c(OC)c1,C13733039_decoy,CASP3,Decoy,0,-9.09717,-6.7,-1.88,-6.173619534232419
O=c1c(Cl)c(N2CCN(Cn3c(=O)oc4ccccc43)CC2)cnn1-c1ccccc1,C57292120_decoy,CASP3,Decoy,0,-6.79152,-7.94,-0.61,-5.432712859067588
Cc1noc([C@@H]2CCCN(C(=O)c3cc(-c4cccs4)nc4c3cnn4C(C)C)C2)n1,C59586981_decoy,CASP3,Decoy,0,-10.1376,-6.69,-0.73,-6.79460133339761
Cc1cc(/C=C2\C(=O)N(C)C(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1,C59595032_decoy,CASP3,Decoy,0,-7.38139,-6.44,-3.09,-5.14497247717825
CC(C)n1ncc2c(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc(-c3ccc4c(c3)OCCO4)nc21,C14049236_decoy,CASP3,Decoy,0,-7.4561,-7.98,-1.98,-6.146398175019864
C[C@@H]1C[C@H](C)CN(C(=O)CSc2nc(C(C)(C)C)nc3c2c(=O)n(C)c(=O)n3C)C1,C11456537_decoy,CASP3,Decoy,0,-8.05283,-7.12,-1.2,-6.525204320333039
C[C@@H]1CCC[C@@H](C)N1C(=O)CSc1nc(C(C)(C)C)nc2c1c(=O)n(C)c(=O)n2C,C28690647_decoy,CASP3,Decoy,0,-7.65353,-7.54,-3.36,-7.25074189318656
N#Cc1ccc(N2CCC(C(=O)N3CCN(Cc4cn5cc(Cl)ccc5n4)CC3)CC2)nc1,C62580832_decoy,CASP3,Decoy,0,-8.75817,-6.66,-0.54,-5.599312667662802
COC(=O)c1ccc(/C=C2\Oc3c(cc4c(c3C)OCN([C@@H]3CCS(=O)(=O)C3)C4)C2=O)cc1,C41587301_decoy,CASP3,Decoy,0,-7.29523,-8.45,-1.42,-4.984836641910874
O=C1/C(=C\c2ccc3c(c2)OCO3)Oc2c1ccc1c2CN([C@H]2CCS(=O)(=O)C2)CO1,C41661360_decoy,CASP3,Decoy,0,-8.33759,-7.47,-0.96,-5.821597389715523
CC1=N[C@@H](C(=O)N2CCC(CC(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)C(C)=C1C,C63625770_decoy,CASP3,Decoy,0,-6.52091,-6.5,-2.35,-4.950769441688083
Cn1c(=O)c2sccc2n2c(CCC(=O)N3CCN(c4ccc(Cl)cc4)CC3)nnc12,C35528425_decoy,CASP3,Decoy,0,-8.66383,-6.62,-1.77,-6.361460735469466
Cn1nc(C(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)c2c1CCN(C(=O)C1CCCCC1)C2,C64565668_decoy,CASP3,Decoy,0,-8.74973,-6.24,-2.25,-6.664126029815236
Cc1nn(-c2ccc(F)cc2)c2nc(N3CCCN(C(=O)c4ccnn4C)CC3)sc12,C65300178_decoy,CASP3,Decoy,0,-7.85094,-6.25,-2.28,-5.89214458403516
Cc1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccccc2F)C(=O)Cn2nnc(-c3cccs3)n2)cc1,C00887688_decoy,CASP3,Decoy,0,-10.6087,-7.59,-2.5,-8.571136105497198
CCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(CCc2ccc(OC)c(OC)c2)C1=O,C08858006_decoy,CASP3,Decoy,0,-9.98522,-7.88,-1.48,-7.71974524787425
CCOCCCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(Cc2ccc(OC)cc2)C1=O,C08859266_decoy,CASP3,Decoy,0,-8.41747,-6.21,-2.59,-6.373075596976377
COc1ccc(S(=O)(=O)NC[C@@H](c2ccc3c(c2)OCO3)S(=O)(=O)c2cccs2)cc1OC,C08969454_decoy,CASP3,Decoy,0,-8.94263,-7.26,-0.97,-7.937598056587766
COCC(=O)Nc1nnc(SCc2cc(=O)c(OC(=O)c3ccccc3C(F)(F)F)co2)s1,C09147612_decoy,CASP3,Decoy,0,-8.15744,-6.99,-1.43,-7.2109160811710575
COc1cc(/C=C\C(=O)NCCS(=O)(=O)N2CCN(c3ccccc3Cl)CC2)cc(OC)c1OC,C10070308_decoy,CASP3,Decoy,0,-8.11397,-7.26,-1.29,-6.136044697158211
COc1cc(C)c(S(=O)(=O)NCCc2cn(S(=O)(=O)c3cc(C)c(OC)cc3C)cn2)cc1C,C12445226_decoy,CASP3,Decoy,0,-8.08892,-7.33,-2.56,-6.212883019523812
O=C(NC[C@@H]1CCCO1)[C@H](c1ccc(F)cc1)N(Cc1cccs1)C(=O)Cn1nnc2ccccc21,C12481194_decoy,CASP3,Decoy,0,-8.89136,-7.42,-1.92,-7.683666887894644
COc1ccccc1N(C(=O)Cn1nnc2ccccc21)[C@H](C(=O)NC[C@@H]1CCCO1)c1ccccc1F,C12483051_decoy,CASP3,Decoy,0,-7.60145,-7.9,-2.36,-8.347945898585602
Cc1ccc(-c2nnn(CC(=O)N(C[C@H]3CCCO3)[C@@H](C(=O)NC3CCCC3)c3cccs3)n2)cc1,C12704156_decoy,CASP3,Decoy,0,-10.3052,-6.79,-3.91,-6.5248936617140085
CCCOc1ccc([C@H]2CN3C(=O)CN(CCOC)C(=O)[C@]3(C)c3[nH]c4ccccc4c32)cc1OCC,C12880384_decoy,CASP3,Decoy,0,-8.43168,-7.06,-4.47,-6.743125122333431
CCOC(=O)[C@](NC(=O)N(C1=NC[C@H](C)S1)c1cccc(C)n1)(OCC(F)(F)F)C(F)(F)F,C09353348_decoy,CASP3,Decoy,0,-6.6681,-5.29,-4.48,-6.169189287852714
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(NCCCOC(C)C)nc12,C13713698_decoy,CASP3,Decoy,0,-8.42575,-6.17,-2.48,-6.196488567002481
COc1cc(CN(C(=O)Cc2csc(C)n2)[C@H]2CCCCNC2=O)ccc1OCCc1scnc1C,C14980577_decoy,CASP3,Decoy,0,-9.09832,-7.55,-1.89,-6.969828964963405
CCCOc1ccc([C@@H]2CN3C(=O)CN(CCCOC)C(=O)[C@@]3(C)c3[nH]c4ccccc4c32)cc1OC,C02135662_decoy,CASP3,Decoy,0,-8.25128,-6.2,-1.96,-5.804943866602429
CCOC(=O)[C@@H]1CCCN(C(=O)c2csc(CN(CCOC)C(=O)Nc3ccc(Cl)cc3)n2)C1,C16459112_decoy,CASP3,Decoy,0,-9.07753,-6.21,-4.45,-7.722517708415257
CCOC(=O)[C@H]1CCCN(C(=O)c2csc(CN(CCOC)C(=O)Nc3c(C)cccc3C)n2)C1,C16459425_decoy,CASP3,Decoy,0,-8.11622,-7.22,-2.61,-8.059351756216078
COCCn1nnnc1[C@H](c1cc2cccc(C)c2[nH]c1=O)N(Cc1ccc(Cl)cc1)Cc1ccco1,C19973113_decoy,CASP3,Decoy,0,-9.17672,-7.0,-1.95,-7.756148240751394
Cc1cccc2cc([C@H](c3nnnn3C[C@@H]3CCCO3)N(Cc3ccccc3)Cc3ccco3)c(=O)[nH]c12,C20082870_decoy,CASP3,Decoy,0,-8.94357,-7.68,-4.49,-5.866172484631992
CC[C@@H](c1nnnn1C[C@@H]1CCCO1)N(Cc1ccccc1OC)Cc1cc2cc(C)ccc2[nH]c1=O,C13495380_decoy,CASP3,Decoy,0,-8.75931,-7.72,-3.69,-8.559200676872146
CCOCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3ccc(C)cn3c2=O)SC1=S,C20149791_decoy,CASP3,Decoy,0,-10.1488,-5.53,-2.85,-6.613781278882978
CCOC(=O)c1c(NC(=O)CSc2nnc(C3CC3)n2C[C@H]2CCCO2)sc2c1CC[C@@H](C)C2,C20168373_decoy,CASP3,Decoy,0,-8.97752,-6.91,-2.89,-8.414021213958065
CCSc1nnc(NC(=O)Cn2cc(OC)c(=O)cc2CN2CCN(c3ccc(F)cc3)CC2)s1,C20830117_decoy,CASP3,Decoy,0,-9.3752,-6.89,-1.89,-7.378312116817476
O=C(CN(c1cccc(F)c1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCSCc1ccco1,C22388898_decoy,CASP3,Decoy,0,-8.20881,-6.49,-1.0,-7.458143921187285
CS(=O)(=O)N(CC(=O)NCCCSCc1ccccc1F)c1ccc(C(=O)N2CCOCC2)cc1,C22424953_decoy,CASP3,Decoy,0,-9.95441,-7.52,-2.05,-10.264812657858782
CCCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(CCc2ccc(OC)c(OC)c2)C1=O,C33706567_decoy,CASP3,Decoy,0,-6.91532,-7.71,-1.85,-6.343882666919462
CCOC(=O)[C@@H]1CCCN(C(=O)Cc2csc(NC(=O)CN(C(=O)C3CCCCC3)C3CC3)n2)C1,C35168341_decoy,CASP3,Decoy,0,-8.95452,-7.35,-5.23,-6.597832011999183
COc1cc(C(=O)N2[C@@H](c3cccs3)SC[C@H]2C(=O)NCCN2CCOCC2)cc(OC)c1OC,C35192362_decoy,CASP3,Decoy,0,-9.93655,-6.72,-1.53,-10.039219141133392
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)o1)S(=O)(=O)c1ccccc1,C35251503_decoy,CASP3,Decoy,0,-8.09494,-6.31,-4.02,-6.658404813357002
CCCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCCn2cc[nH+]c2)cc1OCC,C35444551_decoy,CASP3,Decoy,0,-7.66625,-6.18,-1.89,-6.680980160314391
COc1cc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CC[NH+](C)C)ccc1OCCC(C)C,C35567046_decoy,CASP3,Decoy,0,-9.30408,-5.74,-2.01,-7.222891146854673
COc1ccc(CN(Cc2ccco2)S(=O)(=O)c2ccc(C)cc2)cc1OCc1nc(CO)cs1,C35716986_decoy,CASP3,Decoy,0,-10.3706,-8.03,-3.95,-9.099075540403586
C/C=C\[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(Cc1ccco1)C(=O)Cc1ccc2c(c1)OCO2,C36502132_decoy,CASP3,Decoy,0,-8.6829,-7.18,-1.89,-7.1842835792860615
COc1ccc([C@H](C(=O)NCS(=O)(=O)c2ccc(C)cc2)N(Cc2ccc(C)o2)C(=O)CCl)cc1,C36600130_decoy,CASP3,Decoy,0,-8.86231,-7.68,-2.46,-9.309030037350968
CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(Cc1ccc(C)o1)C(=O)c1cccnc1,C36602353_decoy,CASP3,Decoy,0,-7.34106,-6.95,-4.76,-6.738892096210778
C=CCO[C@H]1C[C@](OCc2cccc(C(F)(F)F)c2)(C(=O)NN2CCOCC2)C[C@H]2OC(C)(C)O[C@@H]12,C37422112_decoy,CASP3,Decoy,0,-7.79016,-5.51,-2.5,-5.753576605909476
CCOC(=O)c1sc(NC(=O)CSc2cc(N3CCN(c4ccccc4F)CC3)ncn2)nc1C,C38537461_decoy,CASP3,Decoy,0,-11.1113,-7.56,-0.86,-7.445481760297412
CC(C)S(=O)(=O)c1ccc([C@H](CC=O)NC=O)c(S(=O)(=O)Oc2ccccc2)c1Br,C39498548_decoy,CASP3,Decoy,0,-7.88666,-7.26,-1.41,-7.400541118212067
O=CC[C@H](NC=O)c1ccc(F)c(S(=O)(=O)Oc2ccccc2)c1S(=O)(=O)Oc1ccccc1,C39498588_decoy,CASP3,Decoy,0,-7.42059,-6.91,-1.14,-6.985734837865309
CCn1c(NCCc2ccc(OC)c(OC)c2)c(/C=C2/SC(=S)N(C(C)C)C2=O)c(C)c(C#N)c1=O,C39851344_decoy,CASP3,Decoy,0,-9.18385,-6.24,-2.68,-7.260405902402258
CCCCn1c(NCCc2ccc(OC)c(OC)c2)c(/C=C2/SC(=S)N(C)C2=O)c(C)c(C#N)c1=O,C39851736_decoy,CASP3,Decoy,0,-8.73074,-6.57,-1.28,-7.53024180945514
CCCCn1c(NCc2ccc(OC)cc2)c(/C=C2/SC(=S)N(CCOC)C2=O)c(C)c(C#N)c1=O,C39851771_decoy,CASP3,Decoy,0,-9.12175,-5.52,-2.97,-6.866655704356057
CCC(C)(C)n1nnnc1[C@H](C(C)C)N(CCN1CCOCC1)Cc1cc2ccc(C)c(C)c2[nH]c1=O,C22928392_decoy,CASP3,Decoy,0,-8.69136,-8.09,-2.43,-7.505480355375398
[H]/N=C1C(=C/c2cc(Cl)ccc2OCCOCCOc2ccccc2)/C(=O)N=C2SC(C(F)(F)F)=NN2/1,C01771038_decoy,CASP3,Decoy,0,-8.54048,-6.15,-3.71,-7.417395370012624
[H]/N=C1C(=C/c2cc(Cl)c(OCCOc3ccc(C)cc3)c(OCC)c2)/C(=O)N=C2SC(CC)=NN2/1,C08770009_decoy,CASP3,Decoy,0,-8.66782,-6.82,-1.93,-6.534405671702359
[H]/N=C1C(=C/c2cc(Cl)c(OCCOc3ccc(CC=C)cc3OC)c(OC)c2)\C(=O)N=C2C=C(C)ON2\1,C41078501_decoy,CASP3,Decoy,0,-8.09344,-7.52,-1.73,-6.5761904303259
[H]/N=C1C(=C\c2ccc(OCCOc3ccc(C(C)(C)C)cc3)c(OC)c2)/C(=O)N=C2SC(CC)=NN2/1,C09730580_decoy,CASP3,Decoy,0,-8.30874,-6.01,-2.6,-5.5560484968218775
[H]/N=C1C(=C/c2ccc(OCCOc3ccccc3[C@@H](C)CC)c(OC)c2)/C(=O)N=C2SC(CC)=NN2/1,C27549739_decoy,CASP3,Decoy,0,-8.41691,-7.0,-2.27,-6.400172490567333
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(Cl)c(C)c3)c(OCC)c2)/C(=O)N=C2SC(CC)=NN2/1,C27549785_decoy,CASP3,Decoy,0,-8.87773,-7.22,-2.33,-6.599475363596724
[H]/N=C1C(=C\c2cc(OC)c(OCCOc3ccc(C)cc3)c(OC)c2)\C(=O)N=C2SN=C(SC)N2\1,C20114632_decoy,CASP3,Decoy,0,-9.97213,-6.16,-1.05,-7.053930024410994
N#Cc1c(NC(=O)c2cc3ncc(Br)cn3n2)sc2c1CCCC2,C00753202_decoy,CASP3,Decoy,0,-8.22803,-6.45,-0.87,-5.183025181088388
Cc1cc2oc(=O)cc(CN3C(=O)N[C@]4(CCCc5ccccc54)C3=O)c2cc1C,C04468816_decoy,CASP3,Decoy,0,-7.52694,-8.48,-1.25,-6.148728712253976
CSc1nnc2c(n1)O[C@H](c1cccnc1)Nc1ccc(Br)cc1-2,C01184880_decoy,CASP3,Decoy,0,-6.91037,-6.77,-4.7,-5.163536423843803
Cc1nc2sc3c(NC[C@H]4CCCO4)ncnc3c2c2c1COC(C)(C)C2,C02299673_decoy,CASP3,Decoy,0,-7.86245,-6.37,-1.6,-4.627933603884656
O=C(N/N=C/c1ccc(I)o1)c1ccc2c(c1)OCO2,C00827334_decoy,CASP3,Decoy,0,-7.38092,-5.35,-1.9,-4.241575656723984
Cc1c(C(=O)Nc2sc3c(c2C#N)CCCC3)nnn1-c1ccccc1F,C04938568_decoy,CASP3,Decoy,0,-8.23914,-6.92,-1.78,-4.605908510839684
C[C@@H]1CCc2c(sc(NC(=O)C3=NN(c4ccccc4)C(=O)CC3)c2C#N)C1,C05485553_decoy,CASP3,Decoy,0,-8.13535,-7.38,-0.98,-5.642934106466652
Cc1cccc(N2N=C(C(=O)Nc3nc4c(s3)CCCC4)CCC2=O)c1,C06086095_decoy,CASP3,Decoy,0,-8.17799,-7.58,-1.86,-5.795408147962062
CC(=O)N1CCOc2cc(S(=O)(=O)Nc3ccc(C)cc3C)c(Cl)cc21,C06779710_decoy,CASP3,Decoy,0,-6.05402,-7.08,-0.98,-5.975762118843504
Cc1cccc2cc([C@@H]3C=C(c4ccco4)NN3S(C)(=O)=O)c(Cl)nc12,C02206954_decoy,CASP3,Decoy,0,-7.04434,-6.35,-1.15,-5.134673907579469
Cc1nc2n(n1)[C@H](c1cccc3ccccc13)C1=C(C[C@@H](c3ccco3)CC1=O)N2,C08560024_decoy,CASP3,Decoy,0,-7.13141,-6.87,-2.04,-5.948992078372361
Cc1cc(C)cc(-n2ncc3c2CCC[C@@H]3NC(=O)c2ccc3nccnc3c2)c1,C11945205_decoy,CASP3,Decoy,0,-7.30177,-8.32,-2.27,-7.691970167860824
CC(=O)c1ccc(N2C(=O)[C@H]3Cc4c([nH]c5ccccc45)C(C)(C)N3C2=O)cc1,C16040818_decoy,CASP3,Decoy,0,-7.10905,-7.2,-2.26,-5.1320640016191605
C[C@@H](Sc1ccc2c(c1)OCCO2)C(=O)N1c2ccccc2NC(=O)C1(C)C,C16819131_decoy,CASP3,Decoy,0,-6.1506,-7.1,-2.14,-5.769207873679488
Cc1cc(C)nc(-n2nc(C)c3c2NC(=O)CS[C@@H]3c2cccc(Cl)c2)n1,C20891618_decoy,CASP3,Decoy,0,-7.90132,-6.69,-1.83,-4.647864964182127
Cc1nn(-c2nc3ccccc3o2)c2c1[C@H](c1ccc(Cl)cc1)CC(=O)N2,C21660887_decoy,CASP3,Decoy,0,-6.8545,-6.32,-5.55,-4.43248322356418
Cc1ccc(C)c(NC(=O)c2nc(-n3cnnc3)ccc2Br)c1,C21721177_decoy,CASP3,Decoy,0,-7.5315,-6.31,-0.66,-6.877383718618455
Cc1c(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)oc2c(F)cccc12,C24044952_decoy,CASP3,Decoy,0,-5.75958,-8.98,-1.84,-6.951733766402361
Cc1[nH+]cc2c(c1[O-])[C@@H]([C@H]1C(=O)N(c3ccccc3)N=C1c1ccccc1)OC2,C06674477_decoy,CASP3,Decoy,0,-6.54775,-8.96,-1.43,-6.583100853732577
CCNC(=O)N1CCN(c2nc(C3CC3)nc3sc4c(c23)CCCC4)CC1,C35866885_decoy,CASP3,Decoy,0,-8.09355,-5.86,-2.42,-6.293975194336446
O=C([C@H]1Sc2nnc(-c3ccccc3)n2N[C@H]1c1ccccc1)N1CCCC1,C20069022_decoy,CASP3,Decoy,0,-6.43412,-6.09,-4.72,-4.728610519868133
Cc1cccc([C@H]2Oc3ccccc3C3=C2[C@@H](c2cccnc2)N2NC=NC2=N3)c1,C13213348_decoy,CASP3,Decoy,0,-7.24361,-6.69,-1.07,-5.228037683849414
Brc1cccc(C2=C[C@H](C3=NN4C=Nc5ccccc5[C@H]4N3)N=N2)c1,C39239680_decoy,CASP3,Decoy,0,-6.89428,-6.86,-1.07,-4.052804918477674
O=C([C@H]1N=NC2=C1CCCC2)N1CCc2c([nH]c3ccccc23)[C@@H]1c1ccccn1,C39531387_decoy,CASP3,Decoy,0,-6.59548,-6.3,-0.44,-4.66042806454138
Cc1ccc(-c2nc(CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)co2)c(C)c1,C40057035_decoy,CASP3,Decoy,0,-6.7855,-8.44,-3.73,-5.414983144120003
Cc1ccc(-n2cnc3nc(N4c5ccccc5C[C@@H]4C)[nH]c(=O)c3c2=S)cc1,C40385761_decoy,CASP3,Decoy,0,-5.92719,-7.82,-2.16,-4.574423025177257
Cc1cccc(-n2c(C)nc3nc(N4CCC(C)CC4)[nH]c(=O)c3c2=S)c1,C40386879_decoy,CASP3,Decoy,0,-8.10693,-6.19,-3.67,-6.723101821365791
Cc1nn(C(C)C)c(C)c1Nc1nc2sc3c(c2c(=O)n1C)CCCC3,C41393870_decoy,CASP3,Decoy,0,-7.64984,-7.87,-3.06,-5.438626441016547
Cc1cc(N(C)C)ccc1NC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2,C46030855_decoy,CASP3,Decoy,0,-8.00233,-7.48,-2.27,-6.365363837030536
Cc1cccc(-n2nc(C)c3c2NC(=O)C[C@@H]3C(=O)c2cc3ccccc3o2)c1,C46057550_decoy,CASP3,Decoy,0,-5.98112,-7.22,-1.22,-3.922371208455573
O=C(c1ccc2[nH]ccc2c1)N1CCC(n2cc(C3CCCCC3)nn2)CC1,C48246267_decoy,CASP3,Decoy,0,-7.3807,-7.49,-1.43,-5.395555033809114
Cc1c(C(=O)N2CCN(c3ccccc3)CC2)oc2c1/C(=N/O)CC(C)(C)C2,C13571790_decoy,CASP3,Decoy,0,-7.94469,-1.96,-0.75,-3.42004616980858
CSc1nc2n(n1)[C@H](c1ccc(N(C)C)cc1)C1=C(CC(C)(C)CC1=O)N2,C01087982_decoy,CASP3,Decoy,0,-10.0521,-4.82,-1.35,-6.259842461046453
Cc1ccc(-n2ncc(N[C@H]3CCS(=O)(=O)C3)c(Cl)c2=O)cc1Cl,C51282946_decoy,CASP3,Decoy,0,-8.05227,-5.76,-0.9,-4.642097405967359
O=C1[C@H]2CCC[C@@H]1[C@H](c1ccc3c(c1)OCO3)N[C@H]2c1ccc2c(c1)OCO2,C12375084_decoy,CASP3,Decoy,0,-7.56726,-8.03,-1.17,-6.632459874038734
Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc3c(c1)OCO3)S[C@H](C)C(=O)N2,C06678947_decoy,CASP3,Decoy,0,-7.31701,-6.42,-2.03,-6.02671517567607
Cc1ccc(N2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1[N+](=O)[O-],C59396534_decoy,CASP3,Decoy,0,-6.46711,-6.71,-3.47,-5.677665317762801
CC1(C)CC(=O)c2sc(NC(=O)[C@H]3CCCN(C(=O)C(C)(C)C)C3)nc2C1,C59741132_decoy,CASP3,Decoy,0,-9.22972,-6.15,-2.91,-6.7834083173805535
O=c1[nH]c(Cn2cc(C(F)(F)F)cc(Cl)c2=O)nc2c1oc1ccccc12,C61126623_decoy,CASP3,Decoy,0,-6.76023,-6.7,-0.94,-6.281486749482013
O=C(Nc1ccc(-n2cccn2)nc1)N1CCC[C@@H]1c1ccc(Cl)cc1,C48134781_decoy,CASP3,Decoy,0,-6.96341,-5.89,-1.39,-5.352162816558048
CC1=C2C(=NC(=O)CS[C@H]2c2ccc3c(c2)OCO3)N(c2ccc(C)cc2)N1,C13127208_decoy,CASP3,Decoy,0,-7.99869,-7.36,-1.05,-6.245344353839956
Cc1ccc([C@@H]2CC(O)=Nc3c2c(C)nn3-c2ccc(Cl)nn2)cc1C,C32097324_decoy,CASP3,Decoy,0,-8.14067,-8.38,-0.73,-7.905064448107977
Cc1ccc(C)c([C@@H]2CC(O)=Nc3c2c(C)nn3-c2ccc(Cl)nn2)c1,C32088401_decoy,CASP3,Decoy,0,-8.03275,-6.43,-2.58,-5.20481005529183
Cn1c(Cc2nc3sc4c(c3c(=O)[nH]2)CCSC4)nnc1-c1ccccc1,C63579819_decoy,CASP3,Decoy,0,-8.65611,-6.27,-4.75,-5.46763220789196
Fc1cc(Cl)ccc1-c1nnc2n1N[C@@H]([C@H]1N=NC=C1Br)S2,C63807306_decoy,CASP3,Decoy,0,-8.5449,-6.18,-0.23,-6.197853014631302
Cc1cc2c(cc1NS(=O)(=O)c1ccc(Cl)cc1C)n(C)c(=O)n2C,C64591870_decoy,CASP3,Decoy,0,-4.98184,-6.05,-1.72,-3.939910684579461
Cc1cccc(C2(NC(=O)C3=CN4CCS(=O)(=O)N=C4C=C3)CCCC2)c1,C66511719_decoy,CASP3,Decoy,0,-8.89213,-6.69,-0.49,-7.714439132250418
Cc1c(C(=O)N[C@@H]2CCc3ccccc3C2)nnn1-c1ccc2ncccc2c1,C66755995_decoy,CASP3,Decoy,0,-7.7908,-7.55,-2.63,-6.021968310176628
Cc1cc(F)cc2c1N(C(=O)Cc1csc(N3CCCNC3=O)n1)CCC2,C66786492_decoy,CASP3,Decoy,0,-5.30702,-7.54,-2.26,-5.565664730534647
C[C@@]1(c2ccc(Cl)s2)NC(=O)N(CN2CCOc3ccccc3C2)C1=O,C66792910_decoy,CASP3,Decoy,0,-8.2743,-6.6,-4.7,-6.891577987026726
COc1ccc2c(c1OC)C(=O)O[C@@H]2[C@H]1c2c(cc3c(c2OC)OCO3)CC[NH+]1C,C01621673_decoy,CASP3,Decoy,0,-6.98709,-6.78,-1.51,-5.789149073440507
COc1ccc(-c2cc(C(F)(F)F)n3ncc(C(=O)N4CC[NH+](C)CC4)c3n2)cc1,C04744685_decoy,CASP3,Decoy,0,-7.50663,-6.86,-2.67,-6.937838981862627
O=C(c1ccco1)N1CC[NH+]([C@@H](c2ccc(F)cc2)c2nnnn2C2CCCC2)CC1,C04849914_decoy,CASP3,Decoy,0,-6.59584,-7.93,-2.39,-6.3357702396315805
CC[NH+]1CCN(C(=O)c2cnn3c(C(F)F)cc(-c4ccc(OC)cc4)nc23)CC1,C00815405_decoy,CASP3,Decoy,0,-7.02515,-7.0,-2.87,-6.596628077509261
CC[NH+]1CCN(c2nc3ccc(C)cn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)CC1,C02356655_decoy,CASP3,Decoy,0,-7.11028,-6.78,-2.8,-4.554706218828176
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC[NH+]([C@H]3CCS(=O)(=O)C3)CC2)cc1,C09814764_decoy,CASP3,Decoy,0,-7.9603,-6.63,-1.69,-5.459103558915289
O=C(c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1)N1CCN(c2cccc[nH+]2)CC1,C11817497_decoy,CASP3,Decoy,0,-6.92871,-6.0,-0.77,-4.756150832835088
O=C(c1ccc(F)c(F)c1)N1CC[NH+](Cc2nnnn2-c2ccc(Cl)cc2)CC1,C11824499_decoy,CASP3,Decoy,0,-7.39648,-6.66,-1.62,-6.027300740955821
Cc1ccc(-n2nnnc2C[NH+]2CCN(S(=O)(=O)c3ccccc3Cl)CC2)cc1,C11830740_decoy,CASP3,Decoy,0,-7.01215,-7.92,-1.95,-6.707637187206212
CN(C(=O)C1CC[NH+](C2CCN(c3nc4ccccc4o3)CC2)CC1)[C@H]1CCOC1,C12716066_decoy,CASP3,Decoy,0,-8.25683,-5.97,-1.33,-5.39900575298432
CC[NH+]1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)CC1,C12759420_decoy,CASP3,Decoy,0,-7.55685,-6.4,-2.87,-5.228316457636239
Cc1onc(-c2ccccc2)c1-c1nnc(C[NH+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)o1,C13164534_decoy,CASP3,Decoy,0,-8.14548,-7.28,-1.37,-6.47373509429905
Cc1nn(C)cc1-c1cc(C(F)(F)F)n2nc(C(=O)N3CC[NH+]4CCC[C@H]4C3)cc2n1,C02780209_decoy,CASP3,Decoy,0,-8.03216,-8.05,-2.59,-6.828530901003818
CCC[NH+]1CCN(C(=O)c2cnn(-c3ncc4c(n3)-c3ccc(OC)cc3CC4)c2C)CC1,C12150829_decoy,CASP3,Decoy,0,-8.85436,-7.59,-2.1,-6.788271502765162
Cc1cc[n+](C2=C(c3c(C(C)C)nn(-c4ccc(Cl)cc4)c3O)C(=O)N(C(C)C)C2=O)cc1C,C16571250_decoy,CASP3,Decoy,0,-7.85755,-6.57,-0.76,-5.779596031017261
Cc1cc(C)cc(-c2nn(C[NH+](C)Cc3c(C)nn([C@@H]4CCS(=O)(=O)C4)c3C)c(=S)o2)c1,C16875577_decoy,CASP3,Decoy,0,-8.05265,-6.67,-3.0,-6.382318571488107
COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@H]1c3ccccc3C=C[NH+]1[C@@H]2C(=O)OC,C08914124_decoy,CASP3,Decoy,0,-7.60578,-8.11,-1.26,-6.772351582704316
Cc1cc(-c2cnc(N3CCCC3)nc2C2CC[NH+](Cc3cn(C)nc3C)CC2)on1,C19123269_decoy,CASP3,Decoy,0,-8.84064,-6.27,-1.15,-6.32747860873372
Cc1ccn2cc(C(=O)N3CCN([C@@H](c4ccccc4)c4[nH+]ccn4C)CC3)nc2c1,C19238175_decoy,CASP3,Decoy,0,-6.96106,-7.18,-1.03,-5.768345969640619
Cc1cc(C(=O)N2CCC[C@@H]([NH+]3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)nc(C)n1,C20997553_decoy,CASP3,Decoy,0,-7.86609,-7.15,-3.33,-5.643193833429835
O=C([C@H]1COc2ccccc2O1)N1CC[NH+]([C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1,C22537761_decoy,CASP3,Decoy,0,-7.86783,-7.08,-1.36,-5.427172948882735
Cc1cc(C(=O)C[NH+]2CCN(Cc3ccc4c(c3)CCO4)CC2)c(C)n1[C@H]1CCS(=O)(=O)C1,C22803757_decoy,CASP3,Decoy,0,-9.80444,-8.27,-1.28,-7.318869204149484
Fc1ccc(-n2c(-c3ccncc3)nn(C[NH+]3CCN(Cc4ccccn4)CC3)c2=S)cc1,C22924562_decoy,CASP3,Decoy,0,-8.29472,-6.18,-1.23,-6.457292047886099
Cc1cc(N2CC[NH+](CC(=O)c3cc(C)n([C@H]4CCS(=O)(=O)C4)c3C)CC2)nc(C(C)C)n1,C24337708_decoy,CASP3,Decoy,0,-9.26867,-7.79,-1.88,-6.350499407742797
Cc1cccc(N2C(=O)C[C@H]([NH+]3CCC(n4nnc(-c5cccs5)n4)CC3)C2=O)c1,C25174461_decoy,CASP3,Decoy,0,-9.34976,-5.86,-2.03,-5.591381211832813
C[C@H](c1nc2ccccc2n1C(F)F)[NH+]1CCN(c2ncnc3c2cnn3C)CC1,C25935665_decoy,CASP3,Decoy,0,-7.34724,-6.78,-1.05,-5.703139355277678
Cc1nc2c3c4c(sc3n3c(SCC[NH+](C)C)nnc3n2n1)COC(C)(C)C4,C27826580_decoy,CASP3,Decoy,0,-7.87964,-5.6,-1.35,-7.219434120717786
Cc1c(C(=O)N2CCN(c3ncccn3)CC2)sc2ncnc(N3CC[NH+](C)CC3)c12,C33048234_decoy,CASP3,Decoy,0,-7.08461,-6.66,-0.52,-5.389933551362788
CC1(C)Cc2c(sc3ncnc(N4CC[NH+](CC(=O)N5CCOCC5)CC4)c23)CO1,C34749803_decoy,CASP3,Decoy,0,-7.90324,-6.55,-1.32,-6.230289609629208
CN(C)C(=O)CSc1nc(N2CC[NH+](CC(=O)N3CC3)CC2)c2c3c(sc2n1)CCCC3,C34756545_decoy,CASP3,Decoy,0,-8.11762,-7.34,-0.8,-10.770446849904925
CC[NH+]1CCN(C(=O)c2cnc(N3CCN(c4c(C)cccc4C)CC3)nc2OC)CC1,C35810044_decoy,CASP3,Decoy,0,-6.92231,-6.49,-2.25,-4.451290248698255
CC[n+]1c(-c2ccc([N+](=O)[O-])cc2)csc1Nc1ccc(-c2nnc3n2CCCCC3)cc1,C36034391_decoy,CASP3,Decoy,0,-6.16385,-6.93,-1.57,-6.175942866644403
CC1=C[C@H](C(=O)N2CC[C@@H]3C(=C[C@H](c4ccncc4)C(=O)N3CC[NH+]3CCCCC3)C2)N=N1,C39344757_decoy,CASP3,Decoy,0,-8.20769,-6.01,-1.58,-5.947959512229126
CC1=C[C@@H](C(=O)N2CC[C@H]3C(=C[C@H](c4ccncc4)C(=O)N3CC[NH+]3CCCCC3)C2)N=N1,C39344760_decoy,CASP3,Decoy,0,-8.12538,-5.87,-1.22,-6.254393240851405
COCCn1nnnc1[C@H]([C@H]1C=c2cccc(C)c2=[NH+]C1=O)N1CCc2ccccc21,C39699289_decoy,CASP3,Decoy,0,-8.25632,-7.11,-0.69,-7.260047965832513
C[C@@H]1CN(C(=O)c2ccccc2)CCN1S(=O)(=O)C1=c2ccnc(-c3nccs3)c2=[NH+]C1,C52636767_decoy,CASP3,Decoy,0,-7.69774,-6.54,-1.67,-4.7392335283750855
COc1cc(OC)c(C2=CCN(Cc3cc(=O)n4ccsc4[nH+]3)CC2)c(OC)c1,C57703584_decoy,CASP3,Decoy,0,-7.10849,-6.81,-1.51,-5.605564021364926
COCCN1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2cccc(OC)c2OC)C1=O,C63137068_decoy,CASP3,Decoy,0,-7.31167,-5.66,-4.21,-6.480442373820305
COCCN1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccc(OC)c(OC)c2)C1=O,C63137488_decoy,CASP3,Decoy,0,-7.53505,-6.46,-2.86,-7.007457371704795
O=C1[C@@H]2CC3=c4ccccc4=[NH+][C@H]3[C@@H](c3ccc([N+](=O)[O-])cc3)N2C(=O)CN1C1CC1,C63141765_decoy,CASP3,Decoy,0,-6.38361,-6.72,-1.32,-5.006925533133832
COc1ccccc1[C@H]1[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(CC(OC)OC)CC(=O)N21,C63142304_decoy,CASP3,Decoy,0,-7.56985,-6.61,-2.06,-6.396161189323299
COc1ccc2c(c1)=C1CCN3C(=O)N(c4cccc5c4OCCO5)C(=O)[C@@]3(C)[C@@H]1[NH+]=2,C63339421_decoy,CASP3,Decoy,0,-7.03227,-6.86,-1.73,-5.11766492913963
COc1ccc(OC)c(/C=N/N2CC(=O)N3C[C@H]4[NH+]=c5ccccc5=C4C[C@@H]3C2=O)c1,C63350741_decoy,CASP3,Decoy,0,-7.94877,-6.95,-3.68,-5.792547743146876
COc1ccc2c(c1)=[NH+][C@H](C(=O)N1CCC([C@H](C)C(=O)N3CCC4(CC3)OCCO4)CC1)C=2,C63738742_decoy,CASP3,Decoy,0,-7.10811,-6.23,-1.76,-4.766769758483702
O=C(c1cnc2ccccn2c1=O)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1c1ccccn1,C64066630_decoy,CASP3,Decoy,0,-7.49859,-7.63,-1.75,-5.719318358916287
CC(C)N1C(=O)C[C@@H](N2CCN(C(=O)[C@@H]3C=c4ccccc4=[NH+]3)CC2)N(C(C)C)C1=O,C64541276_decoy,CASP3,Decoy,0,-6.26555,-6.46,-2.61,-4.572871398619564
CC(C)N1C(=O)C[C@@H](N2CCCN(C(=O)[C@@H]3C=c4ccccc4=[NH+]3)CC2)N(C(C)C)C1=O,C64541284_decoy,CASP3,Decoy,0,-6.67957,-7.36,-2.11,-5.837299949827832
C[NH+]1CCC(N2CCN(C(=O)[C@@H]3CCCN(c4cnc5nccnc5c4)C3)CC2)CC1,C65227124_decoy,CASP3,Decoy,0,-8.80884,-6.58,-3.01,-6.630041701626046
CCC[NH+]1CCN(C(=O)[C@H]2CCCN(c3ncccc3-c3noc(CC)n3)C2)CC1,C65227763_decoy,CASP3,Decoy,0,-6.98117,-6.76,-1.52,-6.001760921122387
COc1ccc(-c2nccn3cc(C(=O)N4CCN(C5CC[NH+](C)CC5)CC4)nc23)cc1,C65274447_decoy,CASP3,Decoy,0,-8.69037,-5.8,-0.76,-6.670185130096258
C[NH+](C)Cc1ccccc1-c1ccc2n(c1=O)C[C@H]1C[C@@H]2C[NH+](Cc2cc3ccccc3o2)C1,C04237326_decoy,CASP3,Decoy,0,-8.15955,-8.51,-3.03,-6.925563891114036
C/C=C(\C)C[NH+]1C[C@@H](Sc2ncccn2)C[C@H]1C(=O)N1CC[NH+](C2C3CC4CC(C3)CC2C4)CC1,C11868172_decoy,CASP3,Decoy,0,-8.22456,-6.39,-2.34,-6.158992898818347
Cn1c(SCC[NH+]2CCCCC2)nnc1C1CC[NH+](Cc2cc3ccccc3s2)CC1,C11997115_decoy,CASP3,Decoy,0,-8.78178,-6.97,-2.32,-5.244708880212257
COc1ccc(-c2n[nH]cc2C[NH+]2CCN(c3[nH+]cc(C(F)(F)F)cc3Cl)CC2)cc1,C08622551_decoy,CASP3,Decoy,0,-8.31483,-7.07,-1.79,-6.21315341527537
CC1CC[NH+](Cc2nc(N3CC[NH+](C[C@@H]4CCCO4)CC3)c3c4c(sc3n2)CCC4)CC1,C12553120_decoy,CASP3,Decoy,0,-10.352,-7.73,-2.36,-7.332622690462183
O[C@@H]1C[NH+](C/C(Cl)=C/c2ccccc2)CC[C@H]1N1CCN(c2cccc[nH+]2)CC1,C20419313_decoy,CASP3,Decoy,0,-8.16334,-6.15,-1.25,-5.233381127026204
CC[NH+](CC)Cc1nc(N2CCN(Cc3c(C)[nH+]c4ccc(C)cn34)CC2)c2c(C)c(C)sc2n1,C23989357_decoy,CASP3,Decoy,0,-7.71995,-6.38,-0.87,-4.7483063077652
CC[C@]1(C)Cc2c(c(N3CCOCC3)[nH+]c3sc4c(c23)NC=[NH+][C@H]4N2CCCC2)CO1,C27345087_decoy,CASP3,Decoy,0,-10.276,-6.4,-2.66,-6.611980293117621
O=C(NCC[NH+]1CCCC1)c1ccc(C[NH+]2CCn3cccc3[C@H]2c2ccc(Cl)cc2)o1,C35523283_decoy,CASP3,Decoy,0,-7.80011,-6.04,-2.08,-5.969701400270324
CC(C)CC[NH+]1CCN(c2nc(C[NH+]3CCC(N4CCCCC4)CC3)cc(=O)[nH]2)CC1,C35926885_decoy,CASP3,Decoy,0,-7.49923,-5.93,-2.36,-5.155632005036922
CC[C@H]1C[NH+]2CCc3cc(OC)c(OC)cc3[C@H]2C[C@@H]1C[C@H]1[NH2+]CCc2cc(OC)c(OC)cc21,C03977736_decoy,CASP3,Decoy,0,-8.82969,-6.59,-1.59,-7.448863783935909
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1N1CCCCC1)c1cc(Cl)ccc1Cl,C38966508_decoy,CASP3,Decoy,0,-6.70728,-6.97,-0.77,-5.470966979600579
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@H]1Nc1cccc(Cl)c1)c1ccc(F)cc1,C38979971_decoy,CASP3,Decoy,0,-7.09317,-6.45,-5.08,-5.654045765049507
COc1cc(OC)c(N[C@@H]2[NH+]=c3ccccc3=[NH+]/C2=N\S(=O)(=O)c2cccs2)cc1Cl,C38980717_decoy,CASP3,Decoy,0,-6.7802,-5.91,-3.14,-4.611765714569535
COc1ccc2c(c1)=C[C@@H]([C@H]1[NH+]=C3C=CC=CN3[C@H]1Nc1ccc(C)cc1C)C(=O)[NH+]=2,C38984220_decoy,CASP3,Decoy,0,-7.10288,-7.73,-2.89,-5.352881180663834
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@H]1NC[C@@H]1CCCO1)c1cc(Cl)ccc1Cl,C38984435_decoy,CASP3,Decoy,0,-8.97481,-5.91,-1.72,-7.092295598234412
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1NCc1ccc2c(c1)OCO2)c1cccs1,C38984537_decoy,CASP3,Decoy,0,-8.70979,-7.92,-1.66,-6.969384175302145
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1Nc1ccc(F)c(Cl)c1)c1ccccc1,C39012337_decoy,CASP3,Decoy,0,-7.57395,-8.99,-3.74,-6.775298926347996
COC(=O)c1cccc(N2[C@@H](C)C=C(/C=C(/C#N)[C@@H]3[NH+]=c4ccc(OC)cc4=[NH+]3)[C@@H]2C)c1,C39436070_decoy,CASP3,Decoy,0,-7.91112,-6.02,-2.59,-5.600414306468733
Cc1ccc(C)c2c1=C[C@@H]([C@@H]([C@@H]1NN=NN1C(C)(C)C)[NH+]1CCN(c3ccccc3)CC1)C(=O)[NH+]=2,C39699315_decoy,CASP3,Decoy,0,-6.71869,-7.41,-1.43,-4.885430581680531
Cc1ccc(C)c2c1=C[C@H]([C@@H]([C@@H]1NN=NN1C(C)(C)C)[NH+]1CCN(c3ccccc3)CC1)C(=O)[NH+]=2,C39699316_decoy,CASP3,Decoy,0,-6.1838,-8.12,-1.5,-4.8616786061948485
CCc1ccc2c(c1)=C[C@@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)[NH+]1CCN(c3ccccc3)CC1)C(=O)[NH+]=2,C39710442_decoy,CASP3,Decoy,0,-8.15686,-6.66,-3.14,-6.005142354216384
COCCn1nnnc1[C@H]([C@@H]1C=c2cc(C)cc(C)c2=[NH+]C1=O)[NH+]1CCCC2(CCCCC2)C1,C39711001_decoy,CASP3,Decoy,0,-7.95645,-6.45,-1.78,-5.933922036730817
Cc1ccc2cc3c([nH+]c2c1)N(c1ccc(C(=O)N(C)C2CC[NH+](C)CC2)cc1)CC3,C39881428_decoy,CASP3,Decoy,0,-6.39576,-6.69,-1.75,-4.733674455418874
CC[NH+]1CCN(C(=O)c2ccc(N3CCc4cc5ccc(OC)cc5[nH+]c43)cc2)CC1,C39881665_decoy,CASP3,Decoy,0,-7.54408,-7.31,-0.77,-7.1895852697218725
Cc1ccc(S(=O)(=O)/N=C2\[NH+]=c3ccccc3=[NH+][C@@H]2Nc2ccc3c(c2)COC3=O)cc1,C39928799_decoy,CASP3,Decoy,0,-7.14091,-8.7,-1.36,-6.689283518659388
COc1ccc2c(c1)=[NH+][C@H](/C(C#N)=C/c1ccc(Oc3ccc([N+](=O)[O-])cn3)cc1)[NH+]=2,C39934912_decoy,CASP3,Decoy,0,-5.56353,-6.39,-1.9,-4.569875030866151
C[C@@H]1[C@@H](/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)c2ccccc2N1Cc1ccccc1C#N,C39964551_decoy,CASP3,Decoy,0,-8.2023,-6.56,-5.18,-6.589982584916092
C[C@H](S[C@H]1NN=C(C[NH+]2CCCCC2)N1c1ccc(F)cc1)C(=O)C1=c2ccccc2=[NH+]C1,C44649549_decoy,CASP3,Decoy,0,-7.6041,-6.72,-1.63,-7.376505752339946
CCOC(=O)/[NH+]=c1/ccc2c(C[NH+](C)Cc3ccccc3N3CCCCC3)cc(O)oc-2c1,C45511779_decoy,CASP3,Decoy,0,-6.55591,-7.06,-1.4,-7.714835772159298
CC[NH+](CC)CCN1C(=O)[C@@H](C(C)C)[NH2+]C12CCN(C(=O)c1ccc(Cl)cc1)CC2,C35665751_decoy,CASP3,Decoy,0,-7.75003,-6.17,-3.74,-6.707445371415495
COc1ccc(C(=O)[C@@H]2C[C@@H]2C[NH+]2CC=C(C3=c4nc(OC)ccc4=[NH+]C3)CC2)cc1,C52565476_decoy,CASP3,Decoy,0,-8.02031,-7.34,-0.89,-7.346653507679885
COc1ccc(C(=O)[C@H]2C[C@H]2C[NH+]2CC=C(C3=c4nc(OC)ccc4=[NH+]C3)CC2)cc1,C52565483_decoy,CASP3,Decoy,0,-7.15081,-7.54,-1.78,-6.207113574464141
c1cnc2c(c1)CC[C@@H]1CCCN(Cc3cn4c(N5CC[NH+]6CCC[C@@H]6C5)cccc4[nH+]3)[C@H]21,C49066858_decoy,CASP3,Decoy,0,-8.95212,-6.19,-1.59,-5.495946145332174
Cc1cc(S(=O)(=O)N(C)C)cc(NC(=O)C[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)c1C,C63102870_decoy,CASP3,Decoy,0,-7.99142,-6.03,-2.81,-5.750718090847115
COc1ccccc1[C@@H]1[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(CCC3=c4ccccc4=[NH+]C3)CC(=O)N12,C63140424_decoy,CASP3,Decoy,0,-6.41877,-6.87,-2.76,-5.217506992497189
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1Nc1cccc2ncccc12)c1ccc(Br)cc1,C39984363_decoy,CASP3,Decoy,0,-5.26454,-7.18,-2.16,-4.877656401268984
CC[NH+]1CCC[C@@H]1CNC(=O)[C@H]1[NH+]=c2cc(OC)ccc2=C1Sc1ccc(C)cc1,C63531253_decoy,CASP3,Decoy,0,-7.59522,-6.57,-1.59,-5.270907442539535
C[C@@H]1CCCC[NH+]1CCCNC(=O)CC1CCN(C(=O)[C@@H]2C=c3ccccc3=[NH+]2)CC1,C63737861_decoy,CASP3,Decoy,0,-8.5701,-6.5,-1.25,-6.344041489998397
CCN1C(=O)N(C2Cc3ccccc3C2)C(=O)C12CC[NH+](C[C@H]1C=c3ccccc3=[NH+]1)CC2,C63985638_decoy,CASP3,Decoy,0,-7.90095,-7.04,-2.05,-5.420364885462451
CC(C)CN1C(=O)N(Cc2ccccn2)C(=O)C12CC[NH+](CC1=c3ccccc3=[NH+]C1)CC2,C63985823_decoy,CASP3,Decoy,0,-7.63103,-6.98,-1.62,-6.472149581962926
CC(C)CN1C(=O)N(C2Cc3ccccc3C2)C(=O)C12CC[NH+](CC1=c3ccccc3=[NH+]C1)CC2,C63994107_decoy,CASP3,Decoy,0,-7.98891,-8.71,-4.36,-6.757312696193608
CCN1C(=O)C[C@](CC(=O)N2CCC([C@H]3[NH+]=c4ccc(F)cc4=[NH+]3)CC2)(c2ccccc2C)C1=O,C64002158_decoy,CASP3,Decoy,0,-7.61704,-9.48,-1.7,-6.8069321017844695
c1ccc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3CC[NH+]2Cc2ccc(Oc3ncccn3)cc2)nc1,C64031718_decoy,CASP3,Decoy,0,-7.36404,-7.38,-0.85,-6.500538706027304
CC(C)n1cc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C[C@@H]2C=c3ccccc3=[NH+]C2=O)cn1,C64103304_decoy,CASP3,Decoy,0,-8.13147,-7.09,-1.75,-5.614402113043254
Fc1ccccc1Cn1cc(/C=N/NC2=N[C@H]3[NH+]=c4ccccc4=C3N=[NH+]2)c2ccccc21,C39029709_decoy,CASP3,Decoy,0,-7.40032,-8.52,-1.31,-6.06770129961446
C[C@H](C(=O)NCC[C@@H](C)[NH+]1CCCC1)C1CCN(C(=O)[C@@H]2C=c3cc(Cl)ccc3=[NH+]2)CC1,C64541247_decoy,CASP3,Decoy,0,-8.33131,-7.25,-1.45,-9.8023285633134
O=C(C[NH+]1CC=C(c2cnn(-c3ccc(F)cc3)c2)CC1)N1CC[NH+](C2CCCCC2)CC1,C35404568_decoy,CASP3,Decoy,0,-8.079,-7.17,-1.46,-6.01527575355667
COc1ccc(Cc2noc(C[NH+]3CCC4=c5ccccc5=[NH+][C@H]4[C@@H]3C(C)C)n2)cc1OC,C64651253_decoy,CASP3,Decoy,0,-7.2884,-6.54,-1.29,-4.969054956055834
C[C@@H]1[C@H]2[NH+]=c3ccccc3=C2[C@H](c2ccccc2Cl)C[NH+]1CC(=O)N[C@@H]1CCS(=O)(=O)C1,C64701889_decoy,CASP3,Decoy,0,-7.72609,-7.35,-1.39,-6.857751148582415
COc1ccc(C[NH+]2COc3c(cc4c5c(c(=O)oc4c3C)CCCC5)C2)cc1OC,C02113477_decoy,CASP3,Decoy,0,-8.67247,-7.06,-2.13,-5.98329718562842
COc1c2c(cc3c1[C@@H](CC(=O)c1ccc(-c4ccc(F)cc4)o1)[NH+](C)CC3)OCO2,C02102705_decoy,CASP3,Decoy,0,-6.98826,-7.36,-0.81,-7.52233975647839
Cc1ccc(C)c(N2CC[NH+]([C@@H](c3ccccc3Cl)c3nnnn3C(C)C)CC2)c1,C04855873_decoy,CASP3,Decoy,0,-6.59972,-7.58,-1.44,-7.046364357569958
Cc1cc(C)c(C)c(S(=O)(=O)N2CC[NH+]([C@H](C)C(=O)N3CCCCC3)CC2)c1C,C09607215_decoy,CASP3,Decoy,0,-6.77507,-6.84,-5.02,-5.408361943347654
Cc1cc(C)c2sc(N(CCC[NH+](C)C)C(=O)c3cc4ccccc4oc3=O)nc2c1,C10068574_decoy,CASP3,Decoy,0,-7.81312,-7.33,-1.56,-5.275549695168294
CCN1C[C@@H](C[NH+](C)CC(=O)N2CCN(c3cccc(C)c3)CC2)Oc2ccccc21,C10056821_decoy,CASP3,Decoy,0,-7.35729,-6.46,-2.89,-5.166313836260556
C[NH+](C)CCCN(C(=O)c1ccc2c(c1)OCCO2)c1nc2c(Cl)cccc2s1,C12140999_decoy,CASP3,Decoy,0,-8.35393,-5.29,-1.88,-5.523377870372637
Cc1ccc(-n2cc(C[NH+]3CCC[C@H](c4nncn4C)C3)c(-c3ccc(F)cc3)n2)cc1,C12443793_decoy,CASP3,Decoy,0,-8.56377,-6.99,-1.09,-6.682558555925372
CCn1c([C@@H]2C[C@H]3CN(Cc4ccccc4OC)C(=O)[C@]34CCC[NH+]24)nc2ccccc21,C12302679_decoy,CASP3,Decoy,0,-7.50577,-6.46,-2.39,-5.716818376013178
CCn1c(N2CCOCC2)nn(C[NH+]2CCc3sccc3[C@H]2c2ccccc2)c1=S,C14201259_decoy,CASP3,Decoy,0,-7.21798,-6.02,-1.72,-5.623372438168008
Cc1ccc(-c2cc(C(F)(F)F)n3ncc(C(=O)N4CC[NH+]5CCC[C@@H]5C4)c3n2)cc1,C02753479_decoy,CASP3,Decoy,0,-6.88722,-6.58,-1.82,-6.484795889667678
O=C(/C=N/c1c2ccccc2nc2ccccc12)C[NH+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C08781435_decoy,CASP3,Decoy,0,-7.06994,-8.63,-2.38,-6.463978054684751
Fc1ccccc1C[NH+]1CCCN(c2ncnc3onc(-c4ccc(Cl)cc4)c23)C1,C20575086_decoy,CASP3,Decoy,0,-7.23439,-6.55,-0.38,-5.9039633207780975
CC1CCN(c2nnc(-n3cccc3CN3CC[NH+](C4CCCCC4)CC3)s2)CC1,C20576378_decoy,CASP3,Decoy,0,-8.2532,-6.04,-1.93,-5.9006764185878975
C[C@@H]1c2cccn2CC[NH+]1CC(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2,C21579485_decoy,CASP3,Decoy,0,-7.73425,-5.9,-1.76,-6.083246026933988
Cc1cccc(-c2nnc([C@H](C)[NH+]3CCN(Cc4nc5ccccc5s4)CC3)o2)c1,C22780459_decoy,CASP3,Decoy,0,-7.68261,-5.87,-2.59,-4.850311394603649
C[NH+](Cc1cn(-c2ccccc2)nc1-c1ccccc1)Cn1nc2ccccn2c1=S,C23245542_decoy,CASP3,Decoy,0,-6.22018,-7.4,-3.31,-5.637036479873983
O=C(c1nc2ccccn2c1CN1CCSCC1)N1CC[NH+](C2CCCCC2)CC1,C23338103_decoy,CASP3,Decoy,0,-8.51153,-6.25,-1.86,-5.942164989518842
Fc1ccc(-n2c(C[NH+]3CCCCC3)nnc2SCc2nnsc2Cl)cc1,C25748413_decoy,CASP3,Decoy,0,-8.78374,-7.58,-1.0,-7.746329125078817
Cc1cc(N2CCN(c3cccc(C)[nH+]3)CC2)n2nc(C)c(-c3ccccc3Cl)c2n1,C27585483_decoy,CASP3,Decoy,0,-8.32174,-8.52,-4.43,-9.01551989555372
Cc1ccc2nc(CSc3nnc([C@@H](C)[NH+](C)C)n3-c3ccc(Cl)cc3)cn2c1,C28987873_decoy,CASP3,Decoy,0,-8.32317,-5.37,-0.89,-6.553362970851836
C[C@H]1CCc2c(sc3ncnc(N4CC[NH+](CC(=O)N5CCCC[C@@H]5C)CC4)c23)C1,C29529792_decoy,CASP3,Decoy,0,-9.1374,-7.15,-1.85,-7.4050405552948755
CCCC[NH+]1CCN(c2nc3sc4c(c3c(=O)n2CCC)CC(C)(C)OC4)CC1,C34734733_decoy,CASP3,Decoy,0,-7.45791,-4.65,-5.72,-4.244523198314995
CCSc1nc(N2CC[NH+](CC(=O)N(C)C)CC2)c2c3c(sc2n1)CCCC3,C34755919_decoy,CASP3,Decoy,0,-9.94181,-4.72,-0.53,-6.471055205488865
C=C(C)CSc1nc(N2CC[NH+](CC(=O)N3CC3)CC2)c2c3c(sc2n1)CCC3,C34757229_decoy,CASP3,Decoy,0,-9.00837,-6.06,-0.93,-7.297896178528398
Cc1cccc(C(=O)N2CCc3[nH+]c(N4CCC(C)CC4)nc(N(C)C(C)C)c3C2)c1,C35836482_decoy,CASP3,Decoy,0,-7.73564,-5.56,-1.1,-6.830898102867003
Fc1ccc([C@@H](c2nnnn2Cc2cccs2)N2CC[NH+](C3CCCC3)CC2)cc1,C19343833_decoy,CASP3,Decoy,0,-9.19947,-7.1,-1.98,-7.526460931221154
Cn1cc[nH+]c1[C@H]1CCCCN1C(=O)CN1Cc2ccccc2O[C@H](c2ccccc2F)C1,C32592994_decoy,CASP3,Decoy,0,-7.4625,-7.58,-3.48,-6.025555967033895
C[NH+](C)CCN(C(=O)/C=C/c1ccc2c(c1)OCO2)c1nc2c(F)cc(F)cc2s1,C36640801_decoy,CASP3,Decoy,0,-7.81696,-7.6,-2.37,-7.272475526017742
Cc1ccc2sc(N(CC[NH+](C)C)C(=O)c3cnn(-c4ccccc4)c3C)nc2c1C,C36642990_decoy,CASP3,Decoy,0,-7.67906,-6.58,-3.5,-5.7796961704074725
C[C@H]1Oc2ccccc2O[C@H]1C(=O)N(CCC[NH+](C)C)c1nc2c(F)cccc2s1,C36645294_decoy,CASP3,Decoy,0,-8.05264,-5.9,-1.59,-5.624163953118307
COc1ccc2c(c1)=C[C@@H](CN(c1ccccc1C)S(=O)(=O)c1ccccc1)C(=O)[NH+]=2,C38984701_decoy,CASP3,Decoy,0,-5.39898,-7.38,-2.29,-5.495247241496855
Cc1cc2c(cc1C)=[NH+]C(=O)[C@H](CN(Cc1ccco1)S(=O)(=O)c1ccccc1)C=2,C39325119_decoy,CASP3,Decoy,0,-8.05897,-6.75,-2.93,-7.045352507025848
O=C(c1ccc(OC2CC[NH+](C[C@H]3C=NN=C3C3CCCCC3)CC2)cc1)N1CCCC1,C39499939_decoy,CASP3,Decoy,0,-7.2933,-6.54,-2.32,-4.818330393421087
CCC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1[C@H]1C=c2c(C)ccc(C)c2=[NH+]C1=O,C40010396_decoy,CASP3,Decoy,0,-7.64866,-7.04,-4.11,-6.463026503295663
COc1cc2c(cc1OC)[C@@H]([C@@H]1C=c3ccc(C)cc3=[NH+]C1=O)N(C(=O)C(C)C)CC2,C40010452_decoy,CASP3,Decoy,0,-7.208,-7.7,-5.39,-5.50917405550295
COc1ccc(-c2nc(C[NH+]3CCN(c4cccc(C)c4)[C@@H](C)C3)c(C)o2)cc1OC,C40962172_decoy,CASP3,Decoy,0,-7.60223,-6.7,-3.7,-5.5630569288991065
Cc1cc(C)c([C@@H]2C[C@@H]3CN(Cc4ccc(C)o4)C(=O)[C@@]34CCC[NH+]24)c(-n2cccn2)c1,C43630451_decoy,CASP3,Decoy,0,-6.59424,-7.56,-2.78,-5.579883362080662
COc1ccccc1CN1C[C@H]2C[C@@H](c3ccc(-n4cccn4)cc3)[NH+]3CCC[C@]23C1=O,C43631610_decoy,CASP3,Decoy,0,-7.9486,-6.35,-1.9,-5.7034429346831965
COc1ccc(-c2nn(-c3ccccc3)cc2C[NH+]2CCC[C@H](C3OCCO3)C2)cc1,C60363266_decoy,CASP3,Decoy,0,-7.38405,-6.13,-2.56,-6.313031109343244
COc1ccc(-c2nc(CC(=O)N3CC[C@@H]4[NH+]=c5ccc(OC)cc5=C4C3)cs2)cc1,C63294587_decoy,CASP3,Decoy,0,-7.65982,-7.45,-0.93,-6.215699730082702
O=C(c1ccccc1Cl)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1,C63569242_decoy,CASP3,Decoy,0,-5.66771,-5.75,-0.51,-5.039493171734442
O=C(c1ccccc1Cl)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@H]1c1ccc([N+](=O)[O-])cc1,C63569244_decoy,CASP3,Decoy,0,-6.65293,-6.36,-2.6,-6.04839183444084
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3c1ccc3c(c1)OCO3)C2/N=C/C1=C[C@H]2N=CC=C2C=C1,C63781572_decoy,CASP3,Decoy,0,-8.22052,-6.55,-1.67,-6.494844758997702
C[C@]12CN3C[C@](C)(C[NH+](C1)[C@H]3c1ccc3c(c1)OCO3)C2/N=C/C1=CC=C[C@H]2N=CC=C12,C63785047_decoy,CASP3,Decoy,0,-8.18474,-8.09,-1.29,-6.065619854229028
COc1ccc([C@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCc2cnn(C)c2)cc1C,C64040361_decoy,CASP3,Decoy,0,-7.4293,-7.04,-1.7,-5.556994505456231
COc1cccc([C@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCc2ccco2)c1OC,C64045317_decoy,CASP3,Decoy,0,-8.06333,-7.54,-1.92,-10.221881048963114
COc1cccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCc2ccco2)c1OC,C64045319_decoy,CASP3,Decoy,0,-7.78231,-5.72,-1.86,-5.939337526705063
COc1cccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)Cc2cscn2)c1OC,C64074207_decoy,CASP3,Decoy,0,-9.48007,-7.04,-3.03,-8.560768939066076
Cc1ccc(-c2ncc(C(=O)N3CCC([NH+]4CCCCC4)CC3)c(-c3ccncc3)n2)cc1,C65153805_decoy,CASP3,Decoy,0,-6.83602,-6.49,-1.38,-4.892310057954088
COCCn1nnnc1[C@@H](c1ccccc1)[NH+]1CCN(c2cc(Cl)ccc2C)CC1,C04855557_decoy,CASP3,Decoy,0,-7.41446,-6.17,-4.39,-7.118634015457595
Fc1ccccc1N1CC[NH+]([C@@H](c2ccncc2)c2nnnn2C2CCCCC2)CC1,C04926042_decoy,CASP3,Decoy,0,-6.81822,-7.06,-1.36,-6.417073067615623
Fc1ccccc1N1CC[NH+]([C@H](c2ccncc2)c2nnnn2C2CCCCC2)CC1,C04926052_decoy,CASP3,Decoy,0,-8.35432,-6.35,-1.76,-5.990876966159841
O=C(C1CCN(c2nnc(-n3cccc3)s2)CC1)N1CCC([NH+]2CCCCC2)CC1,C05144243_decoy,CASP3,Decoy,0,-7.35305,-5.37,-1.01,-2.7537241812745554
O=C(c1cccn1-c1nnc(N2CCCCC2)s1)N1CCC([NH+]2CCCCC2)CC1,C07006108_decoy,CASP3,Decoy,0,-7.87443,-7.25,-4.15,-7.318399902372466
CCOC(=O)CCc1c(C)c2cc3c(c(C)c2oc1=O)OC[NH+](Cc1cccnc1)C3,C09061261_decoy,CASP3,Decoy,0,-7.06713,-8.42,-2.81,-5.943366887749416
COc1ccc(-c2nn(-c3ccccc3)cc2/C=C/C(=O)N2CC[NH+](C)CC2)cc1OC,C09439965_decoy,CASP3,Decoy,0,-7.46519,-7.61,-0.68,-5.958867986309429
C[NH+](C)CCN(C(=O)c1nc2ccccc2s1)c1nc2cc3c(cc2s1)OCO3,C10065946_decoy,CASP3,Decoy,0,-8.29168,-5.82,-1.27,-5.9191964113022495
O=c1cc(CSc2nnc(C[NH+]3CCCC3)n2-c2ccccc2)nc2sccn12,C09872386_decoy,CASP3,Decoy,0,-10.4667,-6.87,-2.1,-7.49460510940033
COc1cc(OC)c(C2=CC[NH+]([C@@H](C)c3nnc(-c4cccs4)o3)CC2)c(OC)c1,C11063544_decoy,CASP3,Decoy,0,-9.7886,-6.0,-1.6,-6.763259022915124
C[C@@H]1C[NH+](Cc2ccc3c(c2)CN(C(=O)c2ccc4c(c2)OCO4)CCO3)C[C@H](C)O1,C12471229_decoy,CASP3,Decoy,0,-7.12091,-6.78,-1.43,-7.096952712116765
Cc1ccc(C2(c3noc(C[NH+]4CCC[C@@H](C(=O)c5nccn5C)C4)n3)CCCC2)cc1,C12305533_decoy,CASP3,Decoy,0,-8.9469,-7.95,-1.46,-7.5451492124193775
COc1ccccc1N1CC[NH+]([C@@H]2CCc3c(c(C(=O)N4CCCC4)nn3C)C2)CC1,C14532900_decoy,CASP3,Decoy,0,-8.15096,-6.49,-3.16,-7.336395209818433
Fc1ccc([C@@H](c2nnnn2C[C@H]2CCCO2)N2CC[NH+](C3CCCCC3)CC2)cc1,C19332676_decoy,CASP3,Decoy,0,-8.11105,-8.26,-4.92,-6.9720896848644704
COc1cccc(-c2nc(C[NH+](C)[C@@H](C)c3ccc4c(c3)OCCO4)c(C)o2)c1OC,C19839172_decoy,CASP3,Decoy,0,-8.14337,-7.53,-1.31,-6.594595302976448
CN(C)c1nc2cc3c(cc2cc1CN(CC[NH+](C)C)C(=O)C1CCCCC1)OCO3,C20782256_decoy,CASP3,Decoy,0,-8.09415,-6.98,-4.12,-7.135845908524895
Cc1ccc(S(=O)(=O)N2CC[NH+](CCn3nc(-c4ccc(Cl)cc4)ccc3=O)CC2)s1,C23245026_decoy,CASP3,Decoy,0,-9.61474,-8.7,-1.81,-7.815268170401105
CS(=O)(=O)c1ccc(-c2noc(C3CC[NH+](Cc4cccc(C#N)c4)CC3)n2)cc1,C24878672_decoy,CASP3,Decoy,0,-8.95979,-6.46,-1.59,-8.52640692078772
COc1ccc(-c2nc(CN3CC[NH+](Cn4ncn(C5CC5)c4=S)CC3)cs2)cc1,C25150539_decoy,CASP3,Decoy,0,-7.50058,-6.32,-1.39,-5.745356908038749
CCOC(=O)[C@H](c1ccc(Cl)cc1)[NH+]1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,C32850841_decoy,CASP3,Decoy,0,-7.49585,-7.13,-0.68,-5.944152693490351
Cc1noc(C[NH+]2CCN(c3nc(-c4cccs4)nc4sc(C)c(C)c34)CC2)n1,C32911813_decoy,CASP3,Decoy,0,-9.39767,-6.47,-1.12,-8.648057376199185
C=C(C)C[NH+]1CCN(c2nc3sc(C)c(C)c3c(=O)n2CC(=O)N(CC)CC)CC1,C34748356_decoy,CASP3,Decoy,0,-8.92318,-5.12,-1.91,-7.674059521733882
C[NH+]1CCN(c2nc3c(c(Oc4ccccc4F)n2)CN(C(=O)c2ccc(F)cc2)CC3)CC1,C34758003_decoy,CASP3,Decoy,0,-7.20258,-7.64,-2.65,-5.336056045726915
CC(=O)N1CCN(C(=O)c2coc(C[NH+](Cc3ccc(C(C)C)cc3)C3CC3)n2)CC1,C36082741_decoy,CASP3,Decoy,0,-7.07974,-7.5,-2.24,-5.857042984101321
CC1CCN(c2nc(N3CC[NH+](C)CC3)nc3c2CN(C(=O)c2ccccc2Cl)CC3)CC1,C34676715_decoy,CASP3,Decoy,0,-8.36813,-5.98,-2.5,-6.337359769152546
C[NH+]1CCN(c2nc(N3CCCCC3)nc3c2CN(C(=O)c2cccs2)CC3)CC1,C34677003_decoy,CASP3,Decoy,0,-8.49957,-6.51,-2.71,-6.124730805120128
C[NH+](C)CCN(C(=O)Cn1c(=O)oc2ccccc21)c1nc2c(F)cc(F)cc2s1,C36642630_decoy,CASP3,Decoy,0,-8.23314,-7.34,-1.09,-6.58312567295999
Fc1ccc(-n2c(C[NH+]3CCCCC3)nnc2SCc2noc(-c3ccsc3)n2)cc1,C39554117_decoy,CASP3,Decoy,0,-9.91418,-7.09,-1.11,-7.166070421692504
COc1ccc2c3c1O[C@@H]1C[C@@H](OC(=O)[C@]45CC[C@](C)(C(=O)O4)C5(C)C)C=C[C@]31CC[NH+](C)C2,C35644408_decoy,CASP3,Decoy,0,-8.60425,-7.75,-1.64,-7.517500242218087
O=C(CSC1=N[C@@H]2[NH+]=c3ccc(F)cc3=C2N=N1)N1CCN(c2ccccc2)CC1,C39981249_decoy,CASP3,Decoy,0,-7.56682,-7.67,-3.09,-5.826950006447299
COc1cc2c(cc1OC)[C@H]([C@@H]1C=c3c(C)ccc(C)c3=[NH+]C1=O)N(C(=O)c1ccco1)CC2,C40010230_decoy,CASP3,Decoy,0,-8.12406,-7.06,-2.95,-7.486599557355787
CCC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1[C@@H]1C=c2cc(OC)ccc2=[NH+]C1=O,C40010416_decoy,CASP3,Decoy,0,-7.94267,-7.35,-1.5,-6.334734341474805
COc1ccc2c(c1)=[NH+]C(=O)[C@@H]([C@@H]1c3cc(OC)c(OC)cc3CCN1C(=O)C1CC1)C=2,C40010622_decoy,CASP3,Decoy,0,-7.98596,-5.9,-3.15,-6.247932841742103
COCC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1[C@H]1C=c2cccc(C)c2=[NH+]C1=O,C40010719_decoy,CASP3,Decoy,0,-6.67092,-6.48,-2.14,-5.730290665065697
COc1cc2c(cc1OC)[C@@H]([C@@H]1C=c3cc(C)cc(C)c3=[NH+]C1=O)N(S(C)(=O)=O)CC2,C40010793_decoy,CASP3,Decoy,0,-7.63433,-6.24,-3.29,-5.226430600341541
CCOc1ccc(-c2nc(C[NH+]3CCC(C(=O)N4CCN(C)CC4)CC3)c(C)o2)cc1,C40983756_decoy,CASP3,Decoy,0,-8.10984,-7.33,-2.2,-6.140971353958483
Cc1nc(N2CCN(Cc3cc(=O)n4ccsc4[nH+]3)CC2)c2c3c(sc2n1)CCC3,C15143824_decoy,CASP3,Decoy,0,-7.77704,-6.17,-1.29,-4.374030718923888
C[NH+]1CCN(c2nnc(-n3cccc3CN3CCN(c4ccccc4)CC3)s2)CC1,C15728187_decoy,CASP3,Decoy,0,-8.92838,-5.9,-4.73,-6.278620403199852
COc1ccc(CCN(C[C@@H]2C=c3cccc(C)c3=[NH+]C2=O)C(=O)N(C)C)cc1OC,C39300488_decoy,CASP3,Decoy,0,-7.56931,-7.21,-2.46,-7.120050784461173
COc1ccc(CCN2CC(=O)N3[C@@H](CC4=c5ccccc5=[NH+][C@H]4C3(C)C)C2=O)cc1OC,C63138805_decoy,CASP3,Decoy,0,-8.03776,-6.95,-1.89,-8.6056042960042
COc1cc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(C4CCCC4)CC(=O)N23)ccc1OC(C)C,C63140486_decoy,CASP3,Decoy,0,-7.96163,-5.79,-2.02,-4.573179818243792
COc1cc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(C(C)C)CC(=O)N23)ccc1OC(C)C,C63140888_decoy,CASP3,Decoy,0,-7.44241,-6.61,-3.77,-7.608399298686891
CCOCCCN1CC(=O)N2[C@H](c3ccccc3OC)[C@@H]3[NH+]=c4ccccc4=C3C[C@H]2C1=O,C63142240_decoy,CASP3,Decoy,0,-7.75201,-5.69,-1.46,-7.156886124420652
C[C@@H]1CCC2=C3C(=O)N=C(COC(=O)C4=c5ccccc5=[NH+]C(=O)C4)N=C3S[C@@H]2C1,C39948632_decoy,CASP3,Decoy,0,-7.13986,-7.53,-1.26,-6.005248373907984
O=C(COC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C1=c2ccccc2=[NH+]C1,C64012245_decoy,CASP3,Decoy,0,-8.93143,-7.35,-0.97,-6.113524717898808
COc1cccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCc2cnn(C)c2)c1OC,C64053265_decoy,CASP3,Decoy,0,-7.26243,-7.39,-1.88,-7.324742253076987
COc1ccc([C@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCn2cncn2)c(C)c1C,C64157807_decoy,CASP3,Decoy,0,-7.94253,-7.67,-2.03,-7.782190381573254
O=C1[C@H]2CC3=c4ccccc4=[NH+][C@@H]3CN2C(=O)CN1/N=C/c1cccc(Oc2ccccc2)c1,C64277678_decoy,CASP3,Decoy,0,-7.33021,-7.92,-4.66,-5.841660220187661
O=C([C@H]1C=c2ccccc2=[NH+]1)N1CCN(c2ccc(-c3noc(C4CCC4)n3)cc2)CC1,C64491513_decoy,CASP3,Decoy,0,-7.75712,-9.04,-2.62,-6.303282731339722
O=C(c1csc(-c2ccc(N3CCCCC3)nc2)n1)N1CCN(c2cccc[nH+]2)CC1,C65165370_decoy,CASP3,Decoy,0,-7.72568,-6.37,-1.5,-5.232722167074965
CCn1c(-c2ccncc2)nn(C[NH+]2CCN(c3ccc(C(C)=O)cc3)CC2)c1=S,C07315766_decoy,CASP3,Decoy,0,-7.83644,-6.85,-2.2,-6.8900537811918525
Fc1ccc(N2CC[NH+]([C@@H](c3ccccc3)c3nnnn3C[C@H]3CCCO3)CC2)cc1,C04856211_decoy,CASP3,Decoy,0,-7.73836,-6.7,-2.7,-5.804813696648214
CCCN1C(=O)/C(=C/c2c(N3CC[NH+](CC)CC3)nc3c(C)cccn3c2=O)SC1=S,C01282688_decoy,CASP3,Decoy,0,-7.54978,-7.38,-1.13,-5.541825203205463
CCCCCCN1C(=O)/C(=C/c2c(N3CC[NH+](C)CC3)nc3ccccn3c2=O)SC1=S,C02338173_decoy,CASP3,Decoy,0,-7.25987,-7.43,-1.96,-5.4464093493385
Cc1cc(-n2c(C)cc(/C=C/C(=O)N3CCN(c4ccc(C(F)(F)F)c[nH+]4)CC3)c2C)no1,C09253336_decoy,CASP3,Decoy,0,-7.96151,-7.0,-1.64,-5.52440522796172
O=C(CSc1nnnn1C1CCCC1)N1CC[NH+](Cc2ccc(Cl)s2)CC1,C09514690_decoy,CASP3,Decoy,0,-8.4657,-7.14,-0.7,-7.849903391306233
COc1cc2c(cc1OC)[C@@H](c1cccs1)[NH+](Cc1nnnn1-c1ccccc1)CC2,C09586242_decoy,CASP3,Decoy,0,-7.83123,-6.67,-2.68,-6.375307161315604
Cc1ccccc1S(=O)(=O)Cc1ccc(C(=O)N2CCN(c3cccc[nH+]3)CC2)o1,C09731562_decoy,CASP3,Decoy,0,-6.88235,-6.43,-1.27,-4.9833287737613166
O=C(c1ccc[nH+]c1N1CCCC1)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1,C09883917_decoy,CASP3,Decoy,0,-7.41054,-6.4,-0.73,-6.144226529068361
O=C(CSc1nnc(C[NH+]2CCCCC2)n1-c1ccc(F)cc1)c1ccc2c(c1)OCCO2,C09881084_decoy,CASP3,Decoy,0,-8.09723,-6.72,-1.4,-5.935710124409445
Cc1sc2nc(C[NH+]3CCC(C)CC3)nc(Sc3nc4ncccn4n3)c2c1C,C11004500_decoy,CASP3,Decoy,0,-8.71558,-6.44,-3.0,-7.416993704940723
C[C@H](c1ccncn1)[NH+](C)Cc1cn(Cc2ccccc2)nc1-c1ccc2c(c1)OCO2,C11818680_decoy,CASP3,Decoy,0,-7.66797,-5.85,-2.72,-5.803076321934349
O=C(c1cc(-c2cccs2)cc(-n2cnnn2)c1)N1CC[NH+]([C@H]2CCc3ccccc3C2)CC1,C11868145_decoy,CASP3,Decoy,0,-8.47686,-6.9,-4.11,-6.912213970731078
C[NH+]1CC[C@@]2(CCN(C(=O)c3cnn(-c4ncc5c(n4)-c4ccccc4CC5)c3C3CC3)C2)C1,C12457265_decoy,CASP3,Decoy,0,-8.40857,-5.98,-2.73,-5.5560245026767525
Cc1noc(C)c1CO[C@H]1CN(CC(C)C)C(=O)C[NH+](Cc2ccc3c(c2)CCO3)C1,C14752123_decoy,CASP3,Decoy,0,-8.44277,-7.64,-3.81,-7.671404258883079
Cn1cc(C[NH+](C)Cc2ccc(OC3CCN(C(=O)[C@H]4CCOC(C)(C)C4)CC3)cc2)cn1,C15072030_decoy,CASP3,Decoy,0,-7.91566,-7.84,-1.98,-6.029114548039669
Fc1ccccc1N1CC[NH+]([C@H](c2ccccn2)c2nnnn2C2CCCCC2)CC1,C01336090_decoy,CASP3,Decoy,0,-7.57222,-6.19,-2.67,-5.8362800428003
C=CCn1nc(C(=O)N2CC[NH+](C)CC2)c2c1CC[C@@H](N1CCOc3ccc(Cl)cc3C1)C2,C14741486_decoy,CASP3,Decoy,0,-8.73615,-5.58,-2.1,-6.898466417968415
COc1cccc(-c2nc(C[NH+](C)[C@H](C)c3ccc4c(c3)OCCO4)c(C)o2)c1OC,C19839174_decoy,CASP3,Decoy,0,-7.22236,-5.95,-3.23,-5.831984551485096
CN1CCC([NH+]2CCC(CN(Cc3ccncc3)C(=O)c3cn4ccccc4n3)CC2)CC1,C20454516_decoy,CASP3,Decoy,0,-7.55723,-6.04,-1.38,-6.256401142602791
COC(=O)C[C@@H]1CCN(C(=O)C2CCC2)C[C@@H]1CC[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,C20462787_decoy,CASP3,Decoy,0,-8.00435,-6.9,-4.3,-7.56885760608883
N#Cc1ccnc(N2CC[NH+](Cn3nc(-c4cccs4)n(C4CC4)c3=S)CC2)c1,C22962748_decoy,CASP3,Decoy,0,-8.66372,-8.43,-1.05,-6.06200441415045
O=S(=O)(c1ccc(Cl)s1)N1CC[NH+](Cc2nnc(-c3ccc(Cl)cc3)o2)CC1,C23827392_decoy,CASP3,Decoy,0,-9.5918,-6.41,-0.4,-6.0535294811836415
CCOC(=O)[C@H](c1ccc(Cl)cc1)[NH+]1CCN(C(=O)c2cc3ccccc3oc2=O)CC1,C24715766_decoy,CASP3,Decoy,0,-7.55846,-8.37,-6.0,-6.509946843390379
C[C@@H](c1ccc(-n2cncn2)cc1)[NH+](C)CC(=O)N1CCN(c2ccccc2F)CC1,C28724799_decoy,CASP3,Decoy,0,-6.73869,-6.99,-0.94,-6.168284320003171
Cc1c(C(=O)N2CCN(c3cccc(Cl)c3)CC2)sc2ncnc(N3CC[NH+](C)CC3)c12,C33048203_decoy,CASP3,Decoy,0,-8.15289,-6.54,-1.4,-5.788472305387206
C=C(C)C[NH+]1CCN(c2nc3sc4c(c3c(=O)n2CC(=O)N(CC)CC)CCCC4)CC1,C34747192_decoy,CASP3,Decoy,0,-9.14478,-6.03,-2.56,-7.57868724246629
COCCn1c(-c2nc(C(=O)N3CCN(c4cccc[nH+]4)CC3)cs2)cc2ccccc21,C38911266_decoy,CASP3,Decoy,0,-7.36875,-7.07,-1.4,-5.7729474542954735
O=C1[NH+]=c2cc3c(cc2=C[C@@H]1CN(Cc1cccs1)S(=O)(=O)c1ccc(F)cc1)OCCO3,C39325301_decoy,CASP3,Decoy,0,-9.0859,-7.19,-1.42,-8.004657699866085
CCOC(=O)C1=C(C)[C@@H]2C(=O)N(CC(=O)C3=c4cccc(CC)c4=[NH+]C3)C=N[C@H]2S1,C39415540_decoy,CASP3,Decoy,0,-8.2198,-7.43,-1.47,-5.6534388191585325
Cc1ccc(C2(c3noc(C[NH+]4CCN([C@H]5CCS(=O)(=O)C5)CC4)n3)CCCC2)cc1,C23373683_decoy,CASP3,Decoy,0,-9.07307,-7.29,-1.84,-6.439545678262115
CCC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1[C@H]1C=c2cc(OC)ccc2=[NH+]C1=O,C40010419_decoy,CASP3,Decoy,0,-7.28101,-5.91,-1.19,-5.709479546916692
COc1cc2c(cc1OC)[C@@H]([C@@H]1C=c3cccc(C)c3=[NH+]C1=O)N(S(C)(=O)=O)CC2,C40010758_decoy,CASP3,Decoy,0,-8.29922,-6.56,-1.3,-6.742074871627996
O=C(c1nn([C@H]2CCS(=O)(=O)C2)c2c1CCCC2)N1CCC(CC[NH+]2CCCCCC2)CC1,C40988944_decoy,CASP3,Decoy,0,-9.4842,-7.17,-1.47,-6.567711019377596
O=C(C[NH+](Cc1ccc2c(c1)OCO2)C1CCCC1)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1,C27574653_decoy,CASP3,Decoy,0,-10.1092,-8.93,-2.23,-13.975256534627816
COc1ccc([C@@H]2C(C#N)=C(/[NH+]=C/N3CCN(C)CC3)OC3=C2C(=O)CC(C)(C)C3)cc1,C13115614_decoy,CASP3,Decoy,0,-8.37185,-6.37,-2.35,-6.498885544941972
CCOC(=O)[C@@H]1CCC[NH+](Cc2nnn(-c3ccc(F)c(C)c3)c2-c2ccncc2)C1,C57345535_decoy,CASP3,Decoy,0,-8.25519,-6.69,-1.78,-6.465907392468399
O=C(c1ccc2c(c1)OCCO2)C1CC[NH+](Cn2nc(-c3ccccc3)oc2=S)CC1,C14317010_decoy,CASP3,Decoy,0,-8.44822,-8.52,-1.16,-7.208613585453317
Cc1cc(N2CCN(C(=O)c3nn(-c4ccccc4F)c4c3CCC4)CC2)nc(C(C)C)[nH+]1,C32054354_decoy,CASP3,Decoy,0,-8.0842,-8.2,-3.06,-6.183720249088682
COc1ccc([C@H]2[C@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(Cc4ccccc4)CC(=O)N32)cc1OC,C63136913_decoy,CASP3,Decoy,0,-7.75433,-6.92,-5.24,-5.924302034181381
COc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(C4CCCCC4)CC(=O)N23)cc1OC,C63137811_decoy,CASP3,Decoy,0,-7.65365,-6.52,-4.76,-6.45808033293899
COc1ccc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(C4CCCCC4)CC(=O)N23)cc1OC,C63137816_decoy,CASP3,Decoy,0,-7.81765,-6.59,-3.5,-5.791516427546
COc1cccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3C[C@H]3C(=O)N(CCCOC(C)C)CC(=O)N32)c1,C63138329_decoy,CASP3,Decoy,0,-7.3126,-6.92,-3.83,-5.748078379390687
CCOc1ccccc1[C@@H]1[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(CCCOC)CC(=O)N12,C63141115_decoy,CASP3,Decoy,0,-7.99521,-6.92,-1.31,-7.358029201574661
CN(C)c1ccc(/C=N/N2CC(=O)N3[C@@H](CC4=c5ccccc5=[NH+][C@H]4C3(C)C)C2=O)cc1,C63351533_decoy,CASP3,Decoy,0,-7.5743,-6.52,-0.86,-4.822133447091827
COc1cccc([C@H]2CN3C(=O)CN(C4CC4)C(=O)[C@]3(C)[C@H]3[NH+]=c4ccccc4=C23)c1OC,C63374874_decoy,CASP3,Decoy,0,-6.74943,-6.58,-2.51,-5.490061975124468
COc1ccc2c(c1OC)C(=O)N1[C@H]2[C@H]2[NH+]=c3ccccc3=C2C[C@H]1C(=O)OC(C)C,C63761265_decoy,CASP3,Decoy,0,-7.23612,-5.15,-1.17,-4.972866200438959
N#CCCN(C(=O)CSc1nnc(C2=c3ccccc3=[NH+]C2)o1)c1ccc(F)cc1,C63784549_decoy,CASP3,Decoy,0,-6.51557,-7.93,-0.5,-6.42132776506382
Cc1cc(N2CCN(CC3=NC(=O)C4=C5CCCC[C@H]5SC4=N3)CC2)nc(C(C)C)[nH+]1,C64046590_decoy,CASP3,Decoy,0,-9.25964,-7.54,-1.4,-7.112819609309794
O=C(c1cc2c(s1)CC[C@@H](C(=O)N1CCN(c3cccc[nH+]3)CC1)C2)N1CCOCC1,C65272728_decoy,CASP3,Decoy,0,-8.24359,-6.45,-1.23,-7.875438508591679
CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)[NH+](C)CC[C@@]341,C04097183_decoy,CASP3,Decoy,0,-7.18231,-6.0,-2.58,-6.004698521601943
C[NH+]1CCN(C(=O)[C@@H](C(=O)c2ccccc2)n2cc(Cl)ccc2=O)CC1,C04681579_decoy,CASP3,Decoy,0,-6.03281,-5.86,-4.12,-5.411253713065051
Cc1nc(N2CC[NH+]([C@H]3CCS(=O)(=O)C3)CC2)c2c3c(sc2n1)CCC3,C07908335_decoy,CASP3,Decoy,0,-9.17443,-7.5,-0.51,-5.990521993230256
Cc1sc2ncnc(N3CC[NH+]([C@@H]4CCS(=O)(=O)C4)CC3)c2c1C,C07908352_decoy,CASP3,Decoy,0,-8.60263,-5.48,-1.05,-5.733835874879508
C[NH+]1CCN(C(=O)[C@H](C(=O)c2ccc(Br)cc2)n2ccccc2=O)CC1,C00819349_decoy,CASP3,Decoy,0,-7.13498,-6.56,-1.01,-6.683673520636316
C[NH+]1CCN(c2oc(COc3ccc(Br)cc3)nc2C#N)CC1,C00934570_decoy,CASP3,Decoy,0,-5.89094,-5.56,-1.27,-3.907838365578077
c1ccc(-n2nnnc2C[NH+]2CCC[C@H]2c2nc3ccccc3s2)cc1,C09638094_decoy,CASP3,Decoy,0,-6.56722,-7.55,-1.29,-4.867674140591458
O=C1C[NH+](Cc2ccco2)[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc(Cl)cc1,C11998901_decoy,CASP3,Decoy,0,-6.57238,-6.54,-1.88,-4.381977398020191
O=C1C[NH+](Cc2ccco2)[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Cl)cc1,C12002365_decoy,CASP3,Decoy,0,-7.05349,-6.23,-0.87,-5.803930526699628
CSc1ncc(C(=O)N2CCN(c3cccc[nH+]3)CC2)n1-c1ccccc1,C08135789_decoy,CASP3,Decoy,0,-8.13385,-5.3,-2.63,-5.110888664169679
CCCn1nc(C(=O)N2CCOCC2)c2c1CC[C@H]([NH+]1CCCCC1)C2,C14541954_decoy,CASP3,Decoy,0,-7.40549,-5.7,-1.94,-5.800719752129212
CC[NH+]1CCN([C@@H](c2ccccc2Cl)c2nnnn2C(C)(C)C)CC1,C19528068_decoy,CASP3,Decoy,0,-5.78049,-6.1,-2.75,-4.426408388953343
O=C1C[C@H]([NH+]2CCN(c3ccccn3)CC2)C(=O)N1c1cccc(Cl)c1,C19595429_decoy,CASP3,Decoy,0,-6.87941,-7.04,-2.3,-4.842507992768495
CC(C)(C)C[NH+]1CCC[C@@]2(CCN(C(=O)c3nnc4n3CCCCC4)C2)C1,C19642550_decoy,CASP3,Decoy,0,-7.5703,-6.19,-5.1,-5.43552963218463
c1cc(-c2cnco2)cc(N2CCC([NH+]3CC[C@H](n4ccnc4)C3)CC2)c1,C23192215_decoy,CASP3,Decoy,0,-8.09108,-6.27,0.2,-5.796203272417734
Cc1ccc(N(CCC#N)C(=O)C[NH+]2CCC3(CC2)OCCO3)cc1C,C26935683_decoy,CASP3,Decoy,0,-7.79517,-7.02,-1.96,-6.218331008822706
O=C(c1ccco1)N1CCC([NH+]2CCC(C(=O)N3CCCC3)CC2)CC1,C35958875_decoy,CASP3,Decoy,0,-6.45391,-5.72,-2.83,-4.955126954436484
Cn1nccc1C(=O)N1CCC2=C(C1)[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]=N2,C39358126_decoy,CASP3,Decoy,0,-5.84822,-6.48,-0.64,-5.202940054337809
C1=NN=C(c2ccc3c(c2)OCO3)[C@@H]1C[NH+]1CCCC[C@H]1c1cccnc1,C39430213_decoy,CASP3,Decoy,0,-7.5931,-7.24,-1.88,-6.6577912311535385
O=C([C@H]1SC=C2OCCO[C@@H]21)N1CCC2=C(C1)[C@@H](c1ccccc1)[NH+]=N2,C39532297_decoy,CASP3,Decoy,0,-7.16169,-5.93,-1.06,-5.174162959358093
Cn1c(C[NH+]2CCCC[C@H]2c2nc3ccccc3s2)cc(=O)n(C)c1=O,C40024436_decoy,CASP3,Decoy,0,-7.17134,-7.12,-1.48,-7.210246175706442
Cc1nn2c(=O)cc(C[NH+]3CCC(c4nc5ccccc5s4)CC3)nc2s1,C43272808_decoy,CASP3,Decoy,0,-8.49788,-6.62,-1.15,-5.559476077054903
CCc1ccc(N2C(=O)C[C@@H](N3CCCn4c3[nH+]c3ccccc34)C2=O)cc1,C40382397_decoy,CASP3,Decoy,0,-5.92924,-6.43,-2.53,-3.6315329705751513
CC(C)(C)C(=O)N1CCC(C(=O)N2CCN(c3cc[nH+]cc3)CC2)CC1,C30880108_decoy,CASP3,Decoy,0,-6.1528,-5.75,-1.69,-4.573738288118406
CC(C)Cc1nc(C(=O)N2CCN(c3cccc[nH+]3)CC2)c2ccccn12,C62093399_decoy,CASP3,Decoy,0,-7.35006,-5.72,-1.86,-5.820191261310507
Cc1ccc(N2C[C@H](C(=O)N3CCC(Cn4cc[nH+]c4)CC3)CC2=O)cc1,C62128826_decoy,CASP3,Decoy,0,-7.02566,-6.13,-1.45,-4.920347936585413
Cc1nc2ccccn2c1C(=O)N1CCC(Cn2cc[nH+]c2C(C)C)CC1,C62130066_decoy,CASP3,Decoy,0,-6.6262,-5.66,-1.89,-5.349928788732824
C[NH+](C)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2I)C1,C62969350_decoy,CASP3,Decoy,0,-5.36502,-4.85,-1.75,-5.218275901272236
CC1(C)[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(C[C@@H]3CCCO3)CC(=O)N21,C63138670_decoy,CASP3,Decoy,0,-6.34654,-6.24,-3.44,-4.909134122953243
C[C@@]12C(=O)N(/N=C/c3ccc(F)cc3)CC(=O)N1CCC1=c3ccccc3=[NH+][C@H]12,C63350653_decoy,CASP3,Decoy,0,-6.83591,-6.54,0.06,-4.03051782036178
O=C(c1ccc2c(c1)OCCO2)C1CCN(C(=O)CC2=c3ccccc3=[NH+]C2)CC1,C63404042_decoy,CASP3,Decoy,0,-7.95645,-8.66,-1.41,-6.1907019691822365
COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCC4=c5ccc(OC)cc5=[NH+][C@H]4[C@@H]3C[C@H]12,C63426625_decoy,CASP3,Decoy,0,-6.21196,-7.49,-1.42,-4.8560856896986335
O=C([C@H]1C=C(c2ccc(Cl)cc2)N=N1)N1CCN(c2cccc[nH+]2)CC1,C63557983_decoy,CASP3,Decoy,0,-5.06303,-7.46,-1.73,-4.356256163111256
C(=N\c1ccc2c(c1)OCCOCCOCCO2)\C1=c2ccccc2=[NH+]C1,C63699193_decoy,CASP3,Decoy,0,-7.0401,-7.75,-2.83,-5.917699066939918
O=C([C@H]1CCCC2=c3ccccc3=[NH+][C@@H]21)N1CCN(c2cnccn2)CC1,C63846480_decoy,CASP3,Decoy,0,-6.85506,-6.25,-0.88,-5.103829643000326
C[C@H]1[C@@H]2[NH+]=c3ccccc3=C2CCN1C(=O)C1CCN(S(C)(=O)=O)CC1,C64117848_decoy,CASP3,Decoy,0,-6.80608,-5.54,-1.75,-3.93220197154615
C[C@H]1[C@@H]2[NH+]=c3ccccc3=C2CCN1C(=O)c1ccc(N2CCCC2)nn1,C64131244_decoy,CASP3,Decoy,0,-6.44201,-6.31,-0.28,-4.510392894848895
O=C1[C@H]2CC3=c4ccccc4=[NH+][C@H]3CN2C(=O)CN1/N=C/c1ccc(F)cc1,C64349330_decoy,CASP3,Decoy,0,-6.50169,-7.27,-4.97,-3.789486722798467
CCC(CC)C(=O)N1CCN(C(=O)[C@@H]2C=c3cc(OC)ccc3=[NH+]2)CC1,C64520704_decoy,CASP3,Decoy,0,-5.08204,-6.05,-1.8,-4.575485463925437
COc1ccc2c(c1)=C[C@@H](C(=O)N1CCN(C(=O)c3c(F)cccc3F)CC1)[NH+]=2,C64541372_decoy,CASP3,Decoy,0,-6.91492,-7.31,-1.21,-6.313231393966963
CN(C(=O)Cc1cn2ccsc2n1)C1CC[NH+](C2CCOCC2)CC1,C65039513_decoy,CASP3,Decoy,0,-9.09996,-5.0,-2.51,-5.713750387355229
O=C([C@@H]1CCCO1)N1CCN(c2nc(C[NH+]3CCCCCC3)cs2)CC1,C65200328_decoy,CASP3,Decoy,0,-8.9876,-5.68,-4.11,-4.896741037053367
CN(C)c1cccc(C(=O)N2CC[NH+]=C2N2CCN(c3cccc(Cl)c3)CC2)c1,C65306454_decoy,CASP3,Decoy,0,-7.55422,-6.07,-0.74,-7.169742830272342
C[C@H](C(=O)N1CCN(c2ncccn2)CC1)[NH+]1CC2C[C@@H]3CC1C[C@H](C2)C3,C65967615_decoy,CASP3,Decoy,0,-6.61828,-6.02,-1.91,-4.848809218726569
COc1ccc(-c2nn(CN3CC[C@@H]([NH+]4CCCC4)C3)c(=S)o2)cc1,C66080991_decoy,CASP3,Decoy,0,-6.51817,-5.52,-3.47,-5.115681861423808
Cc1cc(-c2cc(C(=O)N3CCC([NH+](C)C)CC3)c3c(C)noc3n2)c(C)s1,C66395700_decoy,CASP3,Decoy,0,-7.39412,-6.57,-1.76,-5.691610618836495
Cc1cc([C@@H](C)C(=O)N2CCC(CC(=O)N3CC[NH+](C)CC3)CC2)c(C)o1,C66858184_decoy,CASP3,Decoy,0,-8.10791,-7.05,-2.48,-7.872197806478713
CCc1c(C(=O)N2CCC[NH+]3CCC[C@@H]3C2)nnn1-c1cccc(Cl)c1,C67149829_decoy,CASP3,Decoy,0,-6.90761,-7.03,-0.13,-5.96503344655539
C[NH+](C)[C@H]1Cc2ccccc2N(C(=O)Cc2csc(-c3ncccn3)n2)C1,C67205485_decoy,CASP3,Decoy,0,-6.79142,-6.57,-1.78,-5.431655597793492
Cc1cc(C)n(-c2ccc(C[NH+]3CCC[C@H]3c3nnc4ccccn34)cc2)n1,C67375783_decoy,CASP3,Decoy,0,-6.33576,-8.68,-1.81,-7.084838376260058
CCCN(CCC)c1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(CCCCCC(=O)[O-])C1=O,C09303969_decoy,CASP3,Decoy,0,-8.33168,-6.45,-1.89,-7.033397637549171
CCOc1ccc(-c2nnc(SCC(=O)c3cc(C)n(CCC(C)C)c3C)n2CC(=O)[O-])cc1,C13195568_decoy,CASP3,Decoy,0,-7.65495,-7.27,-1.51,-7.402596805069861
CCOc1ccc(-c2nnc(SCC(=O)c3cc(C)n(CCCOC)c3C)n2CC(=O)[O-])cc1,C13195695_decoy,CASP3,Decoy,0,-7.92117,-6.37,-1.48,-6.475187817429034
CN(CCCNc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-])c1ccccc1,C13211984_decoy,CASP3,Decoy,0,-6.76378,-6.23,-1.31,-5.584512411891346
CCOc1ccc(-c2nnc(SCc3cc4c(cc3OCC)C[C@@H](C)O4)n2CCC(=O)[O-])cc1,C13270649_decoy,CASP3,Decoy,0,-8.09367,-6.96,-2.51,-7.301979254580237
COc1cc(CSc2nnc(-c3cccc(C)c3)n2CCC(=O)[O-])c([N+](=O)[O-])cc1OC(F)F,C13270703_decoy,CASP3,Decoy,0,-5.60198,-6.57,-2.36,-8.239750251575215
CCOc1cc(-c2nnc(SCc3c(C(=O)[O-])oc4ccccc34)o2)cc(OCC)c1OCC,C13417011_decoy,CASP3,Decoy,0,-9.49004,-6.44,-2.06,-6.506504363031788
CCOC(=O)c1ccc([N-]C2=NC(=O)/C(=C\c3ccc(O[C@@H](CC)C(=O)[O-])c(OC)c3)S2)cc1,C16913291_decoy,CASP3,Decoy,0,-7.49913,-7.13,-1.46,-5.8687617397764615
CCOC(=O)c1ccc([N-]C2=NC(=O)/C(=C\c3ccc(O[C@H](CC)C(=O)[O-])c(OC)c3)S2)cc1,C16913297_decoy,CASP3,Decoy,0,-8.40151,-6.25,-0.53,-5.598778654894897
CCOC(=O)c1ccc([N-]C2=NC(=O)/C(=C\c3ccc(OCCC(=O)[O-])c(OCC)c3)S2)cc1,C16920103_decoy,CASP3,Decoy,0,-6.78421,-6.66,-1.65,-6.175231267492469
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCN2CCOCC2)cc1,C33374396_decoy,CASP3,Decoy,0,-8.65586,-6.43,-1.53,-7.68245553642586
CCCCOc1ccc([C@@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2CCCn2ccnc2)cc1OC,C33699910_decoy,CASP3,Decoy,0,-8.20523,-6.37,-3.0,-6.081403838630699
CCCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCOC)cc1,C33814236_decoy,CASP3,Decoy,0,-7.72347,-6.0,-2.07,-6.483701672309221
CCCCCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1,C33814291_decoy,CASP3,Decoy,0,-7.27589,-6.83,-2.31,-6.329912246907334
CCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1,C33814292_decoy,CASP3,Decoy,0,-7.58818,-7.1,-4.09,-7.061386219703379
CC[C@H](C)Oc1ccc(-c2nnc(CCC(=O)N(C)CCc3ccc(OC)c(OC)c3)c([O-])n2)cc1,C34763622_decoy,CASP3,Decoy,0,-8.61253,-6.61,-2.16,-6.70791950397646
COc1ccc(CCN(C)C(=O)CCc2nnc(-c3ccc(OCC(C)C)cc3)nc2[O-])cc1OC,C34763926_decoy,CASP3,Decoy,0,-8.75831,-7.14,-3.05,-6.474251372753275
COc1ccc(CCN(C)C(=O)CCc2nnc(-c3cccc(OCC4CCC4)c3)nc2[O-])cc1OC,C34765712_decoy,CASP3,Decoy,0,-10.1572,-7.7,-1.57,-6.913810281350402
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C34917436_decoy,CASP3,Decoy,0,-7.70016,-5.14,-1.03,-6.040848825390773
CCOc1cc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2Cc2ccco2)ccc1OCCC(C)C,C34917809_decoy,CASP3,Decoy,0,-7.84926,-7.54,-2.94,-7.332843559511049
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C34940944_decoy,CASP3,Decoy,0,-7.92743,-6.74,-4.28,-7.001438162804009
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)cc3)=C([O-])C(=O)N2Cc2ccco2)cc1OC,C35283580_decoy,CASP3,Decoy,0,-7.58188,-7.68,-2.54,-8.751695482432424
CCCCOc1ccc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCCOC)cc1,C35484242_decoy,CASP3,Decoy,0,-7.80695,-5.54,-2.32,-5.350823106013519
C=C1CC[C@H]2[C@](C)(COC(=O)CCC(=O)[O-])[C@H](OC(=O)CCC(=O)[O-])CC[C@]2(C)[C@H]1/C=C/C1=CCOC1=O,C35566793_decoy,CASP3,Decoy,0,-8.83711,-7.96,-1.06,-8.917930835685487
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@H]1c1ccc(Cl)cc1,C35696286_decoy,CASP3,Decoy,0,-8.64508,-6.06,-3.79,-7.272873431982419
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@@H]1c1cc(OC)ccc1OC,C35703654_decoy,CASP3,Decoy,0,-8.41757,-5.14,-3.77,-6.492103348445763
CCOC(=O)[C@@H]1CCCN(/C([O-])=C/C2=CSC3=NC(C)=C(C(=O)OCCOC)[C@@H](c4ccccc4)N23)C1,C36049857_decoy,CASP3,Decoy,0,-8.79517,-6.28,-2.84,-6.781934290689596
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1ccc(C)cc1,C36052663_decoy,CASP3,Decoy,0,-8.33299,-6.02,-1.74,-7.029355563375107
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@@H]1c1cc(OC)cc(OC)c1,C36053178_decoy,CASP3,Decoy,0,-8.43538,-7.0,-5.48,-7.016396903012273
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@@H]1c1ccccc1OC,C36058368_decoy,CASP3,Decoy,0,-9.92804,-7.08,-3.19,-8.042630412962428
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@H]1c1ccc(OC)c(OC)c1,C36058631_decoy,CASP3,Decoy,0,-8.83923,-4.91,-2.64,-6.079732082189636
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOC)cc1OC,C38249565_decoy,CASP3,Decoy,0,-8.24645,-4.89,-1.86,-6.877542296054799
C/C(=N\NC(=O)CCCCCCC(=O)N/N=C(\C)c1c([O-])cc(C)oc1=O)c1c([O-])cc(C)oc1=O,C08444172_decoy,CASP3,Decoy,0,-7.99678,-8.67,-2.72,-9.151707092560793
CCOC(=O)[C@H]1C(c2cccs2)=CS[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703909_decoy,CASP3,Decoy,0,-10.7236,-6.83,-3.28,-8.63709479589705
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCCCC)s3)[C@@H]2c2cccnc2)cc1,C40003217_decoy,CASP3,Decoy,0,-9.5272,-7.66,-4.13,-8.875796395002295
CCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCCOC)cc1,C40003634_decoy,CASP3,Decoy,0,-7.50901,-5.63,-2.16,-7.020543016681454
CCCCN1C(=O)[C@@]2(C(C(=O)c3ccc(OCCC)cc3)=C([O-])C(=O)N2CCOC)c2ccccc21,C40015331_decoy,CASP3,Decoy,0,-8.13813,-5.98,-0.75,-6.946879188450935
O=C([O-])CCCCCCCCCCN1C(=O)/C(=C/c2c([O-])nc3ccccn3c2=O)SC1=S,C40021940_decoy,CASP3,Decoy,0,-8.47292,-6.82,-2.09,-6.414367932131518
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@H]1c1cc(OC)c(OC)c(OC)c1,C40027602_decoy,CASP3,Decoy,0,-7.70265,-6.92,-1.38,-9.304957521231064
C=CCN1C(=O)C([O-])=C(C(=O)c2cc3cccc(OC)c3o2)[C@H]1c1ccc(OCCCC)c(OC)c1,C40028436_decoy,CASP3,Decoy,0,-8.94073,-5.4,-1.93,-5.917946085596896
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40079132_decoy,CASP3,Decoy,0,-8.44782,-5.28,-1.99,-7.555478070951062
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(N(CC)CC)cc2)c(C)c1,C40083653_decoy,CASP3,Decoy,0,-8.38751,-6.3,-3.56,-7.5049708688978
CCN(CC)c1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084316_decoy,CASP3,Decoy,0,-7.55498,-6.32,-1.96,-6.48712684188995
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1OC,C40098587_decoy,CASP3,Decoy,0,-9.09651,-5.74,-2.65,-7.917436053944865
CCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC)cc1OCC,C39898296_decoy,CASP3,Decoy,0,-7.43115,-5.57,-4.05,-6.184522487950213
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CCC(=O)[O-])c1C,C13402591_decoy,CASP3,Decoy,0,-8.51941,-8.09,-3.44,-8.698244196105431
CCOC(=O)c1c(NC(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)sc(C(=O)OC)c1C,C13093087_decoy,CASP3,Decoy,0,-9.13118,-7.79,-1.65,-11.008267276335271
CCOc1cc(/C=C2/SC([N-]c3ccc(OC)cc3OC)=NC2=O)ccc1O[C@@H](CC)C(=O)[O-],C16919193_decoy,CASP3,Decoy,0,-7.93696,-6.42,-1.34,-5.973175241306894
CCOC(=O)c1sc(NC(=O)CSc2nc([O-])cc(-c3ccccc3)n2)c(C(=O)OCC)c1C,C12464191_decoy,CASP3,Decoy,0,-10.0437,-7.91,-3.75,-7.285724749997711
CCOC(=O)C1=C(C)C(C(=O)COC(=O)c2ccccc2[N-]S(=O)(=O)c2cc(C)ccc2C)=N[C@H]1C,C39944779_decoy,CASP3,Decoy,0,-8.48062,-6.99,-2.35,-6.550475288405615
COc1ccc(-c2csc([C@@H]([NH3+])c3cc(OC)c(OC)c(OC)c3)n2)cc1,C11826686_decoy,CASP3,Decoy,0,-7.64024,-6.77,-1.36,-5.827491538790519
Cc1c(C(=O)NCC2CC2)sc2ncnc(NCC[NH+]3CCCCC3)c12,C12079660_decoy,CASP3,Decoy,0,-9.64066,-5.42,-1.13,-8.373281590231258
c1ccc(-c2csc(CC[NH2+]Cc3c[nH]nc3-c3ccc4c(c3)OCO4)n2)cc1,C11935774_decoy,CASP3,Decoy,0,-7.3816,-5.47,-1.79,-6.400477237621374
CC[C@H](Nc1ncnc2sc(C(=O)NCC[NH+](C)C)c(C)c12)c1cccs1,C12450366_decoy,CASP3,Decoy,0,-9.9736,-5.9,-0.8,-7.588178919745292
O=C(Nc1ccc(C(=O)NCc2ccccc2C[NH+]2CCCC2)s1)c1ccco1,C12806360_decoy,CASP3,Decoy,0,-9.30534,-8.04,-1.36,-9.306796662085675
C[NH+](C)[C@H](CNC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1)c1ccco1,C23235983_decoy,CASP3,Decoy,0,-6.34415,-6.23,-2.43,-5.1817707635370525
O=C(C[C@H]1C(=O)NCC[NH+]1Cc1ccoc1)NCCc1ccc(C(F)(F)F)cc1,C23380499_decoy,CASP3,Decoy,0,-6.42084,-6.4,-1.38,-6.121470449733433
CCCNC(=O)C[NH+]1CCC(NC(=O)c2sc(-c3cccs3)nc2C)CC1,C29220623_decoy,CASP3,Decoy,0,-8.52404,-5.86,-0.93,-6.244587313046845
C[NH+](C)CCCCNC(=O)CNc1ncnc2sc(-c3ccccc3)cc12,C31868810_decoy,CASP3,Decoy,0,-8.20772,-6.16,-3.34,-6.997081584902647
CC[NH+]1CCc2cc(OC)c(OC)cc2[C@H]1[C@H](NC(=O)NC(C)C)C(C)C,C35668112_decoy,CASP3,Decoy,0,-7.68526,-5.36,-2.13,-6.694922058981162
O=C(CC[C@@]1(Cc2cccs2)CCC(=O)N1)NCC1=C[C@@H](c2ccccc2)[NH+]=N1,C39552382_decoy,CASP3,Decoy,0,-9.31371,-7.63,-2.31,-6.9886788158604665
CCC[NH+](CCO)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F,C41625036_decoy,CASP3,Decoy,0,-6.1964,-5.72,-1.42,-6.20010048227736
C[NH+](C)C1(CNC(=O)N(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)CCCC1,C43146520_decoy,CASP3,Decoy,0,-7.36628,-7.08,-4.59,-6.889100304648929
CC(C)Cc1nnc(NC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)s1,C43374721_decoy,CASP3,Decoy,0,-9.41705,-5.86,-0.98,-6.719624401126465
CC[NH+](CC)CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)NC)cc1,C43672445_decoy,CASP3,Decoy,0,-6.95776,-5.76,-0.77,-5.557221469426683
CC[C@@H](C)NC(=O)CN1CC[NH+]([C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)CC1,C44743164_decoy,CASP3,Decoy,0,-7.8837,-5.12,-1.7,-5.159557553724572
CC(C)[C@@H](C(=O)NC(C)(C)C)N1CC[NH+]([C@@H](C(=O)NC(C)(C)C)C(C)C)CC1,C45910733_decoy,CASP3,Decoy,0,-7.4038,-6.52,-2.94,-7.4588165434404194
Cc1cc(C)cc(NC(=O)C(=O)NC[C@H](c2ccc(N(C)C)cc2)[NH+]2CCCC2)c1,C04330516_decoy,CASP3,Decoy,0,-7.71835,-7.59,-2.41,-6.80452724052503
O=C(NCc1cccc(OC(F)F)c1)NC[C@H](c1ccco1)[NH+]1CCCCC1,C51719252_decoy,CASP3,Decoy,0,-7.59834,-6.77,-4.15,-7.224897143171169
CC[NH+](CC)[C@@H](CNC(=O)NCc1ncc(C)c(OC)c1C)c1ccsc1,C51755889_decoy,CASP3,Decoy,0,-9.81649,-5.06,-1.51,-6.4705766231287525
C[C@H]1CCCC[NH+]1CCCCNC(=O)Nc1nnc(-c2ccsc2)s1,C52496142_decoy,CASP3,Decoy,0,-9.69901,-6.67,-1.52,-6.998443037236446
CC[NH+](CC)[C@@H](C)CNC(=O)Nc1cc(OC)c(OC)cc1Br,C54483519_decoy,CASP3,Decoy,0,-6.77809,-4.37,-3.88,-4.824247798857644
C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)NCCC(=O)NC1CCCC1,C54750855_decoy,CASP3,Decoy,0,-6.69624,-5.62,-3.69,-5.706300163387798
Cc1ccc(S(C)(=O)=O)c(NC(=O)NCCCC[NH+]2C[C@H](C)C[C@H](C)C2)c1,C56768679_decoy,CASP3,Decoy,0,-9.04705,-7.2,-1.3,-7.381204515597891
CCCNC(=O)c1cccc(CNC(=O)N2CCC(CC[NH+](C)C)CC2)c1,C56866025_decoy,CASP3,Decoy,0,-7.02355,-6.02,-2.09,-6.031086217774679
CC(C)[NH+](CCNC(=O)NCc1cn2cc(Br)ccc2n1)C(C)C,C57346333_decoy,CASP3,Decoy,0,-7.5219,-5.23,-1.39,-8.607108248931867
CC(C)Oc1ccc(CNC(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)cn1,C47951635_decoy,CASP3,Decoy,0,-8.80601,-6.61,-4.24,-10.4709404216497
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)CCNC(=O)OCC(F)(F)F)C1,C60095061_decoy,CASP3,Decoy,0,-6.74744,-5.68,-1.44,-6.210812703430055
C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C,C49944087_decoy,CASP3,Decoy,0,-6.77364,-6.26,-2.93,-5.614765255885961
Cc1cc(C)c(CNC(=O)N(CC[NH+](C)C)Cc2ccc(F)c(F)c2)c(=O)[nH]1,C62476454_decoy,CASP3,Decoy,0,-6.52795,-6.55,-1.0,-7.132444931558942
O=C(NCCC1=c2ccccc2=[NH+]C1)/C(=C\c1ccco1)NC(=O)c1cccs1,C63395287_decoy,CASP3,Decoy,0,-8.50214,-7.78,-3.78,-8.05812809593998
COCCCNC(=O)[C@H]1[NH+]=c2ccc(C)cc2=C1NC(=O)c1ccc(C)cc1,C63752323_decoy,CASP3,Decoy,0,-7.09343,-6.74,-1.22,-6.514288024062658
C[NH+](C)[C@H](CNC(=O)CNS(=O)(=O)c1cccs1)C1CCCCC1,C63804114_decoy,CASP3,Decoy,0,-8.789,-6.19,-2.47,-6.280556707563195
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NC[C@@H]2CC[NH+](C(C)C)C2)C(C)C)cc1,C63836647_decoy,CASP3,Decoy,0,-8.43245,-7.06,-3.53,-7.0269453128242985
O=C(NCCC1=c2ccccc2=[NH+]C1)NC[C@@H](c1cccs1)N1CCOCC1,C63913165_decoy,CASP3,Decoy,0,-9.23246,-6.1,-1.77,-7.109144209454441
COc1cccc(CNC(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)c1OC,C64237140_decoy,CASP3,Decoy,0,-8.18881,-7.22,-1.37,-7.088006887002546
Cc1[nH+]ccn1C[C@H](C)CNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1,C64736902_decoy,CASP3,Decoy,0,-7.02974,-7.16,-1.89,-7.079581603709728
CCCCNC(=O)[C@H]1CCC[NH+](CC(=O)Nc2ccc(Br)cn2)C1,C51059736_decoy,CASP3,Decoy,0,-7.3751,-6.52,-0.53,-6.048907646554742
Cc1cc(C)cc(NC(=O)C[NH+]2CCC[C@H](CNS(=O)(=O)C(C)C)C2)c1,C51101749_decoy,CASP3,Decoy,0,-7.5093,-6.81,-2.09,-5.764848398945102
CCCCNC(=O)[C@@H]1CCCN(C(=O)NC2CC[NH+](CC(F)F)CC2)C1,C65383559_decoy,CASP3,Decoy,0,-7.19964,-7.02,-1.88,-6.650950667996384
CCN(CC)C(=O)Cc1ccc(NC(=O)NC[C@H]2CC[NH+](C(C)C)C2)cc1,C65520977_decoy,CASP3,Decoy,0,-6.54483,-5.71,-1.17,-4.72118662616425
CC[C@H](C)[NH+](C)CCNC(=O)NCc1cc(Br)c2c(c1)OCO2,C66189594_decoy,CASP3,Decoy,0,-6.56664,-5.46,-3.73,-4.756733550205106
CC[NH+](CC)[C@H](C)CNC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C,C66966897_decoy,CASP3,Decoy,0,-8.11272,-5.53,-3.72,-5.8736382563810565
CNS(=O)(=O)c1cccc([C@H](C)[NH2+]Cc2cc3cccc(OC)c3o2)c1,C67010409_decoy,CASP3,Decoy,0,-7.46363,-6.94,-0.9,-5.870458857768814
Cc1ccccc1CN(C)C(=O)NCc1cccc(C(=O)NCC[NH+](C)C)c1,C67086499_decoy,CASP3,Decoy,0,-6.48439,-6.9,-1.71,-6.449845896387287
Cc1ccsc1CN(C)C(=O)NCc1cccc(C(=O)NCC[NH+](C)C)c1,C67086500_decoy,CASP3,Decoy,0,-7.32023,-5.63,-3.25,-5.120621003378682
COc1ccc(C[NH2+]Cc2c[nH]nc2-c2cc3ccccc3o2)cc1OC(F)F,C67186210_decoy,CASP3,Decoy,0,-6.90137,-5.3,-3.58,-5.264534122341933
COc1cccc2cc(C[NH2+]CCNS(=O)(=O)c3ccc(C)cc3)oc12,C67450452_decoy,CASP3,Decoy,0,-7.50207,-6.47,-1.5,-7.353022665606404
CC[C@H](NC(=O)C(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1C)C(C)C,C67454507_decoy,CASP3,Decoy,0,-6.91419,-6.76,-1.75,-5.265817997338481
CC[NH+](CC)[C@@H](CNC(=O)Nc1nnc(C(F)F)s1)Cc1ccccc1,C67586565_decoy,CASP3,Decoy,0,-6.98772,-5.66,-1.3,-5.828883500391285
CC(=O)OC[C@@H]1O[C@H](OC(=O)c2c(C)cc(C)cc2C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C04744217_decoy,CASP3,Decoy,0,-5.31043,-7.3,-2.73,-6.233412338668018
CCOCCCN(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)[C@H](C(=O)NC(C)(C)C)c1ccc(O)cc1,C06600063_decoy,CASP3,Decoy,0,-7.55033,-6.19,-4.03,-6.240589420504186
CC(=O)OC[C@H]1O[C@@H](SC(=S)N(C)C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C08497713_decoy,CASP3,Decoy,0,-7.01094,-6.43,-1.85,-7.807696881402736
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)CSCC(=O)Nc1cc(C)on1,C08825469_decoy,CASP3,Decoy,0,-6.30529,-5.61,-0.76,-5.2893050853859895
CCCCOC(=O)C1=C(N)N2C(=O)[C@H](C)SC2=C(C(=O)OCC)[C@H]1c1cc(OC)c(OC)c(OC)c1,C03624898_decoy,CASP3,Decoy,0,-8.34425,-5.86,-2.46,-7.095502896906298
CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)cc1,C09385837_decoy,CASP3,Decoy,0,-6.64529,-6.21,-1.5,-5.321005880817242
CC(=O)Oc1cc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC(C)=O)c1OC(C)=O,C09439451_decoy,CASP3,Decoy,0,-7.43693,-7.82,-1.57,-6.832622118146952
CCOC(=O)C1=C(COC(=O)/C=C/c2ccc(OCC#N)c(OC)c2)NC(=O)N[C@H]1c1cccs1,C09493398_decoy,CASP3,Decoy,0,-7.53521,-5.89,-1.2,-5.71484787434779
COC(=O)C1=CN(Cc2ccc(OC)c(OC)c2)C=C(C(=O)OC)C1c1ccc(OC)c(OC)c1OC,C02797093_decoy,CASP3,Decoy,0,-7.50495,-5.85,-2.7,-6.974562622538627
COc1cc(/C=C/C(=O)OCc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)ccc1OCC#N,C09584787_decoy,CASP3,Decoy,0,-8.66825,-6.17,-2.39,-5.936187280091487
CCOC(=O)c1c(NC(=O)COC(=O)CSCc2c(C)noc2C)sc(C(=O)NC)c1C,C09634255_decoy,CASP3,Decoy,0,-8.5877,-5.86,-1.31,-5.858325929039404
CCOC(=O)COc1ccc(/C=N/NC(=O)CNC(=O)c2ccc(OC)c(OC)c2)cc1Br,C10000892_decoy,CASP3,Decoy,0,-7.9766,-7.42,-2.89,-6.353596222530174
CCOC(=O)c1c(NC(=O)COC(=O)/C=C/c2ccc(OC)c(OC)c2)sc(C(=O)NC)c1C,C10867358_decoy,CASP3,Decoy,0,-9.33779,-7.12,-1.25,-7.256778161831312
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,C08867572_decoy,CASP3,Decoy,0,-6.62581,-6.05,-3.72,-6.834645533828116
CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H](OC(C)=O)[C@H]1OC(C)=O,C12379907_decoy,CASP3,Decoy,0,-6.72358,-7.21,-2.03,-6.372921069641587
CCOC(=O)/C=c1\s/c(=C\c2ccc3c(c2)OCCO3)c(=O)n1CC(=O)N(CCOC)CCOC,C13134195_decoy,CASP3,Decoy,0,-8.63187,-6.16,-1.5,-9.717578743875851
CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O,C14416832_decoy,CASP3,Decoy,0,-7.31029,-5.45,-3.16,-6.620676038278053
CC(=O)OC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)c1cn(C(C)=O)c(=O)n1C(C)=O,C16322087_decoy,CASP3,Decoy,0,-6.72357,-7.16,-2.51,-8.262209283822422
CC(=O)OC[C@H]1O[C@H](Oc2ccccc2-c2nc(C)n[nH]2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16957006_decoy,CASP3,Decoy,0,-6.44855,-7.51,-2.51,-7.363674302199305
O=C(OCCSSCCOC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1,C05743338_decoy,CASP3,Decoy,0,-6.23934,-6.15,-1.6,-6.165112130473359
CCOC(=S)S[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C17324583_decoy,CASP3,Decoy,0,-7.12294,-6.13,-2.07,-6.938875391938344
CC(=O)OC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O,C14416831_decoy,CASP3,Decoy,0,-7.20123,-6.26,-2.58,-8.60550317129362
CCCCOC(=O)C1=C(N)N(C)c2ccccc2[C@]12C(=O)OC(CC(=O)OCC)=C2C(=O)OCC,C20583259_decoy,CASP3,Decoy,0,-7.83891,-5.08,-0.73,-6.626139572868161
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)n2CCC,C21134353_decoy,CASP3,Decoy,0,-7.05756,-6.77,-0.98,-6.876235639542502
CCOC(=O)C1=C(CN(C)Cc2ccn(CC)n2)NC(=O)N[C@@H]1c1ccc(OC)c(COC)c1,C22707667_decoy,CASP3,Decoy,0,-7.8719,-6.13,-2.42,-8.513703671093767
CCOC(=O)CCCC(=O)N1CCN(c2ccc(-c3cc(C(=O)OCC)nn3-c3ccccn3)cc2)CC1,C23451587_decoy,CASP3,Decoy,0,-8.15338,-7.35,-2.37,-6.692599687050699
CCOCCCn1c(=O)c2ccccc2n2c(SCC(=O)N(CCC#N)CCC#N)nnc12,C23889149_decoy,CASP3,Decoy,0,-8.03022,-5.19,-1.96,-6.254133718497612
C=CCOc1ccc(/C=N/Nc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])cc1OC,C24035463_decoy,CASP3,Decoy,0,-7.86653,-6.25,-2.82,-7.730263052930703
CCOC(=S)S[C@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1NC(C)=O,C25662940_decoy,CASP3,Decoy,0,-6.66085,-4.88,-4.24,-5.97623995413328
CCOC(=O)CCCNC(=O)COC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1,C28442545_decoy,CASP3,Decoy,0,-7.69179,-6.29,-4.61,-5.889258675134262
CCOC(=O)/C(=N\Nc1ccccc1)[P@](=O)(/N=c1/sn(-c2ccccc2)nc1C(=O)OCC)OC,C16682973_decoy,CASP3,Decoy,0,-6.20043,-7.86,-3.97,-7.68245608763084
CC(=O)OC[C@H]1O[C@@H](OCCBr)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C34527652_decoy,CASP3,Decoy,0,-5.50047,-5.59,-2.96,-5.906172345556757
CCOc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(=O)c1cc(OC)c(OC)c(OC)c1,C33959209_decoy,CASP3,Decoy,0,-6.88632,-6.56,-2.78,-6.20343779619103
CCOC(=O)CCCSc1nc2c(OC)c(OC)c(OC)cc2c(=O)n1-c1ccc([N+](=O)[O-])cc1,C35924835_decoy,CASP3,Decoy,0,-8.37609,-5.68,-0.6,-7.492027139592509
CCCCNC(=O)[C@H](c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)C(=O)CNC(=O)c1ccccc1,C36504402_decoy,CASP3,Decoy,0,-6.94801,-7.43,-2.89,-7.04678416391642
CCCCNC(=O)[C@@H](c1ccc(OC)c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)(C)C,C36583777_decoy,CASP3,Decoy,0,-6.97413,-5.46,-1.72,-6.302129655669779
CCCCC[C@@H](C(=O)NC1CCCCC1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36595129_decoy,CASP3,Decoy,0,-7.13693,-6.62,-3.93,-6.541974773148235
CC(C)CCNC(=O)[C@H](c1ccco1)N(CCCO)C(=O)Cn1nnc(-c2ccc(F)cc2)n1,C06134577_decoy,CASP3,Decoy,0,-7.50916,-6.26,-1.2,-6.432770317682319
CCOC(=O)C1=C(C(=O)COC(=O)CSCC(=O)Nc2cc(C)on2)C(C)=N[C@@H]1C,C39620977_decoy,CASP3,Decoy,0,-6.87522,-6.91,-0.18,-6.315949195029991
CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O,C04403108_decoy,CASP3,Decoy,0,-7.52301,-6.09,-2.84,-8.093485982575695
CCNc1ncc(C(=O)OCC)c(CSc2nnc(CCc3cnn(C)c3)n2C(C)C)n1,C41342314_decoy,CASP3,Decoy,0,-8.46918,-6.87,-1.97,-7.157004269191375
C=CCn1c(CCc2cnn(C)c2)nnc1SCc1nc(N2CCCCC2)ncc1C(=O)OCC,C41343184_decoy,CASP3,Decoy,0,-9.44873,-7.22,-3.83,-8.671326315085587
C=CCn1c(Cc2ccc(OC)cc2)nnc1SCc1nc(N2CCOCC2)ncc1C(=O)OCC,C41661670_decoy,CASP3,Decoy,0,-9.04113,-6.59,-3.67,-7.851738969862653
CCOC(=O)/C(=C/c1ccccc1[N+](=O)[O-])c1cccc(/C(=C\c2ccccc2[N+](=O)[O-])C(=O)OCC)c1,C43761406_decoy,CASP3,Decoy,0,-7.51438,-6.52,-4.45,-7.890625690274315
CC(C)(C)C(=O)OC[C@H]1O[C@H](N)[C@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@H]1OC(=O)C(C)(C)C,C44608698_decoy,CASP3,Decoy,0,-6.13988,-6.8,-4.07,-6.482757351630479
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(OC(C)=O)c(OCC)c3)c(=O)n2[C@H]1c1ccc(OC(C)=O)c(OC)c1,C01838890_decoy,CASP3,Decoy,0,-9.15238,-7.87,-2.01,-14.228473001361449
CCOC(=O)Cn1nnnc1[C@@H](CC)N(CCCO)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13496017_decoy,CASP3,Decoy,0,-9.07453,-7.05,-2.19,-8.693314675042524
CCC[C@H](c1nnnn1CC(=O)OCC)N(Cc1ccco1)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13500936_decoy,CASP3,Decoy,0,-8.82848,-8.05,-2.87,-8.672314497420214
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2ccc(C(=O)OC)cc2)C(C)=N1,C09173669_decoy,CASP3,Decoy,0,-8.79391,-5.45,-3.7,-7.074657998835911
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)[C@@H]2C(C)=NC(C(=O)OC)=C2C)[C@@H]1c1ccc(C(=O)OC)cc1,C20219711_decoy,CASP3,Decoy,0,-8.60456,-7.63,-1.85,-11.971513439174757
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cc(Br)c(OCC(=O)[O-])c(OCC)c1,C08456205_decoy,CASP3,Decoy,0,-8.40496,-6.1,-2.82,-6.980539008679068
Cc1ccc(C(=O)O[C@H](C(=O)[O-])[C@@H](OC(=O)c2ccc(C)cc2)C(=O)NNC(=O)c2ccco2)cc1,C10130912_decoy,CASP3,Decoy,0,-7.24521,-7.91,-3.26,-7.560765867323191
Cc1c(CC(=O)N[C@@H](CCCNC(N)=O)C(=O)[O-])c(=O)oc2c(C)c3occ(-c4ccc(F)cc4)c3cc12,C02112495_decoy,CASP3,Decoy,0,-7.89436,-8.38,-1.81,-7.2729230933665585
Cc1ccc(C)c(NC(=O)CN(C)C(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2CCO)c1,C13046263_decoy,CASP3,Decoy,0,-6.94476,-7.16,-1.96,-5.771511313840451
CCOc1cc2c(cc1NC(=O)CSc1nc3cc(C(=O)[O-])ccc3c(=O)n1CCO)O[C@@H](C)C2,C13047114_decoy,CASP3,Decoy,0,-8.37439,-7.83,-1.51,-6.672907724108278
CCOC(=O)C1=C(CSc2nnc(-c3cccs3)n2CC(=O)[O-])NC(=O)N[C@@H]1C,C13203880_decoy,CASP3,Decoy,0,-8.3689,-6.04,-1.92,-8.350426015752655
Cc1ccc(-c2nnc(SCC(=O)c3c(N)n(CC(C)C)c(=O)n(C)c3=O)n2CC(=O)[O-])cc1,C13205217_decoy,CASP3,Decoy,0,-6.89537,-6.96,-2.27,-7.372588852960761
CCOC(=O)C1=C(CSc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])NC(=O)N[C@@H]1C,C13205633_decoy,CASP3,Decoy,0,-7.95972,-6.3,-1.97,-7.084136243481951
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(CNC(C)=O)o2)cs1,C13239937_decoy,CASP3,Decoy,0,-8.37893,-5.98,-1.16,-5.278954166141193
CCC(C)(C)C1CCC(NC(=O)CNC(=O)N[C@H](CC(=O)N2CCCC2)C(=O)[O-])CC1,C13245788_decoy,CASP3,Decoy,0,-8.64221,-7.44,-0.79,-6.4610081606620975
CCCCN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C13259314_decoy,CASP3,Decoy,0,-6.54731,-7.18,-3.49,-6.657640472088458
CNC(=O)c1cccc(NC(=O)CSc2nnc(-c3cccs3)n2[C@H](C(=O)[O-])C(C)C)c1,C13272090_decoy,CASP3,Decoy,0,-7.61159,-7.61,-1.41,-11.20812001018798
CN(CC(=O)NC1CC1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-],C13277333_decoy,CASP3,Decoy,0,-6.54195,-7.65,-1.59,-6.57775768880814
CCOc1c(Br)cc(C(=O)NNS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1OC,C13348411_decoy,CASP3,Decoy,0,-7.79917,-7.56,-1.86,-6.444432982486338
O=C([O-])COc1ccc(/C=N/NC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)cc1,C13352232_decoy,CASP3,Decoy,0,-7.07987,-6.86,-0.9,-6.1229416347114975
COc1nc(N[C@@H](Cc2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)C(=O)[O-])nc(N(C)C)n1,C13442585_decoy,CASP3,Decoy,0,-8.04048,-6.99,-1.16,-6.62243005717623
O=C([O-])CCCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(Br)o1,C13562052_decoy,CASP3,Decoy,0,-6.32193,-6.49,-3.65,-6.127671273939885
NS(=O)(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(CCCCCC(=O)[O-])C3=O)o2)cc1,C13777517_decoy,CASP3,Decoy,0,-11.4805,-5.88,-1.79,-7.39417154722436
O=C([O-])CCCN1C(=O)/C(=C/c2c(NC[C@@H](O)c3ccccc3)nc3ccccn3c2=O)SC1=S,C13806854_decoy,CASP3,Decoy,0,-7.73981,-6.98,-4.35,-6.593803816563391
CCCC1=NN(c2ccc(C(=O)[O-])cc2)C(=O)/C1=C\c1cc(Cl)c(OCC(N)=O)c(OC)c1,C13913992_decoy,CASP3,Decoy,0,-9.7197,-7.18,-0.59,-8.05894207081313
COc1ccc(C(=O)CSc2nnc(N/N=C/c3cc(Cl)cc(Cl)c3[O-])n2N)cc1OC,C21318558_decoy,CASP3,Decoy,0,-8.13539,-8.0,-1.25,-8.50273364508187
COc1ccc(CSc2nnc(N/N=C/c3cc(OC)c([O-])c([N+](=O)[O-])c3)n2N)cc1,C21326847_decoy,CASP3,Decoy,0,-7.2232,-6.87,-2.78,-6.312181763876135
CS(=O)(=O)c1ccc(NCCNC(=O)Cn2c([S-])nnc2-c2cccs2)c([N+](=O)[O-])c1,C09933066_decoy,CASP3,Decoy,0,-8.73243,-6.97,-1.71,-5.86158719869349
Cc1nn(CC(C)C)c(C)c1CC(=O)NNC(=O)c1ccccc1[N-]S(=O)(=O)c1cccs1,C22259753_decoy,CASP3,Decoy,0,-9.1009,-7.87,-4.43,-6.806697829806509
CCCc1nnc([S-])n1CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1,C25444672_decoy,CASP3,Decoy,0,-8.7267,-7.12,-3.12,-7.202523409896623
CCc1nnc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(F)cc3)cc2)s1,C06088682_decoy,CASP3,Decoy,0,-8.29016,-7.93,-0.91,-6.650099225220857
C=C(C(=O)[O-])[C@@H]1[C@H]2C=C(C)[C@@H](OC(C)=O)C[C@@H]2[C@@](C)(O)C[C@@H]1OC(=O)/C(=C/CO)CO,C35454637_decoy,CASP3,Decoy,0,-7.96084,-7.17,-1.41,-13.125947902272156
O=C(NC(=S)NC(=S)/N=C(/[S-])NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1,C02024259_decoy,CASP3,Decoy,0,-8.99382,-6.23,-2.13,-7.713675173603655
CCOC(=O)[C@@H]1C2=C(CCC2)S[C@H]1NC(=O)CSc1nnc(-c2ccccc2NC(C)=O)c([O-])n1,C39252632_decoy,CASP3,Decoy,0,-8.57598,-7.35,-2.63,-6.265834883430943
CCOC(=O)C1=C(COC(=O)Cn2nc([O-])c3ccccc3c2=O)NC(=O)N[C@@H]1c1ccccc1,C39534831_decoy,CASP3,Decoy,0,-5.91709,-7.47,-4.95,-5.846053950570398
CC(=O)[C@]1(O)CC[C@H]2[C@H]3CCC4=C/C(=N/OCC(=O)NCCCCC(=O)[O-])CC[C@]4(C)[C@@H]3CC[C@@]21C,C39546557_decoy,CASP3,Decoy,0,-8.08142,-6.87,-2.52,-5.620929795409036
C=CCN1C(=O)c2ccc(Cl)cc2N[C@H]1SCC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39680246_decoy,CASP3,Decoy,0,-8.858,-7.5,-2.46,-7.821449025340184
O=C(CS[C@H]1NN[C@H](c2cccs2)N1C1CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39692833_decoy,CASP3,Decoy,0,-9.19391,-7.95,-1.36,-8.210607325521503
C[C@@H](O)CN1C(=O)c2ccc(C(=O)[O-])cc2N[C@H]1SCC(=O)NCCc1c[nH]c2ccccc12,C39698620_decoy,CASP3,Decoy,0,-7.91381,-7.98,-2.45,-7.320727884946189
CC1=N[C@@H]2NC(SCC(=O)NCCc3c[nH]c4ccccc34)=NN2C(C)=C1CCC(=O)[O-],C39716107_decoy,CASP3,Decoy,0,-5.82788,-7.48,-2.12,-6.420422692548091
CC(C)OCCCN1C(=O)c2ccccc2N[C@H]1SCc1nc2cc(C(=O)[O-])ccc2c(=O)[nH]1,C39722640_decoy,CASP3,Decoy,0,-8.68501,-7.56,-2.96,-7.440018298802984
CC[C@H](CO)Nc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(CCCC(=O)[O-])C1=O,C40008000_decoy,CASP3,Decoy,0,-8.28478,-6.93,-2.55,-7.607774047059491
CC(C)(CNC(=O)CCC(=O)O[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]21C)[C@@H](O)C(=O)[O-],C43743534_decoy,CASP3,Decoy,0,-8.8518,-9.06,-2.25,-7.739390892685899
CCO/C([O-])=C1\C(COCc2cc(=O)[nH]c(N)n2)=NC(C)=C(C(=O)OC)[C@H]1c1cccc(Cl)c1Cl,C26477098_decoy,CASP3,Decoy,0,-10.0098,-6.47,-2.7,-9.00671276495486
CCCC/N=c1\c(O)c(O)\c1=N/[C@@H](Cc1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1)C(=O)[O-],C25996064_decoy,CASP3,Decoy,0,-8.15535,-6.26,-0.99,-7.191353330481951
CCOC(=O)c1ccc(NC(=O)C[C@@H]2SC([N-]c3ccc(S(N)(=O)=O)cc3)=NC2=O)cc1,C02668709_decoy,CASP3,Decoy,0,-8.03905,-6.34,-0.72,-7.456042664612484
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)n1,C06110427_decoy,CASP3,Decoy,0,-6.73492,-6.82,-0.75,-5.619534943843364
Cn1c(CCNC(=O)c2ccc(Cl)cc2)nnc1SCC(=O)Nc1ccc(C(=O)[O-])cc1,C59179095_decoy,CASP3,Decoy,0,-6.59121,-8.18,-2.78,-7.0016986460898405
CCOc1ccc(N/C(N)=N/c2nc([O-])cc(CSc3nnnn3-c3ccccc3)n2)cc1,C13125591_decoy,CASP3,Decoy,0,-9.40517,-6.68,-1.32,-7.373402279474536
CCOC(=O)c1c(C)[nH]c(C2=NC(=S)N[C@@H](c3ccc(OC)c(OC)c3)/C2=C(/[O-])OCC)c1C,C03268801_decoy,CASP3,Decoy,0,-9.06926,-7.0,-3.32,-7.007732072083941
COc1ccc(CCN2C(=O)[C@](NC(=O)CC(C)C)(C(F)(F)F)c3c2nc(=O)[nH]c3[O-])cc1OC,C01877177_decoy,CASP3,Decoy,0,-8.47439,-6.81,-2.55,-7.271293066846326
CCCCN1C(=O)N=C([O-])[C@H](N(CCC(C)C)CC2=NC(=O)C3=C4CCC[C@@H]4SC3=N2)[C@H]1N,C64012144_decoy,CASP3,Decoy,0,-9.06839,-8.16,-1.52,-7.434296243909657
CCCCNC(=O)CN1CCN(c2ncc(NC(=O)c3ccccc3C)cc2C(=O)[O-])CC1,C64979032_decoy,CASP3,Decoy,0,-8.1048,-6.82,-1.63,-6.865496881217535
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]2OP(=O)([O-])[O-])[C@@H](C)Cl)[NH+](C)C1,C65739430_decoy,CASP3,Decoy,0,-7.36321,-6.69,-2.07,-6.8202460174004536
COc1cc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(Cl)cc3)cc2)ncn1,C66200700_decoy,CASP3,Decoy,0,-8.21723,-7.94,-1.37,-6.577224266971918
CC/C(C[C@H](c1ccccc1)c1c(O)c2ccccc2oc1=O)=N\NC(N)=O,C04579354_decoy,CASP3,Decoy,0,-8.67325,-6.81,-1.67,-7.580477622813585
COc1ccc(CCNC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1OC,C06719743_decoy,CASP3,Decoy,0,-9.39716,-6.27,-3.56,-6.613527688136021
O=C(NNC(=S)NC1CC1)c1ccc(NS(=O)(=O)c2cccs2)cc1,C07505466_decoy,CASP3,Decoy,0,-8.87178,-5.9,-3.04,-7.411930236870694
NC(N)=NS(=O)(=O)c1ccc(/N=C/c2ccc(OCc3ccccc3)cc2)cc1,C01958950_decoy,CASP3,Decoy,0,-7.46901,-6.29,-1.06,-5.232493344292886
CC[C@H](C)Oc1ccc(C(=O)NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1,C10121878_decoy,CASP3,Decoy,0,-9.8931,-5.93,-1.7,-5.469312644116887
CC(C)COc1ccc(C(=O)NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1,C14030380_decoy,CASP3,Decoy,0,-10.3271,-6.29,-0.78,-7.727090343707927
NC(=O)c1cc(-c2csc(NC(=O)CCc3nc4ccccc4s3)n2)c[nH]1,C30982177_decoy,CASP3,Decoy,0,-9.1752,-6.46,-1.09,-6.569158567162944
CC(=O)Nc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1,C31024655_decoy,CASP3,Decoy,0,-7.28479,-7.08,-0.59,-6.186241129952152
C[C@H](O)[C@@H](O)/C=C/C=C/C(=O)O[C@@H]1C=C2CO[C@H](O)[C@]2(O)[C@@]2(C)CCCC(C)(C)[C@H]12,C37538695_decoy,CASP3,Decoy,0,-10.3272,-7.18,-2.25,-7.7499086434306035
COc1ccc(C2=C[C@@H]([C@@H]3NN[C@H](SCc4ccc(C)cc4)N3N)N=N2)cc1,C38984690_decoy,CASP3,Decoy,0,-6.83733,-6.85,-1.78,-5.313419887293543
Cc1ccc2[nH]cc(CCN3C[C@@H](C(=O)N[C@@H]4NN[C@H](C(C)C)S4)CC3=O)c2c1,C39147109_decoy,CASP3,Decoy,0,-6.31979,-7.22,-1.24,-6.280015698429801
NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccnc1OCC(F)(F)F,C39263505_decoy,CASP3,Decoy,0,-7.48274,-7.96,-2.18,-9.029356081622709
CC[C@@H](C)S[C@@H]1NN[C@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1cc(C)ccc1C,C39361827_decoy,CASP3,Decoy,0,-6.85316,-6.47,-3.77,-6.299823540352587
O=C(C[C@H]1CS[C@@H](NC(=O)c2ccco2)N1)NCCc1c[nH]c2ccccc12,C39383966_decoy,CASP3,Decoy,0,-6.49837,-6.75,-1.09,-5.948277744068093
COc1cc(NC(=S)NCc2ccc(S(N)(=O)=O)cc2)c(OC)cc1Cl,C08829883_decoy,CASP3,Decoy,0,-8.75744,-6.94,-2.85,-8.082102323500694
NC(=O)c1c(NC(=O)COC(=O)c2cc(Br)ccc2O)sc2c1CCC2,C39587529_decoy,CASP3,Decoy,0,-8.95955,-7.24,-0.38,-7.967688561904522
CN(Cc1ccccc1)c1ncnc(NNC(=O)c2ccccc2Br)c1N,C40662495_decoy,CASP3,Decoy,0,-6.24993,-7.8,-1.85,-6.076210235782763
CCNC(=O)c1cccc(NC(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1,C41223178_decoy,CASP3,Decoy,0,-6.88651,-8.19,-1.27,-6.703767394669265
NC(=O)CCCNC(=O)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1,C42044508_decoy,CASP3,Decoy,0,-8.64003,-7.16,-1.15,-7.644325351954386
O=C(NCc1ccccc1CN1CCOCC1)NNC(=S)NC1CCCC1,C43863000_decoy,CASP3,Decoy,0,-8.43664,-6.41,-4.33,-6.978991320934549
Cc1ccc(NC(=S)NNC(=O)Cc2csc(NC(=O)C(C)C)n2)cc1,C44883604_decoy,CASP3,Decoy,0,-9.01984,-5.89,-1.16,-8.111357466427336
CC(C)[C@H](NC(=O)Nc1ccccc1CC(N)=O)c1ccc2c(c1)OCCO2,C45725008_decoy,CASP3,Decoy,0,-8.32408,-6.64,-1.47,-6.9475215444239
CCNC(=O)c1ccc(NC(=O)NCCNc2nc3ccccc3s2)cc1,C47008513_decoy,CASP3,Decoy,0,-6.12948,-6.94,-2.04,-5.439802971653438
Cc1cc(OC(C)C)ccc1NC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C48120753_decoy,CASP3,Decoy,0,-7.71569,-6.65,-1.72,-6.353755359546817
CC[C@H](C)NC(=O)c1ccc(NC(=O)N(C)Cc2cccc(C(N)=O)c2)cc1,C54478787_decoy,CASP3,Decoy,0,-8.01428,-7.13,-1.82,-5.762578030952599
O=C(CCNC(=O)NNc1nc(Cl)c(Cl)cc1Cl)NC1CCCC1,C54751767_decoy,CASP3,Decoy,0,-9.27,-5.71,-1.9,-7.460467824108186
NC(=O)c1ccc(NC(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1,C56540668_decoy,CASP3,Decoy,0,-9.44587,-5.82,-3.21,-6.88010696895448
NC(=O)CCOc1ccccc1NC(=O)NCc1ccccc1N1CCCC1,C56716566_decoy,CASP3,Decoy,0,-9.0229,-6.77,-1.06,-7.5459640744664735
NS(=O)(=O)Cc1ccc(C(=O)NCCNc2ncc(Cl)cc2Cl)cc1,C58023890_decoy,CASP3,Decoy,0,-8.66405,-7.07,-3.3,-7.616620018184941
CNC(=S)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)c(C)c2)cc1,C58090115_decoy,CASP3,Decoy,0,-7.68821,-5.63,-0.92,-6.09921360532352
Cc1nn(-c2ccccc2)cc1CCCNC(=O)NCc1cccc(C(N)=O)c1,C61965773_decoy,CASP3,Decoy,0,-7.14002,-7.38,-1.39,-6.203962353826239
CC(C)NC(=O)NNC(=O)c1ccsc1NC(=O)c1ccc(C(C)C)cc1,C63268842_decoy,CASP3,Decoy,0,-6.50078,-5.34,-1.81,-5.306415011925021
Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(C(=O)NCC(N)=O)cc2)c1C,C64797062_decoy,CASP3,Decoy,0,-9.22137,-7.24,-2.1,-5.918475727193516
Cc1cc(OCC(N)=O)ccc1NC(=O)NCc1cccc(OC(F)F)c1,C51618256_decoy,CASP3,Decoy,0,-7.89134,-7.35,-2.31,-6.852711698827487
Cc1cccc(OC[C@H](C)NC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c1,C54611184_decoy,CASP3,Decoy,0,-7.19956,-6.55,-2.78,-7.448245659469688
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)NC1CCCC1,C65918945_decoy,CASP3,Decoy,0,-10.6479,-5.16,-2.74,-7.786725851636284
Cc1cccc(Cn2nccc2NC(=O)C[C@H](NC(N)=O)c2cccs2)c1,C66663864_decoy,CASP3,Decoy,0,-9.30369,-7.9,-1.72,-7.48670520848458
CCOCC(=O)NNC(=O)NC[C@H](c1cccs1)c1c[nH]c2ccccc12,C66688343_decoy,CASP3,Decoy,0,-6.8711,-5.64,-2.5,-5.859818376054752
Cc1[nH]c2ccccc2c1CCNC(=O)NCc1nc(-c2cccs2)n[nH]1,C66703102_decoy,CASP3,Decoy,0,-8.46689,-5.52,-1.05,-6.664499541527059
CC(C)(C)c1ccccc1OCCNC(=O)C(=O)Nc1sccc1C(N)=O,C66721717_decoy,CASP3,Decoy,0,-6.71335,-7.29,-2.09,-6.039089529145463
C[C@H](CC#N)Sc1ccccc1NC(=O)NCCNC(=O)c1ccc(O)cc1,C66955688_decoy,CASP3,Decoy,0,-7.58751,-8.01,-2.42,-7.172178250454605
COc1cc(CNC(=O)NC[C@@]2(O)CCCc3ccccc32)cc(OC)c1O,C66977703_decoy,CASP3,Decoy,0,-8.71334,-6.88,-2.48,-6.895576168965496
Cc1ccc(NC(=O)CCNC(=O)NC[C@]2(O)CCCc3ccccc32)nc1,C66978075_decoy,CASP3,Decoy,0,-7.56299,-8.42,-1.83,-6.653878425062207
Cc1ccc(NC(=O)CCNC(=O)NC[C@@]2(O)CCCc3ccccc32)nc1,C66978076_decoy,CASP3,Decoy,0,-7.16986,-6.69,-2.15,-5.5411103662268
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)CC2CCCCC2)c1,C67060421_decoy,CASP3,Decoy,0,-7.79528,-6.21,-4.17,-7.61221461614866
CNC(=O)c1ccc(NC(=O)NCc2cccc(C(=O)NC(C)C)c2)c(C)c1,C67261564_decoy,CASP3,Decoy,0,-7.25486,-6.53,-4.02,-6.545168854545238
CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1C,C67338098_decoy,CASP3,Decoy,0,-6.55297,-7.77,-2.45,-5.466977591859788
C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1,C67396901_decoy,CASP3,Decoy,0,-7.55688,-7.96,-1.65,-6.690734732812068
CC(C)(C)SCCNC(=O)NCc1cccc([C@]2(C)NC(=O)NC2=O)c1,C67418422_decoy,CASP3,Decoy,0,-7.33857,-6.92,-1.27,-8.788885261295254
CNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](O)COc2c(C)cccc2C)c1,C67564473_decoy,CASP3,Decoy,0,-7.62105,-6.35,-2.19,-6.303800937576463
CC(=O)Nc1ccc(NC(=O)/C=C(\C)NNC(=O)COc2ccc(Br)cc2C)cc1,C03081471_decoy,CASP3,Decoy,0,-7.6813,-7.13,-2.53,-6.523107181140512
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCC)cc1,C00694568_decoy,CASP3,Decoy,0,-5.10832,-7.26,-2.09,-8.215808677054119
CC(C)CN(C(=O)CSc1nc2ccccc2[nH]1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C09126797_decoy,CASP3,Decoy,0,-6.26923,-6.79,-2.04,-5.501862665550749
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=S)NC[C@H]3CCCO3)ccc2C)c1,C09613243_decoy,CASP3,Decoy,0,-9.25626,-7.37,-3.46,-7.081883209184328
O=C(Cc1csc(NC(=O)NCc2ccco2)n1)NCCc1c[nH]c2ccccc12,C09785892_decoy,CASP3,Decoy,0,-7.7336,-6.63,-0.72,-6.586425011269827
CC(=O)O[C@H](CCc1ccc(O)c(O)c1)C[C@@H](CCc1ccc(O)c(O)c1)OC(C)=O,C13377915_decoy,CASP3,Decoy,0,-8.87633,-7.61,-5.37,-9.608640225851351
Cc1cc(C)nc(N/C(=N/C(=S)NCc2ccco2)NCCc2c[nH]c3ccc(F)cc23)n1,C14158802_decoy,CASP3,Decoy,0,-9.0565,-7.81,-2.02,-7.403029535045811
CCCCN(C(=O)CCc1c[nH]c2ccccc12)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14720416_decoy,CASP3,Decoy,0,-6.88255,-6.46,-0.59,-6.668843673391007
COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)OCc2nc(N)nc(Nc3ccc(C)cc3)n2)cc1,C16858752_decoy,CASP3,Decoy,0,-8.28842,-7.2,-1.28,-6.643977365355847
Cc1ccc(NC(=O)CSc2nnc(N/N=C/c3ccc(N(C)C)cc3)n2N)c(C)c1,C20527593_decoy,CASP3,Decoy,0,-9.71949,-6.8,-2.21,-8.390654028198542
COc1ccc(CNC(=O)CSc2nnc(N/N=C/c3ccc(Cl)cc3)n2N)cc1,C20528296_decoy,CASP3,Decoy,0,-8.44185,-6.21,-1.22,-5.72865931924829
CC[C@H](C)c1ccc(NC(=O)CSc2nnc(N/N=C/c3c(C)nn(C(C)C)c3C)n2N)cc1,C20805378_decoy,CASP3,Decoy,0,-9.05568,-8.57,-2.13,-6.817164278650238
CC(=O)c1ccc(NC(=O)CSc2nnc(N/N=C/c3cccc4ccccc34)n2N)cc1,C20805757_decoy,CASP3,Decoy,0,-6.49603,-5.09,-1.9,-5.030813736271447
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)CSc3nnc(C(C)(C)C)n3N)cc2)cc1,C20841920_decoy,CASP3,Decoy,0,-7.17095,-7.88,-1.76,-5.745706007629846
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccccc3Cl)n2N)cc1,C20913301_decoy,CASP3,Decoy,0,-9.66901,-6.79,-1.25,-7.083596087322374
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCCc3ccc(F)cc3)n2N)cc1,C20913483_decoy,CASP3,Decoy,0,-7.15275,-5.45,-2.16,-5.775691640067114
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCCc3ccccc3Cl)n2N)cc1,C20913532_decoy,CASP3,Decoy,0,-8.63641,-7.84,-3.37,-7.907791959962092
Cc1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccccc3Cl)n2N)cc1,C20917150_decoy,CASP3,Decoy,0,-8.55731,-5.66,-3.47,-5.730990158063154
Nn1c(NN=C(Cc2ccccc2)Cc2ccccc2)nnc1SCCC(=O)Nc1ccccn1,C20919140_decoy,CASP3,Decoy,0,-8.65251,-7.62,-3.97,-6.479839857797817
CC[C@@H](C)c1ccc(NC(=O)CSc2nnc(N/N=C/c3cccs3)n2N)cc1,C21317923_decoy,CASP3,Decoy,0,-8.92985,-6.49,-1.85,-6.584337068416476
Nn1c(N/N=C/c2cccc(Cl)c2)nnc1SCC(=O)Nc1ccc(OC(F)(F)F)cc1,C21321758_decoy,CASP3,Decoy,0,-7.11287,-6.5,-1.54,-5.238697754137546
C/C(=N\Nc1nnc(SCC(=O)NCc2ccc(C)cc2)n1N)c1ccc2ccccc2c1,C21323696_decoy,CASP3,Decoy,0,-7.3892,-7.96,-2.25,-5.764251502002423
Nn1c(NN=C2CCCCC2)nnc1SCC(=O)Nc1nnc(SCc2ccccc2)s1,C21327382_decoy,CASP3,Decoy,0,-8.21626,-6.85,-1.35,-5.928776650198145
N#Cc1c(CCCNc2nc(CN3CCOCC3)nc3scc(-c4cccs4)c23)n[nH]c1N,C22089612_decoy,CASP3,Decoy,0,-10.1128,-6.7,-2.13,-7.813409753509181
NC(=O)CCc1nnc(SCc2nc(N)c3c4c(sc3n2)CCCCC4)n1Cc1ccco1,C22749828_decoy,CASP3,Decoy,0,-8.53998,-7.56,-1.55,-7.45401867087892
NC(=O)c1c(NC(=O)COC(=O)CNC(=O)C23CC4CC(CC(C4)C2)C3)sc2c1CCC2,C34718150_decoy,CASP3,Decoy,0,-9.16151,-8.06,-1.84,-7.614751784978923
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(Cc1ccco1)C(=O)c1c(O)cccc1O,C36500686_decoy,CASP3,Decoy,0,-8.0996,-5.94,-3.55,-6.765230891863404
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)c1ccc(OC)cc1,C36568245_decoy,CASP3,Decoy,0,-8.06638,-6.74,-0.64,-7.071859094453004
CCCN(C(=O)c1cccc(O)c1O)[C@@H](C(=O)NC(C)(C)C)c1ccc(O)c(OC)c1,C36571467_decoy,CASP3,Decoy,0,-8.0491,-5.53,-0.57,-6.61345592840869
Cc1ccccc1Nc1nc(N)nc(CSc2nc3ccccc3c(=O)n2CCCO)n1,C03455080_decoy,CASP3,Decoy,0,-8.36696,-7.29,-1.9,-6.827814908400256
COc1ccc(C(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(OC)cc4)N=N3)N2N)cc1,C38748317_decoy,CASP3,Decoy,0,-6.87154,-6.67,-1.3,-6.325614411988073
CCCC[C@H]1NN[C@@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(OC)cc34)C2)S1,C39147151_decoy,CASP3,Decoy,0,-7.14988,-6.47,-1.21,-6.221501924029502
CCC[C@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(OC)cc34)C2)S1,C39252486_decoy,CASP3,Decoy,0,-7.92136,-6.17,-2.21,-6.098132626862327
Cc1cccc(C(=O)N[C@@H](C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)C(C)C)c1,C39658745_decoy,CASP3,Decoy,0,-7.90592,-8.09,-1.55,-6.892049190714137
CCCCCOc1ccccc1Cn1c(S[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)nc2ccccc21,C39915889_decoy,CASP3,Decoy,0,-8.31768,-7.13,-1.96,-7.701573210281172
Cc1ccccc1OCCCn1c(S[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)nc2ccccc21,C39916010_decoy,CASP3,Decoy,0,-8.41555,-7.39,-2.37,-8.490994863170087
CCOCCCNC(=O)c1c(NC(=O)c2cc(-c3ccccc3O)n[nH]2)sc2c1CCCC2,C40549078_decoy,CASP3,Decoy,0,-8.13978,-7.72,-3.43,-6.965512506243293
Cc1cc(NC(=O)c2ccco2)sc1C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C45670060_decoy,CASP3,Decoy,0,-9.79767,-8.35,-1.23,-7.7045491365565555
NC(=O)CNC(=O)c1cccc(NC(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccs2)c1,C46793401_decoy,CASP3,Decoy,0,-11.7282,-6.81,-3.43,-9.912875390370242
Cc1ccc(-c2csc3ncn(CC(=O)NCCCCCc4[nH]nc(N)c4C#N)c(=O)c23)cc1,C09377084_decoy,CASP3,Decoy,0,-8.2859,-1.44,-2.04,-4.227452811707244
NC(=O)c1c(NC(=O)COC(=O)c2cccnc2Nc2ccccc2F)sc2c1CCC2,C15821818_decoy,CASP3,Decoy,0,-8.10053,-8.11,-2.0,-8.610696183418163
Cc1ccc(C(C)C)c(OCc2nnc(SCC(=O)NC(=O)N[C@@H]3CCCC[C@H]3C)n2N)c1,C26109627_decoy,CASP3,Decoy,0,-8.16893,-5.65,-0.84,-6.277803437601964
CC(C)[C@H](NCC(=O)NCCc1ccc(S(N)(=O)=O)cc1)c1ccc2c(c1)OCCCO2,C16695044_decoy,CASP3,Decoy,0,-10.2134,-6.5,-2.76,-7.8167729806754656
CCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(O)cc2)n1,C59015492_decoy,CASP3,Decoy,0,-8.10131,-5.38,-1.86,-5.691367133869063
CCOc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)cc3C)n[nH]2)ccc1O,C59039727_decoy,CASP3,Decoy,0,-7.615,-6.92,-3.63,-6.0942270865604256
CCOc1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(Cl)cc3C)n[nH]2)ccc1O,C59039815_decoy,CASP3,Decoy,0,-9.90073,-6.6,-1.47,-6.977135967635185
C[C@@H](Sc1n[nH]c(N/N=C/c2c3ccccc3cc3ccccc23)n1)C(=O)NNC(=O)C1CCC1,C59879690_decoy,CASP3,Decoy,0,-10.2892,-9.45,-2.66,-9.122340455529796
CC/C(C)=N/Nc1nc(SCC(=O)Nc2ccc(S(=O)(=O)N[C@H](C)CC)cc2)n[nH]1,C59888975_decoy,CASP3,Decoy,0,-7.43963,-6.34,-2.67,-5.7504465265250655
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)CSc3nnc(C(C)C)n3N)cc2)c1,C59913673_decoy,CASP3,Decoy,0,-8.4465,-5.89,-1.6,-6.527874575472322
CCC[C@@H](CNC(=O)c1[nH]c(C)c(C(C)=O)c1C)NC(=O)c1[nH]c(C)c(C(C)=O)c1C,C60342413_decoy,CASP3,Decoy,0,-6.92462,-7.07,-2.57,-6.977501244475583
CCOC(=O)c1c(NC(=O)C[C@H]([NH2+]CCC[NH+](C)C)C(=O)[O-])sc2c1CCCC2,C05258932_decoy,CASP3,Decoy,0,-8.00993,-5.45,-0.77,-6.191525822078713
COc1cc(C(=O)OCCCC[NH2+][C@@H](C)[C@@H](O)c2ccc(O)cc2)cc(OC)c1OC,C05607720_decoy,CASP3,Decoy,0,-6.92961,-6.54,-1.12,-6.091936854462123
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CC(C)(C)[NH2+]C3(C)C)cc1,C04177794_decoy,CASP3,Decoy,0,-8.44598,-5.88,-4.0,-5.644961975117356
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(CC)c4ccccc4)cc3)c2C(N)=O)C1,C09383396_decoy,CASP3,Decoy,0,-7.87796,-7.43,-4.4,-6.109916872726215
CCCCN(C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](CCC)C3)cc1,C09391463_decoy,CASP3,Decoy,0,-8.32628,-6.83,-1.65,-5.513345534774453
CCCCN(C(=O)C[NH+](Cc1c(F)cccc1Cl)C1CC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C09461603_decoy,CASP3,Decoy,0,-8.24631,-5.44,-2.15,-6.274776383189107
COc1cccc([C@@H](C[NH2+]C[C@@H](O)CO[C@@H]2CCCc3ccccc32)c2c[nH]c3ccccc23)c1OC,C12540128_decoy,CASP3,Decoy,0,-7.42372,-7.21,-4.02,-6.830229500213329
[NH2+]=C(NCCCc1c[nH]cn1)NCC[C@H](c1cc(Cl)cc(Cl)c1)c1ccccn1,C13816136_decoy,CASP3,Decoy,0,-8.76431,-6.39,-3.47,-6.885788323850231
CCCCN(C(=O)C[NH+](Cc1ccccc1)C(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14129413_decoy,CASP3,Decoy,0,-7.61091,-6.13,-2.26,-8.044982250121716
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCC(=O)NCC2([NH+]3CCCCC3)CCCCC2)cc1,C14231612_decoy,CASP3,Decoy,0,-7.44094,-6.34,-2.27,-5.512204739951732
COc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)cc(Br)c1OCC(N)=O,C16195361_decoy,CASP3,Decoy,0,-7.11901,-5.67,-2.93,-5.329531578538066
CCOc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)cc(Cl)c1OCC(N)=O,C16688339_decoy,CASP3,Decoy,0,-9.28033,-4.64,-1.39,-6.421105214017876
CCCCN(C(=O)C[NH+](Cc1ccccc1)Cc1ccco1)c1c(N)n(CCC)c(=O)[nH]c1=O,C19535988_decoy,CASP3,Decoy,0,-7.99168,-5.81,-2.63,-6.978520018331853
COc1cc(C[NH2+]C[C@@H](C)O)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCCO2,C20877159_decoy,CASP3,Decoy,0,-7.53019,-6.42,-2.64,-5.806753344903902
CC1(C)CC(NC(=O)CSc2nnc(NN=C(Cc3ccccc3)Cc3ccccc3)n2N)CC(C)(C)[NH2+]1,C20919327_decoy,CASP3,Decoy,0,-7.65818,-7.46,-2.97,-6.189945882597657
CCCCN(C(=O)C[NH+](C)Cc1ccc(Br)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C21134126_decoy,CASP3,Decoy,0,-7.93731,-5.63,-2.94,-6.528943479785813
COC(=O)c1cnn(-c2ccc(C(=O)NCCC[NH+]3CCC(Cc4ccccc4)CC3)cc2)c1N,C21652414_decoy,CASP3,Decoy,0,-7.05659,-8.89,-2.46,-7.155146803983646
Cc1ccccc1OC[C@@H](O)C[NH2+]CCN1CCN(C[C@@H](O)COc2ccccc2C)CC1,C22924121_decoy,CASP3,Decoy,0,-7.49404,-5.68,-1.9,-5.3132008423571735
CCCCN(C(=O)C[NH+](C)[C@@H](C)c1ccc(F)c(F)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C23667578_decoy,CASP3,Decoy,0,-7.41788,-6.02,-2.95,-5.9830061668643095
COc1ccc(CC[NH2+]C[C@H](O)COc2ccc(-c3nc(-c4cccs4)c[nH]3)cn2)cc1OC,C26014442_decoy,CASP3,Decoy,0,-9.59095,-6.71,-3.77,-6.242724300045381
CNC(=O)c1ccc(C[NH+](CC(=O)NC(=O)NCc2cccs2)Cc2ccco2)cc1,C26925850_decoy,CASP3,Decoy,0,-9.41411,-7.28,-2.48,-8.370926667887105
O=C(C[NH+](Cc1ccc(C(=O)NC2CC2)cc1)Cc1ccco1)NC(=O)NCc1ccco1,C27575991_decoy,CASP3,Decoy,0,-7.6295,-7.21,-1.73,-6.929317683712444
CCCCN(C(=O)C[NH+](C)CCCOc1ccc(F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C30267746_decoy,CASP3,Decoy,0,-7.50437,-5.37,-2.81,-5.96749732034418
CNC(=O)CN(C)C(=O)c1ccc(N2CC[NH2+]CC2)c(NS(=O)(=O)c2ccc(CC(C)C)cc2)c1,C33033445_decoy,CASP3,Decoy,0,-7.96575,-6.29,-3.44,-7.439839672981173
CCCCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1csc([C@H]2CCC[NH2+]C2)n1,C34379059_decoy,CASP3,Decoy,0,-7.75521,-7.05,-1.21,-6.754500659943399
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,CASP3,Decoy,0,-9.57682,-7.46,-0.81,-7.800930159090762
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(OCC)c(OCC)c3)c2C(N)=O)C1,C36629246_decoy,CASP3,Decoy,0,-8.16808,-5.67,-1.42,-5.173938069267691
O=C(NCCc1c[nH]c2ccccc12)C(=O)NC[C@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1,C08683842_decoy,CASP3,Decoy,0,-7.33064,-8.57,-5.12,-6.562669039792073
Cn1cc(C(F)(F)F)nc1-c1ccc(OC[C@H](O)C[NH2+]CCOc2ccc(O)c(C(N)=O)c2)cc1,C02569823_decoy,CASP3,Decoy,0,-8.21518,-6.78,-2.5,-6.475028590795861
CCOC(=O)C1=C(C[NH2+]CCc2ccc(Cl)cc2)NC(=O)N[C@H]1c1ccc2c(c1)OCO2,C04195617_decoy,CASP3,Decoy,0,-9.31086,-7.03,-1.64,-7.876405703060421
CCCCN1C(=O)NC(=O)[C@@H](N(CCC(C)C)C(=O)Cc2c[nH]c3ccccc23)[C@H]1[NH3+],C38509846_decoy,CASP3,Decoy,0,-7.42858,-7.31,-1.49,-7.001092885315824
COc1ccc([C@H]2NN(c3ccccc3)C[C@@H]2C[NH2+]CCSc2cnn[nH]2)c(F)c1,C39479190_decoy,CASP3,Decoy,0,-8.22604,-6.7,-3.19,-6.832476762541615
CO[C@@H]1C[NH+]([C@@H](CNc2ccccc2O)c2ccc(S(=O)(=O)Oc3ccccc3)cc2)CCN1,C39534249_decoy,CASP3,Decoy,0,-7.31839,-6.18,-2.91,-8.664290701714574
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39631569_decoy,CASP3,Decoy,0,-7.89778,-5.27,-1.72,-6.081929601106898
CCSc1ncccc1C(=O)N1C[C@H](C(=O)N[C@H](C)CCCC(C)(C)O)C2(CC[NH2+]CC2)C1,C39631740_decoy,CASP3,Decoy,0,-8.79647,-6.09,-4.25,-7.315861453089347
COc1ccc(CCC(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1,C39632029_decoy,CASP3,Decoy,0,-10.1002,-7.19,-1.4,-7.872401882922627
O=C(NCc1ccccc1Sc1ccccc1CO)[C@@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39657697_decoy,CASP3,Decoy,0,-9.77221,-6.98,-2.06,-6.951027119296775
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NCc2ccccc2Sc2ccccc2CO)C2(CC[NH2+]CC2)C1,C39657783_decoy,CASP3,Decoy,0,-8.46374,-7.6,-3.13,-7.062251395011778
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,C39685855_decoy,CASP3,Decoy,0,-7.5028,-6.57,-1.98,-6.3048493441413065
Cc1ccc(Oc2ncccc2C(=O)N2C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)cc1,C39693514_decoy,CASP3,Decoy,0,-7.73452,-7.56,-1.62,-6.949979428430058
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@H]1NN[C@H](c2ccc(OC)cc2)[NH+]1CC(=O)[O-],C39708417_decoy,CASP3,Decoy,0,-7.48022,-6.84,-1.26,-10.760100696035533
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,CASP3,Decoy,0,-9.09498,-5.82,-1.37,-7.135049755512857
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,C43548608_decoy,CASP3,Decoy,0,-9.67901,-5.39,-2.38,-6.892232053074706
CC[NH+](CC)CCCNC(=O)C1CCN(C(=O)NCCNC(=O)OC(C)(C)C)CC1,C58167225_decoy,CASP3,Decoy,0,-7.66362,-5.3,-3.18,-5.494232743041203
Cc1ccc(S(=O)(=O)NCCNC(=O)NC[C@@H](C(C)C)[NH+]2CCCCCC2)cc1,C59296883_decoy,CASP3,Decoy,0,-8.49062,-7.43,-2.94,-7.300388782382214
COc1ccc(OC)c(NC(=S)/N=C(\NCCc2c[nH]c[nH+]2)Nc2nc(C)cc(C)n2)c1,C14156524_decoy,CASP3,Decoy,0,-10.0208,-6.62,-1.54,-7.9213230660049
COc1ccc(NC(=S)/N=C(\NCCC2=c3cc(OC)ccc3=[NH+]C2)Nc2nc(C)cc(C)n2)cc1,C63491528_decoy,CASP3,Decoy,0,-7.6439,-5.74,-2.96,-4.840382544845516
[H]/N=C(\Nc1nc(C)cc(C)n1)N(CCC1=c2ccccc2=[NH+]C1)C(=S)Nc1ccccc1,C63677516_decoy,CASP3,Decoy,0,-7.51,-6.04,-2.72,-5.602446640064912
O=C(CS[C@@H]1Nc2ccccc2C(=O)N1NC(=O)CCC1=c2ccccc2=[NH+]C1)NCc1ccco1,C63708488_decoy,CASP3,Decoy,0,-8.61601,-6.26,-3.66,-7.69026977732583
COc1ccc(OC)c2[nH]c(C(=O)NCCNC(=O)CCC3=c4ccccc4=[NH+]C3)cc12,C63818845_decoy,CASP3,Decoy,0,-6.17913,-7.16,-2.04,-6.58840705877467
CCOC(=O)[C@@]1(C)C=C(Nc2ccc(C(N)=O)cc2)C(=O)N1c1ccccc1,C01828010_decoy,CASP3,Decoy,0,-8.51413,-7.08,-1.09,-7.069807651300976
O=C(N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1,C03236406_decoy,CASP3,Decoy,0,-5.63108,-6.34,-2.54,-6.868588610527421
CCCn1c(N)c(C(=O)CSc2nc3cc(Cl)ccc3s2)c(=O)[nH]c1=O,C05780556_decoy,CASP3,Decoy,0,-7.62275,-6.75,-1.15,-6.164317127787422
C[C@H](OC(=O)c1c2c(nc3ccccc13)CCC2)C(=O)Nc1sccc1C(N)=O,C07119897_decoy,CASP3,Decoy,0,-8.14408,-8.31,-1.81,-8.774081029820625
COC(=O)c1c(NC(=O)CSc2nnc(N)s2)sc2c1CCCC2,C07535109_decoy,CASP3,Decoy,0,-9.51388,-6.18,-2.61,-6.470251614628581
C[C@@H]1Cc2cc(C(=O)NNC(=S)NC3CCCC3)ccc2N1S(C)(=O)=O,C08016958_decoy,CASP3,Decoy,0,-6.63371,-5.89,-0.75,-5.835616860076345
NC(=O)NC(=O)[C@H](Sc1nnc(-c2cccs2)n1C1CC1)c1ccccc1,C09578830_decoy,CASP3,Decoy,0,-8.86154,-8.29,-0.9,-8.81050859269161
NC(=O)c1ccsc1NC(=O)COC(=O)c1cc2c(s1)-c1ccccc1OC2,C09815991_decoy,CASP3,Decoy,0,-8.63941,-6.56,-2.21,-5.45913720650763
Cc1nc(-c2ccc(CCNC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)cs1,C12620954_decoy,CASP3,Decoy,0,-5.96997,-6.69,-1.99,-5.195037878080817
NC(=O)c1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)cc1,C12605359_decoy,CASP3,Decoy,0,-7.96727,-6.62,-3.57,-6.904183201008997
Cc1ccc(-c2cc(C(=O)NCc3cccc(NS(C)(=O)=O)c3)[nH]n2)cc1,C10547797_decoy,CASP3,Decoy,0,-7.92548,-7.4,-1.77,-6.659694885543155
Cc1ccc([C@@](O)(CC(=O)NNC(=O)c2oc3ccccc3c2C)C(F)(F)F)o1,C14241834_decoy,CASP3,Decoy,0,-6.14772,-6.63,-1.29,-5.381195511741602
Cc1ccc(OCc2nc(C(=O)Nc3ccc(S(N)(=O)=O)cc3)cs2)cc1,C16201761_decoy,CASP3,Decoy,0,-9.28318,-6.5,-1.57,-6.800312222042643
C/C(=N\NS(=O)(=O)c1ccc(Cl)cc1)c1ccc(OCC(N)=O)cc1,C17078026_decoy,CASP3,Decoy,0,-8.55104,-6.76,-1.74,-6.936506727651357
O=C(COC(=O)CC12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2)NC(=O)NC1CCCC1,C07999344_decoy,CASP3,Decoy,0,-7.58591,-7.53,-1.77,-6.0070077211600506
COc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1COCC(F)(F)F,C05130567_decoy,CASP3,Decoy,0,-7.14194,-7.01,-1.82,-6.0275500668615525
Cc1occc1-c1nnc(S[C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)n1N,C22710776_decoy,CASP3,Decoy,0,-6.8829,-6.51,-1.72,-5.589489953831765
Cc1occc1-c1nnc(S[C@@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)n1N,C22710783_decoy,CASP3,Decoy,0,-9.17583,-7.55,-5.72,-6.125377566755857
O=C(Nc1ccc(C(=O)NCCc2nc3ccccc3[nH]2)s1)c1ccco1,C23697260_decoy,CASP3,Decoy,0,-6.91441,-6.25,-2.44,-5.670740674051815
O=C1N/C(=C\c2c[nH]c3ccccc23)C(=O)N1C[C@H](O)COc1ccccc1F,C24843910_decoy,CASP3,Decoy,0,-7.99909,-6.88,-3.28,-5.9111814894210175
Cc1ccc(C(=O)N[C@H](C(=O)NC2CC2)C2CCN(C(=O)NC(C)C)CC2)cc1,C36213736_decoy,CASP3,Decoy,0,-7.73876,-7.49,-1.99,-8.364582990119901
Cc1n[nH]c(CCNC(=O)c2ccc3c(c2)O[C@H](Cc2cccc(Cl)c2)N3)n1,C39509667_decoy,CASP3,Decoy,0,-7.12568,-6.7,-3.45,-5.539105273084999
CC[C@@H](NC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc(C)cc1,C40068991_decoy,CASP3,Decoy,0,-7.16637,-7.38,-2.23,-6.549660446655124
C[C@H](Sc1nnc(Nc2ccccc2)s1)C(=O)N1CCC[C@H](C(N)=O)C1,C42208363_decoy,CASP3,Decoy,0,-9.40535,-5.38,-1.51,-5.888513562005231
Cc1ccc(C(=O)NCCNC(=O)Nc2ccccc2N2CCCC2=O)cc1F,C43852417_decoy,CASP3,Decoy,0,-5.81749,-8.1,-0.6,-5.962503593536549
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=S)NNC(=O)Cn1ncc2ccccc2c1=O,C44744535_decoy,CASP3,Decoy,0,-6.35786,-6.22,-1.0,-4.761220922330586
Cc1c(Cl)cccc1NNC(=O)NC[C@@H]([C@@H]1CCOC1)N1CCOCC1,C45537065_decoy,CASP3,Decoy,0,-7.98152,-6.18,-3.13,-6.276416420760437
C[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccc(OC(F)(F)F)cc1,C45680353_decoy,CASP3,Decoy,0,-7.34622,-6.82,-0.51,-7.171004793105445
Cc1cccc([C@H](CNC(=O)NNc2cccc(C#N)c2)N2CCOCC2)c1,C46249481_decoy,CASP3,Decoy,0,-7.56686,-6.75,-2.51,-6.691444575850034
Cc1oc(C)c(C(=O)NCCCc2nn(-c3ccc(F)cc3)c(N)c2C#N)c1C,C46680369_decoy,CASP3,Decoy,0,-7.35953,-6.38,-1.38,-5.990017645237728
Cc1ccc(C(=O)NCCNC(=O)Nc2ccccc2-n2cccn2)cc1F,C48152494_decoy,CASP3,Decoy,0,-5.91998,-7.48,-0.93,-5.558497164586759
CC(C)(C)OC(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1,C17398309_decoy,CASP3,Decoy,0,-6.62269,-5.07,-3.39,-5.204919818816275
NC(=O)COc1ccc(/C=C/C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1,C58567104_decoy,CASP3,Decoy,0,-6.82331,-7.23,-0.57,-6.089399266360527
O=C(CSc1nc(-c2cccc(Cl)c2)n[nH]1)NNC(=O)C(F)(F)F,C59793937_decoy,CASP3,Decoy,0,-6.34162,-6.09,-1.09,-4.819588190456546
Cc1ccc(Nc2nnc(SCC(=O)N3CCC(C(N)=O)CC3)s2)cc1,C60382749_decoy,CASP3,Decoy,0,-7.07566,-7.05,-0.51,-4.9541782326037
N#Cc1c(F)cccc1NCCNC(=O)Nc1ccc(F)c(N2CCCC2=O)c1,C48232519_decoy,CASP3,Decoy,0,-8.14487,-7.57,-2.05,-5.879733167965967
COc1ccc([C@H]2N=C(CS[C@@H]3[NH+]=c4cc[nH+]cc4=[NH+]3)[C@H](C)O2)cc1OC,C63513636_decoy,CASP3,Decoy,0,-5.91961,-7.14,-4.78,-5.515689251924321
CCCCNC(=O)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O,C64882925_decoy,CASP3,Decoy,0,-6.32961,-7.02,-2.08,-6.25421684478752
COc1c(C)cnc(CNC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c1C,C51335184_decoy,CASP3,Decoy,0,-7.28597,-6.65,-1.8,-5.724015850126846
CSc1cccc(NC(=O)NCCNc2cc(N3CCCC3)nc(C)n2)c1,C65362113_decoy,CASP3,Decoy,0,-8.29449,-6.02,-1.44,-6.845727249092078
Cc1ccc(C(=O)NC2CCN(C(=O)NCCCc3cn[nH]c3C)CC2)s1,C51674642_decoy,CASP3,Decoy,0,-8.32409,-6.03,-3.23,-5.658723912153825
COCCNC(=O)CCNC(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1,C54749935_decoy,CASP3,Decoy,0,-7.61327,-5.98,-1.5,-6.462513593706947
CC(C)(C)C1CCC2(CC1)NC(=O)N(CN1CCC[C@H](CCC(N)=O)C1)C2=O,C66080615_decoy,CASP3,Decoy,0,-9.60793,-7.56,-2.54,-7.672005462921462
Cc1ccc(NC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc1OCC(F)F,C66241694_decoy,CASP3,Decoy,0,-6.27495,-6.3,-1.06,-6.897396174879815
CNC(=O)c1ccc(CN(C)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1,C66686210_decoy,CASP3,Decoy,0,-7.4475,-7.29,-4.74,-7.31372773395954
O=C(NCc1nc(-c2cccs2)n[nH]1)N[C@@H](c1ccccc1)c1ccncc1,C66703526_decoy,CASP3,Decoy,0,-9.15814,-7.65,-1.65,-9.362002320326884
CCCNC(=O)NC(C)(C)C(=O)N1CCC(NC(=O)CC2CCCC2)CC1,C66840631_decoy,CASP3,Decoy,0,-7.20805,-6.47,-1.59,-6.350916237185176
C=CCNC(=O)NC(=O)[C@H](C)N1CCC(NC(=O)CC2CCCCC2)CC1,C66902549_decoy,CASP3,Decoy,0,-7.80007,-5.66,-2.2,-5.866224853978093
Cc1cccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1,C67063191_decoy,CASP3,Decoy,0,-7.53257,-6.61,-1.92,-5.493805403283731
O=C(NCCCc1nnc2n1CCCCC2)NCCc1c[nH]c2ccccc12,C67381003_decoy,CASP3,Decoy,0,-6.22908,-6.2,-1.84,-5.64296382786306
C=CCn1c(S[C@@H](C(=O)NC(N)=O)C(C)C)nc2sc(C)c(C)c2c1=O,C05212667_decoy,CASP3,Decoy,0,-7.86765,-7.48,-1.86,-8.019399541829342
NC(=O)c1c(NC(=O)COC(=O)c2ccc(Cl)nc2)sc2c1CCCC2,C03331782_decoy,CASP3,Decoy,0,-7.48405,-5.56,-1.39,-6.169853368890242
NC(=O)c1ccc(NC(=O)COC(=O)c2csc(-c3cccs3)n2)cc1,C07074681_decoy,CASP3,Decoy,0,-10.302,-6.76,-0.97,-7.573855560517191
NC(=O)NC(=O)[C@H](Sc1nnc(C2CC2)n1-c1ccccc1)c1ccccc1,C09514549_decoy,CASP3,Decoy,0,-10.6404,-7.37,-1.06,-9.695810422912247
Cc1ccc(-c2nnc(SCC(=O)Nc3ccc(C(N)=O)cc3)n2C)cc1,C08131013_decoy,CASP3,Decoy,0,-7.63088,-7.56,-1.12,-6.528559047899545
CCOC(=O)N1CCc2c(sc(NC(=O)Cc3ccc(C)c(C)c3)c2C(N)=O)C1,C10702745_decoy,CASP3,Decoy,0,-8.27205,-6.64,-2.56,-6.216994452258794
COc1cc(C(=O)Nc2nc3c(s2)CCCCC3)cc(Cl)c1OCC(N)=O,C12821818_decoy,CASP3,Decoy,0,-7.25568,-6.22,-0.5,-5.822965474939876
CCCn1c(N)c(C(=O)COc2ccc(Cl)cc2Br)c(=O)[nH]c1=O,C12909445_decoy,CASP3,Decoy,0,-6.56052,-6.99,-0.86,-6.074007483352138
Cc1ccc(-n2c(N)cc(=O)nc2SCC(=O)NCc2ccco2)cc1C,C05143630_decoy,CASP3,Decoy,0,-7.43747,-6.64,-1.25,-6.196237411050342
CS(=O)(=O)Nc1nc2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2s1,C13692326_decoy,CASP3,Decoy,0,-6.60378,-8.53,-1.96,-5.508490107196997
O=C(NNC(=S)NC1CCCC1)c1cccc(N2CCCS2(=O)=O)c1,C14394150_decoy,CASP3,Decoy,0,-8.6719,-5.82,-0.35,-7.997146456293168
C[C@@H]1[C@H](C)CCC[C@H]1NC(=S)NNC(=O)Cn1c(=O)n(C)c2ccccc21,C14394600_decoy,CASP3,Decoy,0,-7.68188,-5.46,-0.66,-7.483482825616493
Cc1cc(N)nc(SCC(=O)NCC2(N3CCOCC3)CCCCC2)n1,C22133195_decoy,CASP3,Decoy,0,-8.2831,-6.88,-2.52,-7.837385966870879
C[C@H](Sc1nnc2ccc(C(F)(F)F)cn12)C(=O)Nc1sccc1C(N)=O,C24146591_decoy,CASP3,Decoy,0,-7.23494,-7.16,-1.52,-6.509767284494159
C[C@H](Sc1nc(-c2ccccc2F)n[nH]1)C(=O)NC(=O)NCC(F)(F)F,C24897352_decoy,CASP3,Decoy,0,-6.95411,-5.75,-0.42,-5.2378191616806085
Nc1nnc(SCC(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)s1,C03345644_decoy,CASP3,Decoy,0,-7.37285,-7.13,-0.5,-6.286037830789741
O=C(CSc1ncn[nH]1)N[C@H]1SC2=C(CCCC2)[C@H]1C(=O)Nc1ccccc1,C38685110_decoy,CASP3,Decoy,0,-7.3972,-7.79,-0.97,-6.6620919980170346
C[C@@H](Sc1nnc(Nc2ccccc2)s1)C(=O)N1CCC[C@H](C(N)=O)C1,C42208367_decoy,CASP3,Decoy,0,-9.21235,-6.59,-0.05,-5.325342140618912
CCCc1cc(=O)[nH]c(S[C@@H](C(=O)N2CCC[C@@H](C(N)=O)C2)C(C)C)n1,C42939825_decoy,CASP3,Decoy,0,-7.69273,-5.29,-1.17,-6.507895023120242
CCC(C)(C)C1CCC(NC(=O)NNC(=O)C[C@H]2CCS(=O)(=O)C2)CC1,C43863074_decoy,CASP3,Decoy,0,-8.4516,-7.08,-1.38,-6.185377392964379
Cc1ccc(C)c(NC(=S)NNC(=O)Cn2c(C)nc3ccccc3c2=O)c1,C45154227_decoy,CASP3,Decoy,0,-6.13172,-7.63,-1.73,-6.467171670526311
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1,C46893635_decoy,CASP3,Decoy,0,-8.33643,-5.97,-0.71,-7.091466656803815
CCNC(=O)c1ccc(NC(=O)NCCCn2cnc3ccccc32)c(C)c1,C48109860_decoy,CASP3,Decoy,0,-6.03283,-6.15,-3.46,-5.544273907352324
N#C[C@@H](C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1nc(N)nc(Nc2ccccc2)n1,C49394797_decoy,CASP3,Decoy,0,-7.59207,-6.54,-1.15,-5.980341396062145
C#CCNC(=O)CNC(=O)C(=O)Nc1cccc(-c2nc3ccccc3s2)c1,C51808210_decoy,CASP3,Decoy,0,-8.01873,-6.93,-1.31,-6.361234860810948
C[C@@H]1CCCC[C@H]1NC(=S)NNC(=O)CCn1cnc2ccccc2c1=O,C53756003_decoy,CASP3,Decoy,0,-7.64326,-6.78,-2.33,-6.178845190676633
Cn1c(CC(=O)NNC(=O)NCCSc2ccccc2)nc2ccccc21,C54047122_decoy,CASP3,Decoy,0,-7.11989,-7.5,-2.49,-6.011055126176955
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1,C54880672_decoy,CASP3,Decoy,0,-8.0114,-8.02,-1.97,-6.149413374670711
Cn1c(CC(=O)NNC(=O)NCC2(c3ccccc3)CCC2)nc2ccccc21,C54926157_decoy,CASP3,Decoy,0,-6.77725,-7.72,-2.78,-5.39433201104456
CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)cc1,C57123756_decoy,CASP3,Decoy,0,-8.57866,-5.44,-2.09,-6.354607121871883
CC1(C)[C@H]2CC[C@]1(C)[C@@H](NC(=O)COC(=O)c1sccc1S(N)(=O)=O)C2,C14200433_decoy,CASP3,Decoy,0,-8.37161,-5.93,-0.75,-5.83735307569251
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=S)NC3CCCCC3)ccc21,C14841100_decoy,CASP3,Decoy,0,-9.39511,-6.86,-0.53,-6.076003255510602
CCNC(=O)CNC(=O)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1,C61924965_decoy,CASP3,Decoy,0,-6.41979,-7.01,-1.63,-5.268565297360338
Cc1nc([C@@H](CC(C)C)NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)sc1C,C62450192_decoy,CASP3,Decoy,0,-7.98135,-5.6,-0.47,-6.308699059071371
CC(C)NC(=O)NNC(=O)c1ccc(SCc2cn3ccccc3n2)cc1,C63269559_decoy,CASP3,Decoy,0,-6.66551,-5.83,-1.87,-5.619477924044065
C[C@H](S[C@H]1N=C([NH-])[NH+]=C2N=CN=C21)C(=O)NC(c1ccccc1)c1ccccc1,C38870329_decoy,CASP3,Decoy,0,-6.59559,-6.53,-2.57,-6.186426888737726
COc1cc(C(=O)NNC(=S)Nc2cc(C)ccc2F)cc2c1OCCO2,C63344765_decoy,CASP3,Decoy,0,-8.8221,-6.57,-1.62,-6.09499408772517
Cc1ccc(CNS(=O)(=O)C2=CN=C([C@@H]3NN[C@H](c4ccccc4)O3)C2)cc1,C64612687_decoy,CASP3,Decoy,0,-6.79507,-6.22,-1.05,-5.095449507686528
Cc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)NC[C@@H]2CCCO2)cc1,C65146581_decoy,CASP3,Decoy,0,-7.65118,-6.41,-3.39,-6.499483826179541
CCNC(=O)NNC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cccs1,C65191426_decoy,CASP3,Decoy,0,-9.50408,-6.54,-1.7,-6.98503725188497
COCCCNC(=O)NNC(=O)c1sc(-c2cccc(Cl)c2)nc1C,C65206861_decoy,CASP3,Decoy,0,-8.96669,-5.61,-2.4,-5.611489751725651
CCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)NC3CC3)cc2)C1,C51712695_decoy,CASP3,Decoy,0,-5.74873,-6.97,-1.22,-5.523716107230426
CCNC(=O)c1ccc(NC(=O)CNS(=O)(=O)c2cccs2)c(C)c1,C65501236_decoy,CASP3,Decoy,0,-6.96465,-6.95,-1.18,-6.288865531261228
Cc1ccc(Sc2ncccc2C(=O)Nc2ccn(CC(N)=O)n2)c(C)c1,C65862016_decoy,CASP3,Decoy,0,-9.24617,-7.96,-1.78,-7.176498883776999
COc1cc(C)c([C@H](C)NC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cc1OC,C66402538_decoy,CASP3,Decoy,0,-6.46229,-6.56,-1.46,-6.626721525511887
Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1,C66783745_decoy,CASP3,Decoy,0,-6.04908,-6.96,-1.76,-6.093371823017308
CCOCCCNC(=O)NNC(=O)c1cc2cccc(Br)c2o1,C67310692_decoy,CASP3,Decoy,0,-6.78334,-6.56,-1.91,-6.566040679110749
CNC(=O)c1cccc(CNC(=O)N(Cc2ccc(O)c(OC)c2)C2CC2)c1,C67391183_decoy,CASP3,Decoy,0,-7.87543,-7.59,-1.12,-7.366522258671574
C[C@H](Cc1ccc(O)cc1)NC(=O)C(=O)Nc1ccc(-c2csnn2)cc1,C67395931_decoy,CASP3,Decoy,0,-7.34901,-7.5,-2.82,-6.122960960356315
CC(C)CNC(=O)c1ccc(NC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)cc1,C67545640_decoy,CASP3,Decoy,0,-6.8008,-5.78,-0.94,-5.612689948009165
C=CCn1c(N)cc(=O)nc1SCC(=O)Nc1sc2c(c1C(=O)OCC)CCC2,C02484777_decoy,CASP3,Decoy,0,-8.24516,-5.96,-2.51,-6.846254000036047
COCCNC(=O)c1c(N)n(CCc2ccc(OC)cc2)c2nc3ccccc3nc12,C02304702_decoy,CASP3,Decoy,0,-8.16498,-6.61,-1.68,-6.246224301893202
COCCCn1c(N)c(C(=O)NCc2ccc(OC)cc2)c2nc3ccccc3nc21,C02235279_decoy,CASP3,Decoy,0,-8.09401,-6.03,-1.77,-6.795705086767102
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCSc1ccccc1,C09502270_decoy,CASP3,Decoy,0,-8.11626,-6.76,-2.02,-6.667049370207526
O=C(CNc1ccccc1C(=O)NCc1ccco1)Nc1ccc(N2CCOCC2)cc1,C09545810_decoy,CASP3,Decoy,0,-8.2363,-8.29,-3.67,-6.496524986259449
C=CCn1c(Cc2ccccc2)nnc1SCC(=O)Nc1ccc(S(N)(=O)=O)cc1,C09582872_decoy,CASP3,Decoy,0,-6.81346,-6.96,-3.82,-6.324334560438931
CCN(c1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1)C(C)C,C12596444_decoy,CASP3,Decoy,0,-7.24246,-7.67,-1.77,-6.197416529238337
CCc1sc(C(=O)NCC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1C,C12869115_decoy,CASP3,Decoy,0,-7.11158,-6.94,-1.11,-6.720290336394625
Cn1ccnc1[C@@H](NC(=O)CNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)cc1,C12507630_decoy,CASP3,Decoy,0,-8.52213,-6.29,-1.85,-6.743496629706555
CCCCN1C(=O)C[C@H](C(=O)Nc2nc(CC(N)=O)cs2)[C@H]1c1ccc(OC)cc1,C13006975_decoy,CASP3,Decoy,0,-10.7255,-6.95,-1.1,-8.180771486172794
CCCCN(C(=O)COc1ccc(Cl)cc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C13986620_decoy,CASP3,Decoy,0,-6.90152,-6.42,-2.03,-5.512752993255503
COCCCN(C(=O)CC12CC3CC(CC(C3)C1)C2)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14254795_decoy,CASP3,Decoy,0,-7.19972,-7.51,-1.41,-7.222856889764457
Cc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)Cc3ccccc3C)cc2)no1,C14562725_decoy,CASP3,Decoy,0,-6.93458,-5.7,-4.89,-5.18401803415903
CCCCN(C(=O)c1ccc2ccccc2n1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14624035_decoy,CASP3,Decoy,0,-6.53905,-6.42,-2.57,-5.214937503278738
CCCCn1c(N)c(N(C)C(=O)CCc2ccc(-c3ccccc3)o2)c(=O)[nH]c1=O,C14655953_decoy,CASP3,Decoy,0,-7.03629,-6.59,-1.33,-6.389646054192978
COc1ccc(-c2nnc(SCC(=O)N(CCC(N)=O)c3ccc(F)cc3)[nH]2)cc1,C16114172_decoy,CASP3,Decoy,0,-9.75051,-7.39,-1.72,-9.4934469916122
CCOC(=O)c1ccc(NC(=S)NNC(=O)c2ccc3c(c2)nc(C)n3CC)cc1,C16211711_decoy,CASP3,Decoy,0,-7.67102,-6.53,-1.86,-5.913772416164061
CCCSc1nc2ccc(NC(=O)CSc3nnc(COC)n3N)cc2s1,C20843654_decoy,CASP3,Decoy,0,-10.1578,-5.22,-2.37,-6.573662719781362
NC(=O)c1c(NC(=O)COC(=O)CSc2cnc3ccccc3n2)sc2c1CCC2,C21376161_decoy,CASP3,Decoy,0,-7.88539,-7.44,-0.6,-5.793108151379204
COc1ccccc1CN/C(=N/C(=S)NC[C@H]1CCCO1)Nc1nc(C)cc(C)n1,C14156222_decoy,CASP3,Decoy,0,-8.66149,-6.3,-2.31,-6.957227268640508
Cc1ccccc1-c1nnc(SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)n1C,C21753381_decoy,CASP3,Decoy,0,-9.3015,-7.26,-3.58,-8.213063177303104
CCc1sc(C(=O)NCC(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)cc1C,C24750397_decoy,CASP3,Decoy,0,-10.2517,-5.92,-2.22,-6.504455218507281
NC(=O)c1c(NC(=O)COC(=O)c2cnn(Cc3ccccc3)c2)sc2c1CCCC2,C25824823_decoy,CASP3,Decoy,0,-6.36016,-7.17,-1.52,-5.285444437159356
CCNc1ccc(C(=O)OCC)cc1NS(=O)(=O)c1cc(NC(C)=O)ccc1C,C26540578_decoy,CASP3,Decoy,0,-7.65358,-6.93,-0.71,-6.271121678779932
Cc1ccc(OCC(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1C,C28418044_decoy,CASP3,Decoy,0,-9.36262,-7.91,-2.12,-8.492731102511858
C[C@@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)Nc1ccccc1Cl,C29665432_decoy,CASP3,Decoy,0,-10.3586,-7.66,-3.67,-9.347590930191435
CC(C)[C@H](NC(=O)CSc1nnc(-c2ccco2)n1CCC(N)=O)c1ccccc1,C29666452_decoy,CASP3,Decoy,0,-10.0626,-6.61,-1.41,-7.860195621895798
CCCn1c(CCC(=O)NC[C@@H]2Cc3ccccc3O2)nc2cc(S(N)(=O)=O)ccc21,C30001842_decoy,CASP3,Decoy,0,-10.8184,-8.15,-3.12,-10.03721329848158
Nn1c(COc2ccc(F)cc2)nnc1SCCCn1c(=O)[nH]c2ccccc21,C32905603_decoy,CASP3,Decoy,0,-7.36807,-6.51,-2.29,-5.91049110968915
COc1ccc(CCNC(=O)c2cn3cc(-c4ccc(C(N)=O)cc4)ccc3n2)cc1OC,C34831156_decoy,CASP3,Decoy,0,-8.26415,-6.9,-2.93,-6.30037840241016
COCCOC(=O)c1c(NC(=O)CN2c3ccccc3C[C@H]2C)sc(C(N)=O)c1C,C03495615_decoy,CASP3,Decoy,0,-11.57,-6.12,-4.38,-8.670011725066573
CCOC(=O)C1=C(CSc2nc(C(C)(C)C)n[nH]2)[C@@H](C(=O)OCC)[C@H](N)S1,C38793053_decoy,CASP3,Decoy,0,-8.51083,-6.5,-1.67,-6.114713479045146
CCOC(=O)C1=C(CSc2nc(C(C)(C)C)n[nH]2)[C@@H](C(=O)OCC)[C@@H](N)S1,C38793057_decoy,CASP3,Decoy,0,-9.44542,-5.3,-1.12,-6.23730514554418
CC(C)CN(C(=O)[C@@H](C)Oc1ccc(F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C21355822_decoy,CASP3,Decoy,0,-6.91523,-4.91,-2.42,-5.585124874256571
O=CC[C@@H](NC=O)c1ccc(S(=O)(=O)Oc2ccccc2)c(-c2ccccc2O)c1O,C39496573_decoy,CASP3,Decoy,0,-6.44059,-7.05,-2.95,-6.47496149372335
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)Sc2nc(C(C)C)n[nH]2)cc1,C14247530_decoy,CASP3,Decoy,0,-8.34866,-7.26,-1.18,-7.163140066690457
Cc1ccc([C@@](O)(CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C(F)(F)F)o1,C40087166_decoy,CASP3,Decoy,0,-6.35695,-7.09,-0.9,-6.684307588440329
CCOc1cc(/C=N/NC(=O)OC(C)(C)C)cc(Br)c1OCC(N)=O,C03574640_decoy,CASP3,Decoy,0,-8.71198,-5.62,-1.82,-6.402183121358385
C[C@@H](Oc1ccccc1C#N)C(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C46705901_decoy,CASP3,Decoy,0,-7.24972,-5.69,-3.17,-6.838868396067214
CCc1ccccc1N/C(=N\C(=O)c1ccc(NC(C)=O)cc1)NCc1c(C)nn(C)c1C,C32972506_decoy,CASP3,Decoy,0,-8.28802,-6.54,-4.39,-6.151925443382996
O=C(CSc1n[nH]c(N/N=C/c2ccco2)n1)NCc1cccc(C(F)(F)F)c1,C59006005_decoy,CASP3,Decoy,0,-8.65401,-7.84,-1.81,-6.553084180508075
COc1ccc(CNC(=O)CSc2n[nH]c(N/N=C/c3ccc(F)cc3)n2)cc1,C59014787_decoy,CASP3,Decoy,0,-7.45684,-6.22,-3.3,-5.378168715367462
Cc1ccc(/C=N/Nc2nc(SCC(=O)NCCc3ccc(Cl)cc3)n[nH]2)o1,C59020080_decoy,CASP3,Decoy,0,-9.53558,-7.15,-0.52,-6.6544650591599614
C/C(=N/Nc1nc(SCC(=O)Nc2cccc(C(F)(F)F)c2)n[nH]1)c1ccccn1,C59038681_decoy,CASP3,Decoy,0,-6.83156,-7.04,-2.42,-6.46606891256834
COC(CN/C(=N/c1nc(C)cc(C)n1)NC(=S)Nc1cc(C)cc(C)c1)OC,C14155923_decoy,CASP3,Decoy,0,-7.72249,-5.87,-1.26,-6.129137044589269
O=C(CSc1n[nH]c(N/N=C/c2ccncc2)n1)Nc1ccc(C(F)(F)F)cc1,C59311031_decoy,CASP3,Decoy,0,-5.99074,-6.56,-1.83,-5.846981578624736
COC(CN/C(=N\c1nc(C)cc(C)n1)NC(=S)Nc1ccc(C)cc1C)OC,C14155920_decoy,CASP3,Decoy,0,-6.96291,-5.38,-1.94,-5.483348327901089
CC[C@@H](C)C(=O)NCC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1,C59856004_decoy,CASP3,Decoy,0,-6.90652,-5.9,-1.17,-5.49936543330285
C=CCn1c(CNc2ccc(C)cc2)nnc1S[C@@H](C)C(=O)NNC(=O)C(C)C,C59877860_decoy,CASP3,Decoy,0,-8.73086,-7.39,-3.15,-10.787217581091594
CCCc1ccc(-c2nc(NC(=O)CCn3cc(S(N)(=O)=O)cn3)sc2C)cc1,C60332526_decoy,CASP3,Decoy,0,-8.28695,-7.67,-2.74,-6.871342558320638
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1cc(Cl)c(N)cc1OC,C03338107_decoy,CASP3,Decoy,0,-7.69085,-6.46,-2.07,-6.836107940423894
C=CCn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1cccs1,C02451029_decoy,CASP3,Decoy,0,-9.85563,-7.9,-0.95,-8.180384983829292
CCNC(=O)NCCNC(=O)c1cc2c(CC)nn(-c3ccc(OC)cc3)c2s1,C06801815_decoy,CASP3,Decoy,0,-8.29641,-5.89,-0.76,-6.291436026480385
O=C(NNC(=S)Nc1ccn(Cc2ccccc2F)n1)c1ccnn1C(F)F,C02803153_decoy,CASP3,Decoy,0,-9.02669,-6.91,-1.26,-8.202043945657426
C[C@H](OC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(=O)NC(C)(C)C,C07358504_decoy,CASP3,Decoy,0,-7.31893,-7.52,-1.62,-6.446497945486088
CCCCn1c(N)c(N(Cc2ccco2)C(=O)Cc2ccccc2F)c(=O)[nH]c1=O,C07799413_decoy,CASP3,Decoy,0,-7.48638,-5.8,-2.01,-6.393839539428764
CCCCc1ccc(-n2nnnc2SCC(=O)Nc2ccc(C(N)=O)cc2)cc1,C08229781_decoy,CASP3,Decoy,0,-9.21234,-6.05,-0.85,-5.954428872409489
CC(=O)Nc1ccc(/C=N/NC(=S)Nc2cc(S(=O)(=O)N(C)C)ccc2C)cc1,C09443929_decoy,CASP3,Decoy,0,-9.68493,-7.77,-2.58,-7.338064492984759
CCOc1ccc(/C=C/C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1OC,C09552479_decoy,CASP3,Decoy,0,-8.57493,-6.42,-0.58,-6.524243885729816
CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccs2)cc1,C10609428_decoy,CASP3,Decoy,0,-8.95579,-6.45,-0.73,-6.396489466972758
CCc1cccc2c(C(=O)COC(=O)c3ccc(OC)c(S(N)(=O)=O)c3)c[nH]c12,C11045547_decoy,CASP3,Decoy,0,-9.4357,-7.37,-1.13,-8.648463067982568
CCCCSc1nnc(SCC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)s1,C11069062_decoy,CASP3,Decoy,0,-9.15005,-5.15,-1.93,-6.452717624985044
CC(C)Cn1c(N)c(C(=O)CSc2ncc(-c3ccccc3)n2C2CC2)c(=O)[nH]c1=O,C12189173_decoy,CASP3,Decoy,0,-6.27085,-7.1,-2.62,-5.662807432765373
CCCOc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(C)cc(C)c2)cc1OC,C12697000_decoy,CASP3,Decoy,0,-7.46386,-6.63,-2.71,-7.211321428637554
CCOc1ccc([C@@H](C)NC(=O)NCCNS(=O)(=O)c2ccc(OC)cc2)cc1,C12983833_decoy,CASP3,Decoy,0,-7.65077,-6.15,-1.84,-6.284033741719384
CCOc1ccc(/C=C/C(=O)NC(=S)NNC(=O)c2ccc(OC)c(OC)c2)cc1,C13621176_decoy,CASP3,Decoy,0,-6.3849,-5.76,-1.47,-5.273387838568366
COC(CN/C(=N/C(=S)Nc1cc(C)ccc1C)Nc1nc(C)cc(C)n1)OC,C14155921_decoy,CASP3,Decoy,0,-8.80719,-7.24,-2.4,-8.456453746671324
CCn1c(C)nc2cc(C(=O)NNC(=O)CCCNC(=O)c3ccc(Cl)cc3)ccc21,C15348024_decoy,CASP3,Decoy,0,-7.89581,-7.34,-1.34,-6.295647458042489
CCOC(=O)c1c(C)oc(NC(=O)CSc2cc(C)c3ccccc3n2)c1C(N)=O,C18488781_decoy,CASP3,Decoy,0,-8.13193,-5.93,-1.18,-7.062014181979969
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CCc2ccccc2F)c(=O)[nH]c1=O,C19623676_decoy,CASP3,Decoy,0,-6.89125,-6.32,-1.18,-6.14134927273551
Cc1ccc(/C=N/Nc2nc(SCC(=O)NCCc3ccccc3Cl)n[nH]2)o1,C20407284_decoy,CASP3,Decoy,0,-8.54771,-6.65,-1.21,-6.050963183810324
C=CCn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1C(C)(C)C,C20839565_decoy,CASP3,Decoy,0,-8.86372,-7.41,-2.87,-8.13139602020312
C=CCn1c(COc2ccc(F)cc2)nnc1SCC(=O)Nc1sccc1C(N)=O,C20992119_decoy,CASP3,Decoy,0,-8.37197,-6.12,-1.94,-6.723701566474904
O=C(CCSc1n[nH]c(N/N=C/c2cccnc2)n1)Nc1ccccc1Br,C21038865_decoy,CASP3,Decoy,0,-8.94003,-7.26,-1.53,-7.852635778168107
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N/C(=C\c3c[nH]c4ccccc34)C2=O)cc1,C24832488_decoy,CASP3,Decoy,0,-6.42568,-5.99,-3.01,-5.076915898594314
Cc1ccc(C)c(S(=O)(=O)NCCNC(=O)c2ccc(CSc3ncn[nH]3)cc2)c1,C25128741_decoy,CASP3,Decoy,0,-8.91344,-6.57,-2.9,-6.234824959601705
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=S)NCc2ccc3c(c2)OCO3)cc1,C25262445_decoy,CASP3,Decoy,0,-7.25685,-6.7,-2.39,-5.2011181522730165
CCCCN1C(=O)CC[C@@H](C(=O)Nc2nc(CC(N)=O)cs2)[C@H]1c1ccccc1OC,C25407268_decoy,CASP3,Decoy,0,-8.26939,-7.28,-1.46,-8.576035705064307
CCN(C(=O)COC(=O)c1ccc(CNC(N)=O)cc1)c1nc2ccccc2s1,C26094640_decoy,CASP3,Decoy,0,-6.18268,-7.43,-1.16,-6.0530538250801325
NC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)cc1,C28367726_decoy,CASP3,Decoy,0,-10.2579,-5.79,-1.0,-7.344003230924461
CC(C)[C@H](NC(=O)CSc1nnc(-c2ccco2)n1CCC(N)=O)c1cccs1,C29666465_decoy,CASP3,Decoy,0,-10.3018,-6.85,-3.82,-7.812219222174329
COc1cc(/C=N/NC(=O)C(C)(C)Oc2ccc(Cl)cc2)ccc1OCC(N)=O,C33808887_decoy,CASP3,Decoy,0,-8.51332,-7.31,-1.26,-7.814744525016118
CCOC(=O)c1ccc(C(=O)Cn2nc(N)n(Nc3cccc(C)c3)c2=S)cc1,C36625704_decoy,CASP3,Decoy,0,-7.29993,-6.83,-4.06,-5.492500667143494
C[C@@H](NC(=O)CSc1nnc(CCC(N)=O)n1Cc1ccco1)c1ccccc1Cl,C36692646_decoy,CASP3,Decoy,0,-9.37812,-7.28,-1.93,-10.494448703184094
Cc1ccc(C(=O)NNC(=O)CSc2nnc(CNc3ccc(F)cc3)n2C)cc1,C00874044_decoy,CASP3,Decoy,0,-7.4918,-7.95,-2.01,-6.21417103404149
CCOC(=O)C1=C(CSc2nc(C3CCCC3)n[nH]2)[C@H](C(=O)OCC)[C@@H](N)S1,C38793038_decoy,CASP3,Decoy,0,-9.49585,-6.73,-2.92,-6.537597129040581
C=CCn1c(Cc2ccc(OC)cc2)nnc1SCC(=O)Nc1sccc1C(N)=O,C39972981_decoy,CASP3,Decoy,0,-7.45133,-7.03,-4.84,-6.672850012197359
COc1ccc(CCNc2ncnc(Oc3cccc4cccnc34)c2N)cc1OC,C40683720_decoy,CASP3,Decoy,0,-7.13228,-6.18,-1.46,-5.883598982381102
COc1ccc([C@H](C#N)c2cncc(NNC(=S)Nc3ccccc3)n2)cc1OC,C44551029_decoy,CASP3,Decoy,0,-8.64318,-6.39,-2.36,-6.331711962910057
C[C@H](Oc1ccccc1C#N)C(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C46705899_decoy,CASP3,Decoy,0,-6.67033,-7.1,-3.24,-5.831497186270392
CCOc1ccc(C(=O)NCC(=O)Nc2ccc(C(=O)NC)cc2C)cc1OCC,C46778714_decoy,CASP3,Decoy,0,-8.09289,-7.82,-2.16,-7.511318958407644
CC(C)Cn1c(CCC(N)=O)nnc1S[C@H](C)C(=O)Nc1nc2ccccc2s1,C46876027_decoy,CASP3,Decoy,0,-9.7069,-7.65,-1.44,-7.988921453637029
Cc1ccc(-n2nnnc2SCC(=O)Nc2ccccc2SCC(N)=O)cc1C,C16245419_decoy,CASP3,Decoy,0,-9.95438,-8.04,-1.73,-7.837750826704181
CCOCCCNC(=O)NC(=O)CSc1nnc(Nc2ccccc2F)s1,C09509089_decoy,CASP3,Decoy,0,-8.4779,-6.35,-1.45,-6.421493897246978
CC(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3F)n2)cc1,C59014989_decoy,CASP3,Decoy,0,-7.17261,-6.77,-3.29,-6.077213240559687
C/C(=N/Nc1nc(SCC(=O)NCCc2ccccc2Cl)n[nH]1)c1ccncc1,C59023875_decoy,CASP3,Decoy,0,-9.1964,-7.06,-2.54,-8.219290193528844
CCCCn1c(N)c(N(C)C(=O)COc2ccc(C(F)(F)F)cc2)c(=O)[nH]c1=O,C44283562_decoy,CASP3,Decoy,0,-5.7179,-6.68,-0.95,-5.388025616100297
C=CCn1c(CNc2ccc(C)cc2)nnc1S[C@H](C)C(=O)NNC(=O)C1CCC1,C59877856_decoy,CASP3,Decoy,0,-8.24145,-6.92,-1.53,-7.046592033722358
COc1cc(NC(=O)/C=C/c2c(C)nn(CC(C)C)c2Cl)c(C(N)=O)cc1OC,C60204864_decoy,CASP3,Decoy,0,-9.83862,-6.15,-1.31,-6.477410327863984
COCCOC(=O)c1c(NC(=O)COc2c(C)cccc2C)sc(C(N)=O)c1C,C60386798_decoy,CASP3,Decoy,0,-9.90125,-6.99,-1.88,-8.08496064331165
CCOCCCn1c(S[C@@H](C)C(=O)NC(N)=O)nc2sc(C)c(C)c2c1=O,C03569468_decoy,CASP3,Decoy,0,-11.4995,-6.54,-1.76,-9.74662192263746
CCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nnc1-c1ccncc1,C06878324_decoy,CASP3,Decoy,0,-8.94873,-7.08,-3.5,-6.714981061374992
Nn1c(Cc2ccccc2F)nnc1SCC(=O)Nc1ccc(N2CCCC2=O)cc1,C08724164_decoy,CASP3,Decoy,0,-10.0842,-6.67,-0.09,-7.3968553185993375
NC(=O)c1ccsc1NC(=O)CSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1,C09508572_decoy,CASP3,Decoy,0,-7.88947,-7.88,-1.81,-8.781996026987837
Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)Nc3sc4c(c3C(N)=O)CCC4)cc2)n1,C02652482_decoy,CASP3,Decoy,0,-6.55064,-6.7,-1.28,-5.922452100353512
CCCn1c(CNc2ccccc2C(N)=O)nc2cc(S(=O)(=O)N(C)C)ccc21,C10847045_decoy,CASP3,Decoy,0,-6.4181,-6.28,-0.75,-4.981392431005638
CC(C)Cn1c(N)c(C(=O)CSc2ncc(-c3ccccc3)n2C)c(=O)[nH]c1=O,C10350288_decoy,CASP3,Decoy,0,-6.04781,-6.75,-0.63,-5.262055004877175
CC(=O)NCc1ccc(-c2csc(NC(=O)CNC(=O)c3cccc(C)c3)n2)o1,C12052938_decoy,CASP3,Decoy,0,-8.75495,-6.34,-0.8,-6.406057758198091
C[C@H](C(=O)NCCC(=O)NCCc1c[nH]c2ccccc12)n1cnc2ccccc2c1=O,C12296567_decoy,CASP3,Decoy,0,-6.71984,-7.14,-2.45,-5.617576901180974
[H]/N=C(\N/N=C(/C)c1ccc(O)cc1)S[C@@H]1CC(=O)N(c2ccccc2OC)C1=O,C12378906_decoy,CASP3,Decoy,0,-7.47529,-6.48,-1.57,-5.853939277194742
NC(=O)CCn1c(S[C@@H](C(=O)NC2CC2)c2ccccc2)nnc1-c1ccco1,C12800276_decoy,CASP3,Decoy,0,-10.3482,-7.01,-2.25,-8.366077013474534
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)no1,C15557167_decoy,CASP3,Decoy,0,-8.75571,-6.28,-1.18,-5.931363292102628
CCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nnc1-c1ccncc1,C17007383_decoy,CASP3,Decoy,0,-8.95824,-7.65,-3.13,-9.661618605476542
CCn1cc(NC(=O)[C@H](C)n2nc(C(F)(F)F)c(Cl)c2C2CC2)c(C(N)=O)n1,C02778751_decoy,CASP3,Decoy,0,-8.72829,-6.19,-1.97,-8.323878863354201
CNS(=O)(=O)c1cc(NC(=O)CSc2nnc(NC3CC3)s2)ccc1C,C19353184_decoy,CASP3,Decoy,0,-9.30069,-6.72,-2.82,-7.95214355494619
CC[C@](C)(NC1=NC(C(F)(F)F)(C(F)(F)F)NC(=O)N1)P(=O)(OC)OC,C12418601_decoy,CASP3,Decoy,0,-6.16489,-5.85,-1.31,-5.972647266684638
COC(=O)c1c(NC(=O)CSc2nnc(C(F)(F)F)n2N)sc2c1CCC2,C20841547_decoy,CASP3,Decoy,0,-7.065,-7.04,-1.51,-5.84663944609911
COCCCN(C(=O)c1ccc(F)c(F)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C22579730_decoy,CASP3,Decoy,0,-6.95497,-5.29,-5.05,-5.733721415764189
CCOc1c(Br)cc(C(=O)NNC(=O)CNC(=O)[C@@H]2C[C@@H]2C)cc1OC,C23187332_decoy,CASP3,Decoy,0,-8.23657,-6.55,-2.42,-6.508273337142241
COC(=O)c1cn(CC(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)c2ccccc12,C23481484_decoy,CASP3,Decoy,0,-8.257,-7.22,-1.5,-8.986300546324577
CCNC(=O)NC(=O)[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)c1ccccc1,C24870183_decoy,CASP3,Decoy,0,-8.15447,-5.32,-3.89,-5.846336408667948
Cc1nc2ccccc2n1CCNC(=O)c1ccccc1SC[C@]1(C)NC(=O)NC1=O,C25049256_decoy,CASP3,Decoy,0,-7.37938,-7.53,-3.27,-7.240707701995941
NS(=O)(=O)c1ccc(CNC(=O)c2ccc(Cn3ccc(C(F)(F)F)n3)o2)cc1,C27934712_decoy,CASP3,Decoy,0,-9.08773,-6.36,-0.03,-6.723297747157716
Cc1sc2nc(CS[C@@H](C)C(=O)NCCNc3ccc(C#N)cn3)[nH]c(=O)c2c1C,C12973565_decoy,CASP3,Decoy,0,-10.2889,-7.51,-1.34,-6.831245818214052
CC(C)C(=O)Nc1ccc2[nH]cc([C@H](C(=O)[O-])[NH+]3CCN(Cc4ccccn4)CC3)c2c1,C36364801_decoy,CASP3,Decoy,0,-7.43794,-6.01,-1.75,-5.387197028315277
CCCCNC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccc(C)o1)C(=O)[C@@H]1CCC(=O)N1,C36601059_decoy,CASP3,Decoy,0,-6.36402,-5.26,-2.14,-5.8730335082178415
Cc1ccc(-n2cnnc2SCC(=O)NCc2ccc(S(N)(=O)=O)cc2)c(C)c1,C36852133_decoy,CASP3,Decoy,0,-7.98267,-7.99,-2.43,-7.772074403699294
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)NCC(=O)NCc1ccccc1C,C07007136_decoy,CASP3,Decoy,0,-6.486,-7.26,-1.93,-5.886156814440644
CC(C)Cn1c(CCC(N)=O)nnc1S[C@H](C)C(=O)Nc1ccc(Cl)cn1,C07845456_decoy,CASP3,Decoy,0,-10.5862,-7.14,-1.53,-8.5758015443681
CC(C)c1nnc(S[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)n1C1CC1,C08850776_decoy,CASP3,Decoy,0,-8.71904,-7.22,-2.56,-7.453933978845604
O=C(Cc1csc(NC(=O)c2cnccn2)n1)NCCc1c[nH]c2ccccc12,C38740192_decoy,CASP3,Decoy,0,-7.48153,-6.26,-1.12,-5.789432292144765
CCc1cc(C2=NN=C[C@H]2c2nc(C)cs2)c(O)cc1O[C@@H](C)C(=O)NCCO,C09242653_decoy,CASP3,Decoy,0,-7.70944,-6.54,-0.53,-8.248632381244644
CC(C)Cn1c(CCC(N)=O)nnc1S[C@@H](C)C(=O)Nc1ccc(Cl)cn1,C07845450_decoy,CASP3,Decoy,0,-9.64332,-5.54,-1.21,-6.929141705311758
CCCc1cc2c(c(=O)n1CCO)[C@@H](c1cccc(OC)c1OC)C(C#N)=C(N)O2,C40569205_decoy,CASP3,Decoy,0,-8.06749,-5.54,-3.92,-5.842743917909021
CCC[C@@H](C(=O)NCCOC)n1c(-c2ccc3c(c2)OCCCO3)cc(C(N)=O)c1C,C43225925_decoy,CASP3,Decoy,0,-8.6729,-5.79,-1.29,-7.850791781438192
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)N2CCOCC2)[C@]1(C)CO,C43553865_decoy,CASP3,Decoy,0,-8.40101,-6.35,-2.6,-6.891550756603076
Cc1c(C(N)=O)cc(-c2cc(-c3ccccc3)no2)n1[C@@H](C)C(=O)NC[C@@H]1CCCO1,C44145008_decoy,CASP3,Decoy,0,-8.063,-7.47,-2.93,-7.659392759178342
NC(=O)[C@H]1CN(C(=O)COC(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc2O1,C45632154_decoy,CASP3,Decoy,0,-7.449,-9.15,-1.39,-9.489547233899785
CC(C)c1nnc(S[C@@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)n1C1CC1,C29962999_decoy,CASP3,Decoy,0,-9.15947,-6.29,-1.57,-7.486863617699838
CNS(=O)(=O)c1cccc(NC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)c1,C46794049_decoy,CASP3,Decoy,0,-8.22328,-6.02,-0.52,-6.122780360138169
CCCn1c(N)c(N(CCOC)C(=O)c2ccc(Br)s2)c(=O)[nH]c1=O,C22404037_decoy,CASP3,Decoy,0,-7.23073,-5.36,-0.69,-6.333546957307139
CCOC(=O)c1c(NC(=O)CCSc2nnc(C3CC3)n2N)sc2c1CCC2,C59912619_decoy,CASP3,Decoy,0,-8.64948,-7.42,-3.13,-7.532388270011061
CCOC(=O)[C@H]1C2=C(CCCCC2)S[C@H]1NC(=O)CSC1=NC(=O)CC(N)=N1,C63289543_decoy,CASP3,Decoy,0,-8.64843,-5.84,-1.19,-6.514435351178602
CCOC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)[C@H](CC)SC1=NC(=O)CC(N)=N1,C63537935_decoy,CASP3,Decoy,0,-9.05461,-6.7,-1.93,-7.455908910215382
CCOc1cc([C@@H]2C3=C(c4ccccc4O)N=N[C@@H]3C(=O)N2CCCO)ccc1O,C06752887_decoy,CASP3,Decoy,0,-7.36813,-5.24,-1.73,-6.809436724280272
CCOc1cc([C@H]2C3=C(c4ccccc4O)N=N[C@H]3C(=O)N2CCCO)ccc1O,C06752888_decoy,CASP3,Decoy,0,-7.92858,-6.13,-2.48,-6.841904912239245
Cc1sc(-c2ccno2)cc1S(=O)(=O)NCCc1ccc(S(N)(=O)=O)cc1,C35503169_decoy,CASP3,Decoy,0,-9.18843,-6.35,-4.06,-7.235488438194244
Cc1ccc(Cc2n[nH]c(CCNS(=O)(=O)C3=CNN(C(F)F)[C@@H]3C)n2)cc1,C64506954_decoy,CASP3,Decoy,0,-6.35493,-7.44,-1.88,-7.336914113464958
CCOc1cc([C@@H]2CC(=O)Nc3c2cnn3-c2cccc(Cl)c2)ccc1OCC(N)=O,C65331222_decoy,CASP3,Decoy,0,-9.70226,-6.45,-1.0,-6.970592876985624
CCOc1cc([C@H]2CC(=O)Nc3c2cnn3-c2cccc(Cl)c2)ccc1OCC(N)=O,C65331223_decoy,CASP3,Decoy,0,-9.4661,-6.23,-2.69,-6.667659371284923
COCCN(C(=O)/C=C/c1ccsc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C07989584_decoy,CASP3,Decoy,0,-8.16882,-4.83,-1.59,-6.178035786083851
COC(=O)c1ccc(C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1,C09479692_decoy,CASP3,Decoy,0,-7.69381,-6.55,-2.84,-6.079304246975135
CCCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1,C15559534_decoy,CASP3,Decoy,0,-7.17927,-4.69,-1.39,-5.321225384612471
C=CCSc1nnc(NC(=O)CSc2nnc(C(F)(F)F)n2N)s1,C20841263_decoy,CASP3,Decoy,0,-7.60476,-6.99,-2.3,-6.112271683497105
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NCC(=O)NCc2ccco2)c1,C21960546_decoy,CASP3,Decoy,0,-6.81132,-6.56,-2.08,-7.515476292982678
NC(=O)Cn1c(SCC(=O)NCCc2ccccc2)nnc1-c1ccco1,C23348082_decoy,CASP3,Decoy,0,-7.15036,-5.59,-1.46,-6.517169681476111
CCCCN(C(=O)CCc1ccco1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C24005010_decoy,CASP3,Decoy,0,-6.97823,-6.65,-2.15,-6.479660403531888
N#CCCNC(=O)CSc1nnc(-c2ccc(OC(F)F)cc2)n1N,C24772700_decoy,CASP3,Decoy,0,-6.71629,-4.94,-1.52,-6.94742517279991
CCn1c(=O)n(CCC(=O)NNC(=S)NC[C@@H]2CCCO2)c2ccccc21,C26803465_decoy,CASP3,Decoy,0,-7.92666,-6.36,-2.55,-5.713352017215972
CCCOC(=O)c1ccc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)cc1,C28197939_decoy,CASP3,Decoy,0,-5.95261,-6.2,-1.48,-4.559810561258734
C=CCNC(=O)[C@@H](C)Sc1nnc(COc2ccccc2OCC)n1N,C31679653_decoy,CASP3,Decoy,0,-7.67427,-6.37,-1.31,-7.702518156546665
CCOCCCNC(=O)Nc1cc(OC)c2nc(NC(C)=O)sc2c1,C33008565_decoy,CASP3,Decoy,0,-7.96458,-4.82,-1.75,-5.934560158447929
COC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2)cc1C,C01121558_decoy,CASP3,Decoy,0,-8.54776,-5.78,-1.03,-5.523349665841455
CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(C)s2)cc1OC,C06507272_decoy,CASP3,Decoy,0,-8.59559,-5.88,-1.09,-6.331006491870771
CCOC(=O)[C@H]1S[C@@H](NC(=O)CSc2ncn[nH]2)N[C@@H]1c1ccccc1,C39961164_decoy,CASP3,Decoy,0,-7.57859,-7.11,-1.06,-6.979201453167898
COCCCNc1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1N,C40727699_decoy,CASP3,Decoy,0,-7.94383,-6.11,-0.65,-6.315579316663863
O=C(NCc1nncn1-c1ccccc1)NC[C@H](O)COc1ccccc1,C41517938_decoy,CASP3,Decoy,0,-6.68668,-7.02,-0.25,-6.591639664955315
CCOc1cccc([C@H](c2sc3nc(C)nn3c2[O-])[NH+](CCO)CCO)c1,C41633652_decoy,CASP3,Decoy,0,-8.45426,-6.72,-1.38,-7.172157422914053
COCCNC(=O)NC(=O)[C@@H](C)Sc1nc(Cc2cccs2)n[nH]1,C42615160_decoy,CASP3,Decoy,0,-8.08635,-6.52,-2.8,-6.468462410606928
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCOC[C@H]1CCCO1,C45163018_decoy,CASP3,Decoy,0,-7.02068,-7.09,-0.77,-8.339090258854265
Cn1cc(C(=O)NNC(=O)NCCCOC[C@@H]2CCCO2)c2ccccc21,C45180236_decoy,CASP3,Decoy,0,-6.52463,-7.76,-2.02,-6.411070565416794
CCC(CC)[C@@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)N1CCOCC1,C45527505_decoy,CASP3,Decoy,0,-8.58195,-7.36,-0.59,-8.235906846735059
CCN(CCNC(=O)NNC(=O)C[C@H]1CCS(=O)(=O)C1)c1ccccc1C,C46866763_decoy,CASP3,Decoy,0,-7.67771,-7.91,-1.14,-8.797385377480675
Cc1cc(C)n(CC(=O)NNC(=O)NCCCc2ccc(N(C)C)cc2)n1,C47016283_decoy,CASP3,Decoy,0,-7.29054,-6.24,-1.74,-5.494274221597221
CCN(Cc1ccccc1NC(=O)NCCNc1ncccc1C#N)C(C)=O,C47115007_decoy,CASP3,Decoy,0,-6.25122,-6.08,-2.43,-5.278613743265828
O=C(NCCNC(=O)c1ccco1)Nc1ccc(OCC(F)(F)F)nc1,C48200079_decoy,CASP3,Decoy,0,-6.80042,-7.07,-1.2,-5.330120614271327
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCCC(C)C)cc1,C48603791_decoy,CASP3,Decoy,0,-7.063,-6.09,-2.67,-5.279739316285297
CCS(=O)(=O)NCCCNC(=O)NCc1ccnc(OC2CCCC2)c1,C51683807_decoy,CASP3,Decoy,0,-8.27345,-6.49,-3.01,-7.037580369307667
O=C(Cc1csc(NC(=O)c2ccco2)n1)NCCC(=O)NC1CCCC1,C53325194_decoy,CASP3,Decoy,0,-9.05266,-6.55,-0.2,-6.293383770156377
CC(C)COC[C@H](O)CNC(=O)C(=O)Nc1cc(C#N)ccc1OC(C)C,C54877638_decoy,CASP3,Decoy,0,-7.65907,-5.68,-1.71,-5.890297285715011
CSc1nnc(CCCNC(=O)CNC(=O)NC2CC2)n1C1CCCC1,C56569964_decoy,CASP3,Decoy,0,-8.52829,-6.64,-1.17,-7.421706988793106
CCOc1cc(C(=O)NCc2nnc(N)s2)cc(OCC)c1OCC,C20201632_decoy,CASP3,Decoy,0,-7.9077,-5.15,-1.08,-7.569130494599033
COC(=O)c1cc(CNC(=O)NCCNC(=O)c2ccc(C)c(F)c2)oc1C,C48550641_decoy,CASP3,Decoy,0,-6.83542,-7.37,-1.7,-6.435720580410618
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccccc1-n1ccnc1,C62656520_decoy,CASP3,Decoy,0,-7.47568,-5.75,-0.91,-6.150557894505269
CC(C)N(CCCNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)S(C)(=O)=O,C63161760_decoy,CASP3,Decoy,0,-5.57485,-6.37,-2.66,-4.616179773224069
O=C(NCCCNC(=O)c1ccccc1F)NCc1ccnc(-n2cccn2)c1,C63315717_decoy,CASP3,Decoy,0,-7.16244,-5.9,-1.65,-6.583489126799561
CCC[C@H](NC(N)=O)C(=O)N1CCN(Cc2ccc(OC)c(OC)c2)CC1,C63642733_decoy,CASP3,Decoy,0,-8.12411,-6.73,-2.07,-9.363625239374416
CCCn1c(N)c(N(CCOC)C(=O)c2sccc2CC)c(=O)[nH]c1=O,C64691384_decoy,CASP3,Decoy,0,-6.22918,-5.6,-4.0,-5.967804353985365
CCCCNC(=O)NNC(=O)CSCc1cc(=O)n2ccsc2n1,C64884088_decoy,CASP3,Decoy,0,-7.22993,-6.56,-1.69,-5.700114414586569
COCCNC(=O)NNC(=O)/C(C#N)=C\c1cc(C)n(CCC(C)C)c1C,C64899317_decoy,CASP3,Decoy,0,-7.83282,-5.21,-2.9,-6.059484325383666
CSCC[C@@H](C(=O)NNC(=O)NCC1CC1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O,C65192465_decoy,CASP3,Decoy,0,-8.58108,-5.61,-2.15,-8.599421211536457
CC(C)S(=O)(=O)NC[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)C1,C51276491_decoy,CASP3,Decoy,0,-8.01183,-6.41,-2.41,-6.205055719291702
CCS(=O)(=O)NCCCNC(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C,C65379287_decoy,CASP3,Decoy,0,-8.71547,-6.67,-1.26,-6.828514300821215
Cc1ccc([C@@H](CNC(=O)NCCC(=O)NC2CCCC2)N2CCOCC2)o1,C54752222_decoy,CASP3,Decoy,0,-8.25676,-6.2,-1.38,-6.21830544970101
C[C@H](NC(=O)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1nncn1C,C57485316_decoy,CASP3,Decoy,0,-6.73744,-6.46,-0.69,-5.095329676093311
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1n[nH]c(=S)n1C,C66625412_decoy,CASP3,Decoy,0,-7.96247,-5.72,-0.89,-8.302662027889411
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NCCN(C(=O)OC(C)(C)C)C1CC1,C67081260_decoy,CASP3,Decoy,0,-6.54764,-5.78,-0.84,-7.22707930286283
CCOCCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(C)c2C)C1,C67312172_decoy,CASP3,Decoy,0,-7.47076,-6.81,-3.28,-8.661178638251135
COCCOc1ccc(NC(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)cn1,C67396165_decoy,CASP3,Decoy,0,-7.87212,-6.96,-1.18,-6.43497866770479
CCn1nc(C)c(CNC(=O)N[C@@H](C)c2ccc(OCCO)c(OC)c2)c1C,C67406846_decoy,CASP3,Decoy,0,-8.55874,-6.25,-3.8,-6.794453204479314
CCNC(=S)NNC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(C)cc1,C01832338_decoy,CASP3,Decoy,0,-6.86547,-7.6,-2.11,-7.097498240930202
CCCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nc2ccccc2c1=O,C06481658_decoy,CASP3,Decoy,0,-8.33631,-7.91,-1.18,-8.544811702570337
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2cc3c(s2)CCCCC3)cc1,C09053856_decoy,CASP3,Decoy,0,-9.40878,-7.41,-1.91,-7.109076376791244
CC(C)Cn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1ccccc1F,C09632080_decoy,CASP3,Decoy,0,-8.27341,-6.11,-1.46,-7.040434310553467
NC(=O)c1c(NC(=O)CSc2nnc(Cc3cccs3)n2C2CC2)sc2c1CCC2,C09781449_decoy,CASP3,Decoy,0,-11.0183,-6.68,-1.67,-9.225805713599293
Cc1nc(COc2ccccc2/C=C/C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)cs1,C09906130_decoy,CASP3,Decoy,0,-9.63498,-6.31,-2.2,-6.722838469775775
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)no1,C10690938_decoy,CASP3,Decoy,0,-8.55841,-8.87,-2.94,-7.955852552994092
O=C(CSc1nc(Cc2cccs2)n[nH]1)NCC(=O)Nc1ccc(F)c(F)c1F,C11601798_decoy,CASP3,Decoy,0,-9.56718,-5.63,-0.76,-6.443475374636837
COc1ccc(C(=O)NNC(=S)NC(=O)COc2ccc(C)cc2)cc1Br,C12503025_decoy,CASP3,Decoy,0,-9.20527,-6.48,-0.77,-6.20645263150894
CCCCCCN1C(=O)/C(=C\c2[nH]c3ccccc3c2CCNC(C)=O)C(=O)NC1=S,C12661911_decoy,CASP3,Decoy,0,-9.35063,-6.0,-2.22,-7.266153196056608
CCOc1cc2c(cc1CNC(=O)CSc1nc(C)c(C)c(C)c1C(N)=O)O[C@H](C)C2,C12786155_decoy,CASP3,Decoy,0,-7.48623,-6.61,-2.83,-7.481822354101556
CC(C)CN(C(=O)Cc1cccc(C(F)(F)F)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13134342_decoy,CASP3,Decoy,0,-6.13657,-6.93,-1.64,-5.650441145898399
Cc1ccc(/C=C/C(=O)NC(=S)NNC(=O)COc2ccc(Br)cc2C)o1,C13978531_decoy,CASP3,Decoy,0,-8.31406,-7.67,-2.12,-9.749998461431067
C=CCN(CC(=O)Nc1ccc(C(N)=O)cc1)S(=O)(=O)c1ccccc1C(F)(F)F,C14162129_decoy,CASP3,Decoy,0,-8.57302,-7.28,-1.89,-7.988840532054306
COCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2Cl)cc1,C14657139_decoy,CASP3,Decoy,0,-9.31894,-6.86,-0.91,-7.0327647170956284
O=C(CCCNC(=O)c1ccc(Cl)cc1)NNC(=O)CN1CCCc2ccccc21,C15901139_decoy,CASP3,Decoy,0,-6.82019,-6.82,-2.53,-5.359615905427162
CC(=O)Nc1ccc(-c2csc(NC(=O)CSCC(=O)Nc3ccc(C)cc3)n2)cc1,C15991723_decoy,CASP3,Decoy,0,-8.78931,-7.5,-1.31,-5.873783058597871
CCOC(=O)c1c(C)oc(NC(=O)CSc2cc(Cl)ccc2Cl)c1C(N)=O,C18951106_decoy,CASP3,Decoy,0,-8.66004,-5.06,-1.74,-7.180816050960742
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)c2ccc(CSC)cc2)c(=O)[nH]c1=O,C21355539_decoy,CASP3,Decoy,0,-6.6681,-6.99,-2.86,-7.376459760656337
Cc1cccc(-n2ccnc2SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1C,C21609382_decoy,CASP3,Decoy,0,-8.71336,-6.27,-3.85,-6.986231060439631
COc1ccc([C@H](CNC(=O)CSc2nc(C3CC3)n[nH]2)c2c[nH]c3ccccc23)cc1,C21737314_decoy,CASP3,Decoy,0,-8.98825,-6.62,-2.94,-6.053812558091995
CCOC(=O)c1c(C)[nH]c(C(=O)NCCNc2ncc(C(F)(F)F)cc2Cl)c1C,C22357356_decoy,CASP3,Decoy,0,-7.08695,-7.69,-2.88,-6.85414028991974
Cc1ccc(SCCNC(=O)CSc2nnc(COc3ccccc3F)n2N)cc1,C24105194_decoy,CASP3,Decoy,0,-6.12692,-6.96,-1.8,-5.406834604786342
Cc1nc(SCC(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)sc1CC(N)=O,C24901783_decoy,CASP3,Decoy,0,-7.86132,-8.24,-1.58,-6.342119015540249
NC(=O)c1c(NC(=O)COC(=O)c2ccc(OC(F)(F)F)cc2)sc2c1CCC2,C03284314_decoy,CASP3,Decoy,0,-9.30093,-7.15,-1.68,-9.32055068104151
Cc1ccc(C(=O)NCCNC(=O)[C@H](C)NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1F,C25580341_decoy,CASP3,Decoy,0,-6.79209,-7.23,-4.33,-5.367143576432625
Cc1ccc(SCCNC(=O)CN2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C2=O)cc1,C26397656_decoy,CASP3,Decoy,0,-6.17421,-7.84,-2.01,-6.235049399386482
CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C27093308_decoy,CASP3,Decoy,0,-7.62638,-6.48,-2.08,-6.157537577105479
O=C(CSCc1nc2ccccc2s1)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1,C27852488_decoy,CASP3,Decoy,0,-8.04721,-6.43,-1.98,-5.223327857583902
C[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)Nc1c(F)cccc1F,C28948517_decoy,CASP3,Decoy,0,-8.33337,-6.53,-0.92,-7.052856771266634
C[C@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)Nc1ccc(Cl)cc1,C32895055_decoy,CASP3,Decoy,0,-9.38732,-5.82,-2.59,-6.793869059528693
CCOC(=O)C1=C(CSc2n[nH]c(/C=C/c3ccc(F)cc3)n2)[C@H](C#N)[C@@H](N)S1,C38800218_decoy,CASP3,Decoy,0,-10.2257,-7.08,-2.0,-6.92902766209331
CC[C@@H](COC)NC(=O)[C@H]1Sc2ncnc(NCCc3c[nH]c4ccccc34)c2[C@H]1C,C39394835_decoy,CASP3,Decoy,0,-8.57681,-5.38,-1.82,-6.425242796593547
NC(=O)CCN(C(=O)CSc1nc(-c2ccccc2Br)n[nH]1)c1ccccc1,C16811211_decoy,CASP3,Decoy,0,-9.87649,-5.85,-0.91,-8.534397275471704
CC[C@@H](C(=O)N1C[C@H](C(=O)NCCCCCC(=O)[O-])C2(CC[NH2+]CC2)C1)c1ccccc1,C39660108_decoy,CASP3,Decoy,0,-6.97331,-6.54,-1.95,-6.503431762174096
CC[C@@H](C(=O)N1C[C@@H](C(=O)NCCCCCC(=O)[O-])C2(CC[NH2+]CC2)C1)c1ccccc1,C39660110_decoy,CASP3,Decoy,0,-8.50848,-8.07,-3.32,-7.15591508364489
O=C(NCCc1c[nH]c2ccccc12)C(=O)NC[C@H](c1ccco1)N1CCc2ccccc2C1,C39703458_decoy,CASP3,Decoy,0,-7.36862,-8.69,-3.1,-6.827958858720929
CCCc1cc2c(c(=O)n1CCO)[C@@H](c1ccccc1Cl)C(C(=O)OCC)=C(N)O2,C40569637_decoy,CASP3,Decoy,0,-8.23625,-6.21,-4.39,-7.537520377065679
COC[C@@H](C)Nc1ncnc(N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1N,C40730080_decoy,CASP3,Decoy,0,-7.22326,-5.76,-1.87,-5.907831689700844
COCC(=O)N[C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@@]12CCC(=O)NCc1ccc(OC)cc1,C43547926_decoy,CASP3,Decoy,0,-10.7981,-6.86,-1.58,-8.201152060793621
CCC[C@@H](C(=O)NCc1ccc2c(c1)OCO2)n1c(-c2ccccc2)cc(C(N)=O)c1C,C44144915_decoy,CASP3,Decoy,0,-7.86719,-7.32,-2.55,-7.359432803879839
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl,C26225691_decoy,CASP3,Decoy,0,-9.29632,-7.11,-2.46,-7.25519084655784
CCCOc1c(Br)cc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1OC,C46554969_decoy,CASP3,Decoy,0,-10.2481,-5.63,-1.05,-7.689465391151796
CCOc1cc(/C=N/NC(=S)NCCN2CCOCC2)cc(Br)c1O,C57416780_decoy,CASP3,Decoy,0,-10.2497,-6.08,-2.92,-7.181940704249434
C[C@H](Sc1nnc(SCC(N)=O)s1)C(=O)Nc1nc(-c2ccc(F)cc2)cs1,C24842500_decoy,CASP3,Decoy,0,-7.91371,-5.8,-2.13,-6.037250394239081
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NCc1ccc(F)cc1,C59015576_decoy,CASP3,Decoy,0,-8.93894,-6.41,-3.38,-6.47935349487063
Cc1cccc(C(=O)NCCNC(=O)c2ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c2)c1,C59828236_decoy,CASP3,Decoy,0,-7.64884,-7.1,-4.51,-5.626738634069445
CC[NH+](CC)c1ccc(NC(=O)[C@@H](NC2=NS(=O)(=O)c3ccccc32)C(C)C)cc1,C16598617_decoy,CASP3,Decoy,0,-6.84682,-6.95,-0.74,-6.440844921826304
Cc1cccn2cc(COc3ccc(C(=O)NCCc4cccc(C(N)=O)c4)cc3)nc12,C60366342_decoy,CASP3,Decoy,0,-8.38332,-8.77,-3.31,-7.574872571804161
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)Nc1nnc(CCc2ccccc2)s1,C62001393_decoy,CASP3,Decoy,0,-9.89239,-7.12,-2.04,-7.563809031317674
O=C(Cc1ccc(Br)cc1)Nc1cc(SC[C@H](O)CO)cc([N+](=O)[O-])c1,C02765093_decoy,CASP3,Decoy,0,-8.75252,-5.75,-2.77,-5.472441867313356
O=c1[nH]c(=O)n(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1N(CCO)CCO,C04975108_decoy,CASP3,Decoy,0,-6.60695,-7.47,-1.67,-7.270217861068137
Cc1ccc(S(=O)(=O)N(CC(N)=O)C[C@@H](O)Cn2c3ccccc3c3ccccc32)cc1,C01109283_decoy,CASP3,Decoy,0,-7.02647,-7.08,-3.16,-5.225989465750056
CCn1c(Cc2ccccc2)nnc1SCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C06878306_decoy,CASP3,Decoy,0,-9.3629,-6.51,-1.56,-7.939600050250397
CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Br)c(O)c(OC)c1,C08443445_decoy,CASP3,Decoy,0,-8.99516,-5.58,-1.79,-6.745475498396377
CCOc1ccc(CCNC(=O)c2sc3nc(C)cc(COC)c3c2N)cc1OCC,C00719757_decoy,CASP3,Decoy,0,-8.69819,-6.6,-1.14,-6.192283896786071
C[C@@H]1CCc2sc(C(=O)OCC(=O)NCCc3ccc(S(N)(=O)=O)cc3)cc2C1,C09128796_decoy,CASP3,Decoy,0,-7.85369,-6.45,-2.95,-4.949378572986247
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)C(O)(c1ccccc1)c1ccccc1,C09180560_decoy,CASP3,Decoy,0,-8.46444,-6.49,-1.85,-6.491180902297664
CCOc1ccc(Br)cc1S(=O)(=O)NCCc1ccc(S(N)(=O)=O)cc1,C09442419_decoy,CASP3,Decoy,0,-9.69283,-7.15,-2.78,-8.029188762789934
CCOC(=O)N1CCc2c(sc(NC(=O)CCCSc3ccc(C)cc3)c2C(N)=O)C1,C09473898_decoy,CASP3,Decoy,0,-9.03474,-6.25,-1.25,-5.921178910055227
Cc1cc(NC(=O)[C@H](C)SCC(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)no1,C10690950_decoy,CASP3,Decoy,0,-7.64112,-6.5,-4.06,-6.42145398009356
Cc1cc(C)cc(-n2ccnc2SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1,C11544875_decoy,CASP3,Decoy,0,-9.01443,-7.7,-1.45,-8.401102117178265
O=C(CSc1nnc(CCC2CCCC2)[nH]1)NCC(=O)Nc1ccc(F)c(F)c1F,C12104818_decoy,CASP3,Decoy,0,-7.53303,-6.06,-0.96,-5.408341152889043
CC[C@H](O)CNC(=O)c1sc2ncnc(NCC3(c4ccccc4)CCOCC3)c2c1C,C12165401_decoy,CASP3,Decoy,0,-9.69733,-7.84,-2.06,-7.324941547313152
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CNC(=O)c1ccc(F)cc1,C12912672_decoy,CASP3,Decoy,0,-7.35528,-7.53,-1.5,-6.3232636461731335
CCCCN(C(=O)Cc1cccc(C(F)(F)F)c1)c1c(N)n(CCC)c(=O)[nH]c1=O,C14823584_decoy,CASP3,Decoy,0,-6.96459,-6.43,-0.78,-6.197015292207943
CC[C@H](C)Oc1ccc(C(=O)NC(=S)Nc2cccc(C(=O)NC[C@@H]3CCCO3)c2)cc1,C14839199_decoy,CASP3,Decoy,0,-8.28813,-6.33,-2.58,-6.127432685135457
CC[C@H](C)Oc1ccc(C(=O)NC(=S)Nc2cccc(C(=O)NC[C@H]3CCCO3)c2)cc1,C14839201_decoy,CASP3,Decoy,0,-8.59093,-7.22,-1.02,-5.986351499341716
O=C(CCCCCN1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S)Nc1nccs1,C15045187_decoy,CASP3,Decoy,0,-10.3837,-6.47,-3.06,-7.239998188496739
Nn1c(COc2ccccc2F)nnc1SCC(=O)Nc1ccccc1C(F)(F)F,C15278818_decoy,CASP3,Decoy,0,-9.29755,-7.63,-2.14,-11.637846748221198
CC(=O)NCc1ccc(C(=O)N/C(=N/c2ccc(Cl)cc2C)NCc2ccccn2)cc1,C15828063_decoy,CASP3,Decoy,0,-8.14541,-5.69,-3.51,-6.547133343319721
CC(=O)Nc1ccc(-c2csc(NC(=O)CCCNC(=O)c3ccc(Cl)cc3)n2)cc1,C15991952_decoy,CASP3,Decoy,0,-9.40254,-6.94,-0.64,-6.188497042730808
CCNC(=S)NNC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1,C16681748_decoy,CASP3,Decoy,0,-7.92603,-6.53,-1.24,-7.038143125751097
O=S(=O)(NC[C@@H](NNS(=O)(=O)c1ccccc1)c1ccccc1)c1ccccc1,C16758534_decoy,CASP3,Decoy,0,-7.08484,-7.06,-2.16,-6.631040479586381
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)Nc1c(Cl)cccc1C(F)(F)F,C17274264_decoy,CASP3,Decoy,0,-10.7082,-8.11,-1.69,-17.11700410210796
CCCN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)CCc1ccc(S(N)(=O)=O)cc1,C17915523_decoy,CASP3,Decoy,0,-8.92186,-7.48,-1.21,-7.274145440135956
CCC[C@@H](NC(=O)CCc1nc2cc(S(N)(=O)=O)ccc2n1CCC)c1ccccc1,C18135133_decoy,CASP3,Decoy,0,-9.28967,-7.74,-5.03,-8.673657319494026
O=C(CCc1c[nH]c2ccccc12)NCCNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1,C20716521_decoy,CASP3,Decoy,0,-7.40542,-7.8,-0.73,-5.824914103284569
Cc1cccc(CSCC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)c1,C22916240_decoy,CASP3,Decoy,0,-7.51704,-6.2,-1.66,-8.12663347871549
CSCC[C@@H](NS(=O)(=O)c1cc(C)ccc1C)C(=O)NNC(=O)c1ccc(C)cc1C,C24580180_decoy,CASP3,Decoy,0,-10.3183,-5.3,-4.03,-7.743559457419894
NS(=O)(=O)c1ccc(OCCSc2nnc(NCCc3cccs3)s2)cc1,C24719954_decoy,CASP3,Decoy,0,-9.57796,-5.61,-4.29,-7.730266460511885
Cc1nc(SCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccccc2)sc1CC(N)=O,C24902247_decoy,CASP3,Decoy,0,-11.3017,-5.33,-3.76,-6.846906967334352
Cc1ccc([C@H](NC(=O)CSc2nnc(-c3cccs3)n2CCC(N)=O)C2CC2)cc1,C28949201_decoy,CASP3,Decoy,0,-10.5433,-6.29,-2.6,-6.952343500481056
CCn1c(SCCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)nc2ccccc21,C28853882_decoy,CASP3,Decoy,0,-7.38023,-6.46,-2.01,-5.087519356894734
CCOC(=O)c1cc2c(N)c(C(=O)c3ccc(CCNC(C)=O)c(F)c3)sc2nc1C,C32929380_decoy,CASP3,Decoy,0,-8.68624,-7.49,-1.75,-6.407013512956109
CCCCNC(=O)[C@@H](c1cccc(O)c1)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548327_decoy,CASP3,Decoy,0,-8.09127,-6.23,-2.07,-7.470388915009593
CCCCNC(=O)[C@@H](c1cccc(O)c1)N(C(=O)[C@@H]1CCC(=O)N1)c1cccc(Cl)c1,C36552817_decoy,CASP3,Decoy,0,-7.76652,-7.16,-2.08,-6.3122541366235625
COc1cc(/C(C)=N/NC(=O)[C@@H]2[C@@H](C=C(Cl)Cl)C2(C)C)ccc1OCC(N)=O,C33958955_decoy,CASP3,Decoy,0,-9.56639,-5.65,-2.55,-7.843538679272574
COC[C@H](C)NC(=O)[C@@H]1Sc2ncnc(NCCc3c[nH]c4ccccc34)c2[C@H]1C,C39442505_decoy,CASP3,Decoy,0,-9.48128,-6.83,-3.95,-8.041194297559848
CCONC[C@@H](c1ccc(-c2ccccc2O)cc1)N1CCN[C@H](S(=O)(=O)C(C)C)C1,C39534217_decoy,CASP3,Decoy,0,-8.1287,-7.62,-1.3,-7.783785649736273
N#Cc1ccccc1Sc1ccccc1C(=O)OCC(=O)Nc1ccc(C(N)=O)cc1,C39610537_decoy,CASP3,Decoy,0,-7.57421,-8.35,-1.69,-7.230988331177527
CCNC(=S)N1CCc2c(sc(N)c2C(=O)c2cc(OC)c(OC)c(OC)c2)C1,C40954303_decoy,CASP3,Decoy,0,-8.96094,-6.35,-1.25,-7.978637729625891
CC(C)Cn1c(CCC(N)=O)nnc1S[C@H](C)C(=O)Nc1cccc(Br)c1,C18597470_decoy,CASP3,Decoy,0,-9.9281,-6.89,-2.11,-9.50650920678828
COc1ccc(C(=O)NCCCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1,C46642950_decoy,CASP3,Decoy,0,-9.47852,-7.79,-1.85,-6.619033372431935
O=C(NCCNc1ncc(C(F)(F)F)cc1Cl)c1cccc(Nc2ncccn2)c1,C25339973_decoy,CASP3,Decoy,0,-6.17922,-8.08,-2.93,-6.083950927406309
Cc1ccc([C@@H](OC[C@H](O)Cn2nc(C(N)=O)c3ccccc3c2=O)c2ccccc2)cc1,C58614320_decoy,CASP3,Decoy,0,-7.1191,-7.03,-2.33,-6.373792401925616
C=CCOc1cc(Br)c(/C=N/NC(=O)Cc2csc(N)n2)cc1OC,C59644954_decoy,CASP3,Decoy,0,-8.93198,-5.11,-1.78,-6.239138234258643
COc1ccc(C(=O)NCC(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)cc1,C60035146_decoy,CASP3,Decoy,0,-6.27907,-6.68,-1.59,-5.027360027967364
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCc3cccc(C(N)=O)c3)c2C)cc1,C60366325_decoy,CASP3,Decoy,0,-8.09372,-7.48,-2.89,-8.029782783680702
CC[C@H](C)CC1=C2C(=O)N=C(SCC(=O)Nc3sccc3C(N)=O)N=C2S[C@@H]1C,C38675692_decoy,CASP3,Decoy,0,-8.62398,-6.07,-3.72,-6.568465462464016
CCCCC(=O)NC(Nc1ccc(S(=O)(=O)Nc2nocc2C)cc1)(C(F)(F)F)C(F)(F)F,C02050558_decoy,CASP3,Decoy,0,-6.07644,-6.92,-3.05,-5.805063293462594
CCOC(=O)NC(Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1)(C(F)(F)F)C(F)(F)F,C02050583_decoy,CASP3,Decoy,0,-6.64342,-6.26,-2.11,-6.162015906468482
CCOC(=O)C1=C(c2[nH]c(C)c(C(=O)OCC)c2C)NC(=S)N[C@@H]1c1ccc(OC)c(OC)c1,C03268799_decoy,CASP3,Decoy,0,-9.21647,-5.77,-5.21,-7.355212420775796
CCCCCCNC(=O)c1c(N)n(/N=C/c2cccc(OC)c2OC)c2nc3ccccc3nc12,C02245888_decoy,CASP3,Decoy,0,-8.39546,-6.42,-2.35,-6.114263823694945
CCC(CC)n1c(COc2ccccc2Cl)nnc1SCC(=O)Nc1sccc1C(N)=O,C03404401_decoy,CASP3,Decoy,0,-8.39053,-6.73,-2.22,-7.243185170625727
CC[C@H](C)Oc1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)Nc3nc(C)cc(C)n3)cc2)cc1,C10121155_decoy,CASP3,Decoy,0,-8.32553,-6.8,-1.69,-5.950998982692424
CCOC(=O)c1c(NC(=O)COC(=O)CCCc2c[nH]c3ccccc23)sc(C(=O)NC)c1C,C10625467_decoy,CASP3,Decoy,0,-6.36424,-7.47,-1.48,-7.907869888427637
CCc1ccccc1Nc1nc(N)nc(CSc2nnc(-c3ccc(Cl)cc3)n2CCOC)n1,C12591190_decoy,CASP3,Decoy,0,-9.95816,-6.77,-3.9,-8.179863263718635
CCCCCCNC(=O)c1c(N)n(-c2cc(OC)c(OC)c(OC)c2)c2nc3ccccc3nc12,C02363568_decoy,CASP3,Decoy,0,-8.04591,-6.68,-2.0,-6.7871919002887
CCCOC(=O)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccc(C(C)(C)C)cc2)cc1,C14021981_decoy,CASP3,Decoy,0,-6.99997,-7.44,-2.62,-7.429148498492858
CCOC(=O)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccc(C)c(Br)c2)cc1,C14027547_decoy,CASP3,Decoy,0,-10.8952,-7.19,-0.53,-8.463538348352753
COc1ccc(OC)c(NC(=S)/N=C(\NCCc2cccs2)Nc2nc(C)cc(C)n2)c1,C14158988_decoy,CASP3,Decoy,0,-10.4867,-6.56,-3.93,-9.186826992540022
CCCCN(C(=O)c1cc(Cl)c(OC(C)C)c(OC)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14623891_decoy,CASP3,Decoy,0,-8.27371,-5.1,-1.59,-6.315275329505033
CCCCn1c(N)c(N(C)C(=O)/C=C/c2cc(Cl)c(OCC(C)C)c(OC)c2)c(=O)[nH]c1=O,C14655887_decoy,CASP3,Decoy,0,-7.64259,-5.14,-1.74,-5.93926513564246
COCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(OCC(C)C)cc2)cc1Br,C14662154_decoy,CASP3,Decoy,0,-8.94358,-6.86,-0.98,-6.982748352500951
CCCCn1c(N)c(N(CC(C)C)C(=O)c2cc(Cl)c(OC(C)C)c(OC)c2)c(=O)[nH]c1=O,C14669908_decoy,CASP3,Decoy,0,-7.712,-6.39,-2.58,-7.568122379016933
CCCCN(C(=O)COC(=O)[C@H]1COc2ccc(Cl)cc2C1)c1c(N)n(CCC)c(=O)[nH]c1=O,C16796839_decoy,CASP3,Decoy,0,-8.34267,-7.43,-1.18,-12.057255959707469
CCn1c2ccccc2c2cc(NC(=O)[C@@H](C)Sc3nnc(CCC(N)=O)n3CC(C)C)ccc21,C17274881_decoy,CASP3,Decoy,0,-10.0919,-8.93,-2.27,-11.735165235860377
Cc1ccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)cc1,C17396136_decoy,CASP3,Decoy,0,-9.01199,-6.04,-1.82,-6.840178197785991
Cc1cccc(Cl)c1COc1ccc(/C=N/Nc2nc(SCC(=O)NC(C)(C)C)n[nH]2)o1,C20425115_decoy,CASP3,Decoy,0,-9.12073,-6.93,-2.07,-6.548494010422675
CC(C)(C)c1nnc(CSc2nnc(NN=C(Cc3ccccc3)Cc3ccccc3)n2N)o1,C20919395_decoy,CASP3,Decoy,0,-9.07857,-7.47,-2.81,-8.34986574785419
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(F)cc3)n2)s1,C21077245_decoy,CASP3,Decoy,0,-9.42554,-6.38,-4.73,-6.22233211171417
CC[C@@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C(\C)c3ccccc3)n2)s1,C21081386_decoy,CASP3,Decoy,0,-10.8431,-5.48,-2.01,-7.9106823725657875
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C(\C)c3ccccc3)n2)s1,C21081389_decoy,CASP3,Decoy,0,-10.1832,-6.27,-1.0,-5.696923239382498
CCCOc1c(Cl)cc(C(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1OC,C21285733_decoy,CASP3,Decoy,0,-7.43618,-4.66,-2.57,-6.075962871022247
Nn1c(N/N=C/c2ccccc2OCc2ccc(Cl)cc2)nnc1SCC(=O)c1ccccc1,C21327928_decoy,CASP3,Decoy,0,-8.85371,-7.48,-1.68,-6.24362527694802
COc1cc(NC(=S)N=C(NCc2cccs2)Nc2nc(C)cc(C)n2)cc(OC)c1OC,C14157193_decoy,CASP3,Decoy,0,-10.491,-6.89,-2.33,-9.698202818086097
CCCCN(C(=O)COC(=O)c1cc(SC)ccc1Cl)c1c(N)n(CCC)c(=O)[nH]c1=O,C21678659_decoy,CASP3,Decoy,0,-8.93769,-6.71,-1.3,-7.139915548416389
CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3ccc(OC)cc3OC)n2N)cc1C,C24788370_decoy,CASP3,Decoy,0,-8.48349,-6.79,-2.18,-6.765201780582364
CCCN1C(=O)N[C@@H](c2ccc(NC(=O)Nc3ccc(C#N)cc3)cc2)C(C(=O)OCCOC)=C1C,C34887591_decoy,CASP3,Decoy,0,-8.73468,-5.32,-1.53,-5.538537773675383
COc1ccc2c(CCN/C(=N\C(=O)CSc3ncccn3)Nc3nc(C)cc(C)n3)c[nH]c2c1,C08758591_decoy,CASP3,Decoy,0,-7.60694,-7.59,-2.05,-7.23988108029453
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(C(=O)CNC(=O)c1ccccc1)c1ccccc1Cl,C36548308_decoy,CASP3,Decoy,0,-7.53025,-6.6,-3.81,-6.926229972174462
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(C(=O)CNC(=O)c1ccccc1)c1ccccc1Cl,C36548309_decoy,CASP3,Decoy,0,-8.09038,-7.86,-2.88,-8.44857193762936
COc1cc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccc(C)o2)C(=O)c2ccccc2O)ccc1O,C36595478_decoy,CASP3,Decoy,0,-9.01532,-6.72,-4.24,-7.209322610515211
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccc(N(C)C)cc2)o1,C36597835_decoy,CASP3,Decoy,0,-8.62675,-7.49,-4.62,-7.189140960906228
Cc1ccc(CN(C(=O)CNC(=O)c2ccccc2)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccc(O)cc2)o1,C36600880_decoy,CASP3,Decoy,0,-8.20983,-7.97,-2.22,-7.669225988936456
CCCCn1c(N)c(N(CCC(C)C)C(=O)[C@@H](C)Oc2ccc(Cl)cc2C)c(=O)[nH]c1=O,C36836388_decoy,CASP3,Decoy,0,-6.35419,-6.59,-2.92,-6.007814837119291
CCCCn1c(N)c(N(CC(C)C)C(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c(=O)[nH]c1=O,C12852354_decoy,CASP3,Decoy,0,-7.60469,-7.72,-4.16,-6.219924847794242
CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc1nc(-c2ccc(Cl)cc2)cs1,C40174518_decoy,CASP3,Decoy,0,-7.93454,-7.23,-1.18,-9.62634934643452
CCCCOc1ccc([C@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OCC,C38705894_decoy,CASP3,Decoy,0,-7.0315,-5.77,-1.87,-6.558855264605578
CCCCCN(C(=O)CCc1ncc(-c2ccc(C)c(C)c2)o1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C45727032_decoy,CASP3,Decoy,0,-6.95102,-6.04,-3.92,-6.040358297412336
CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(OCC)c(OC)c4)c32)cc1OCC,C09292496_decoy,CASP3,Decoy,0,-8.39723,-6.09,-3.16,-6.989582042063591
O=C(CSc1n[nH]c(N/N=C/c2cccc([N+](=O)[O-])c2)n1)NCc1cccc(C(F)(F)F)c1,C58992900_decoy,CASP3,Decoy,0,-6.75821,-7.15,-0.84,-5.5129321722273215
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccccc3Br)n[nH]2)cc1,C59005481_decoy,CASP3,Decoy,0,-8.68221,-7.32,-1.8,-6.530333110347646
CCCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C(/C)c4ccccc4)n3)cc2s1,C59020334_decoy,CASP3,Decoy,0,-9.33974,-7.53,-1.94,-6.653263445657349
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(C)\C=C\c3ccccc3)n2)s1,C59023413_decoy,CASP3,Decoy,0,-10.8016,-7.82,-2.15,-7.405184679338708
Cc1csc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3OCc3ccccc3Cl)n2)n1,C59038973_decoy,CASP3,Decoy,0,-10.7616,-8.24,-1.28,-8.405507635831404
CCCCOc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)c1cccc([N+](=O)[O-])c1,C14650315_decoy,CASP3,Decoy,0,-7.16156,-6.39,-3.49,-8.77345141669201
CCCCOc1ccc([C@@H]2c3c(-c4cc(C)ccc4O)n[nH]c3C(=O)N2CCCO)cc1OCC,C27749163_decoy,CASP3,Decoy,0,-9.23018,-5.51,-2.72,-7.191390836016585
CCOC(=O)C1=C(CSc2n[nH]c(/C=C/c3ccccc3)n2)NC(=O)N[C@@H]1c1ccc(OC)cc1,C12835301_decoy,CASP3,Decoy,0,-7.52807,-7.29,-1.48,-6.261036093609305
COc1ccc(Nc2nc(NCc3ccco3)nc(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2)cc1,C06156942_decoy,CASP3,Decoy,0,-8.22759,-6.62,-3.62,-6.652069340957621
CCOc1cccc(-c2c(C(=O)N/N=C/c3ccccc3OCC(=O)[O-])nnn2-c2nonc2N)c1,C01874938_decoy,CASP3,Decoy,0,-6.98662,-7.6,-1.73,-6.488891068614042
COc1cc(/C=N/Nc2nc(Nc3ccc(F)cc3)nc(N3CCCCC3)n2)ccc1OCC(=O)[O-],C08853512_decoy,CASP3,Decoy,0,-7.68378,-6.77,-2.55,-6.6404471676606605
CCCC[C@@H](NC(=O)CCc1c(C)c2cc3c(C)c(C)oc3c(C)c2oc1=O)C(=O)NCCC(=O)[O-],C08876278_decoy,CASP3,Decoy,0,-8.02838,-8.48,-1.63,-7.238328390383819
O=C([O-])CCCCCNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1,C09065103_decoy,CASP3,Decoy,0,-7.07298,-6.03,-2.51,-5.140084480259604
CN(Cc1c(C(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)nnn1-c1nonc1N)c1ccccc1,C09293448_decoy,CASP3,Decoy,0,-7.85235,-8.05,-3.42,-7.458095454597309
CCCCNc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C)c1C,C10513871_decoy,CASP3,Decoy,0,-9.39148,-7.43,-2.92,-7.626282562340912
Cc1oc2cc3oc(=O)c(CCC(=O)N[C@H](CCCCNC(N)=O)C(=O)NCC(=O)[O-])c(C)c3cc2c1C,C11865605_decoy,CASP3,Decoy,0,-8.82145,-8.52,-1.62,-7.301516463107995
CC[C@@H](C)[C@H](NC(=O)CCc1c(C)c2cc3c(C)coc3c(C)c2oc1=O)C(=O)NCCCCCC(=O)[O-],C12888407_decoy,CASP3,Decoy,0,-8.95613,-8.65,-1.51,-11.119059718801122
CCCCNC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCCC,C13044538_decoy,CASP3,Decoy,0,-8.22949,-7.06,-4.85,-7.439449725257852
CCc1ccc(OCC(=O)N/N=C(\C)c2ccc(S(=O)(=O)Nc3ccc(C(=O)[O-])cc3)cc2)cc1,C13060988_decoy,CASP3,Decoy,0,-8.28488,-6.54,-3.47,-5.638373992983116
CCOc1ccc(OCc2ccc(C(=O)NNS(=O)(=O)c3cc(C(=O)[O-])cc(C)c3C)cc2)cc1,C13078661_decoy,CASP3,Decoy,0,-8.32741,-7.14,-2.77,-6.185272642357934
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)ccc1OCCC(C)C,C13079093_decoy,CASP3,Decoy,0,-6.69281,-7.18,-2.85,-6.732913226589735
CN(CCCNc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1[N+](=O)[O-])c1ccccc1,C13192703_decoy,CASP3,Decoy,0,-7.61553,-8.08,-2.43,-7.677397544077892
Cc1ccc(OCCNc2ccc(S(=O)(=O)Nc3ccc(C(=O)[O-])cc3)cc2[N+](=O)[O-])cc1,C13211375_decoy,CASP3,Decoy,0,-7.14393,-6.39,-4.84,-5.761357308338882
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(NCCSc3ccccc3)c([N+](=O)[O-])c2)cc1,C13212591_decoy,CASP3,Decoy,0,-7.06927,-6.25,-2.87,-6.599133834221643
O=C([O-])c1ccccc1C(=O)c1ccc(NCCNc2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1,C13212716_decoy,CASP3,Decoy,0,-6.10768,-7.07,-1.59,-5.783351141956227
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(NCCCOc3ccccc3F)c([N+](=O)[O-])c2)cc1,C13240845_decoy,CASP3,Decoy,0,-6.74687,-7.28,-0.95,-6.8701431660433725
CC(C)CN(C(=O)CN(C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C13272708_decoy,CASP3,Decoy,0,-6.34849,-6.85,-0.5,-5.226057541013119
CCCNc1nc(N[C@@H](Cc2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)C(=O)[O-])nc(OC)n1,C13442587_decoy,CASP3,Decoy,0,-10.3423,-6.44,-2.59,-7.284911052135171
O=C([O-])c1ccccc1C(=O)c1ccc(N[C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1,C13461710_decoy,CASP3,Decoy,0,-5.26115,-7.9,-1.96,-6.258411789620576
O=C([O-])c1ccccc1C(=O)c1ccc(N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1,C13461717_decoy,CASP3,Decoy,0,-5.48529,-8.32,-1.84,-6.693074479237749
CC[C@@H](NC(=O)CCc1c(C)c2cc3c4c(oc3cc2oc1=O)CCCC4)C(=O)NCCCCCC(=O)[O-],C13591524_decoy,CASP3,Decoy,0,-7.03559,-7.45,-3.03,-6.339233145743536
CC[C@H](C)[C@H](NC(=O)CCc1c(C)c2cc3c(C)c(C)oc3c(C)c2oc1=O)C(=O)NCCCC(=O)[O-],C15969638_decoy,CASP3,Decoy,0,-8.17996,-7.39,-1.62,-6.422314639158141
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@]1(CC(=O)[O-])CC(c2ccc(OCC(N)=O)cc2)=NO1,C15972539_decoy,CASP3,Decoy,0,-8.44303,-5.9,-0.17,-7.894275825003653
CC[C@H](C)[C@H](NC(=O)CCc1c(C)c2cc3c(C)coc3c(C)c2oc1=O)C(=O)NCCCCCC(=O)[O-],C16025441_decoy,CASP3,Decoy,0,-8.02526,-7.69,-1.37,-6.539389458910246
COc1ccc(NC(=O)CSc2nnc(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2N)cc1OC,C20527405_decoy,CASP3,Decoy,0,-7.73958,-5.36,-1.39,-5.194291616650282
COc1cc(NC(=O)CSc2nnc(N/N=C/c3cc([N+](=O)[O-])ccc3[O-])n2N)cc(OC)c1,C20527407_decoy,CASP3,Decoy,0,-4.99781,-7.02,-2.36,-6.072537048228281
COc1cc(/C=N/Nc2nc(SCCC(=O)Nc3nc4ccccc4s3)n[nH]2)cc([N+](=O)[O-])c1[O-],C20836314_decoy,CASP3,Decoy,0,-8.29765,-8.14,-0.98,-7.015770871744549
COc1cc(/C=N/Nc2nc(SCC(=O)N(C3CCCCC3)C3CCCCC3)n[nH]2)cc([N+](=O)[O-])c1[O-],C20836316_decoy,CASP3,Decoy,0,-6.08462,-6.89,-2.15,-6.148704702017002
COc1cc(/C=N/Nc2nc(SCC(=O)OC3CCCCC3)n[nH]2)cc([N+](=O)[O-])c1[O-],C21084185_decoy,CASP3,Decoy,0,-8.48361,-7.79,-2.32,-6.864305781217615
COc1cccc(C(=O)CSc2nnc(N/N=C/c3cc(OC)c([O-])c([N+](=O)[O-])c3)n2N)c1,C21326830_decoy,CASP3,Decoy,0,-7.14571,-6.64,-1.4,-5.304016680796213
COc1cc(/C=N/Nc2nnc(SCC(=O)NCc3ccc(F)cc3)n2N)cc([N+](=O)[O-])c1[O-],C21326939_decoy,CASP3,Decoy,0,-7.15664,-7.69,-2.74,-8.547862520817672
COc1cc(/C=N/NC(=S)Nc2cccc(C(=O)[O-])c2)ccc1OCc1ccc([N+](=O)[O-])cc1,C02749405_decoy,CASP3,Decoy,0,-7.38934,-6.66,-2.83,-5.869303039609624
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,C31166276_decoy,CASP3,Decoy,0,-6.87966,-7.79,-2.5,-6.6574298695815965
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,C31167451_decoy,CASP3,Decoy,0,-12.28,-8.0,-2.13,-13.37454332580795
CCCCNC(=O)C[NH+]1CCN(c2ccc(C(=O)[O-])cc2[N-]S(=O)(=O)c2ccc(C)cc2)CC1,C33253263_decoy,CASP3,Decoy,0,-7.86302,-9.21,-2.93,-8.418248053849469
CCCCNC(=O)[C@@H](c1ccccc1O)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499690_decoy,CASP3,Decoy,0,-6.45174,-5.69,,99.0
CCCCNC(=O)[C@@H](c1ccc(O)cc1)N(CCC)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36570102_decoy,CASP3,Decoy,0,-7.00313,-6.36,-1.43,-7.220201233583269
CCCCNC(=O)[C@H](c1ccc(O)cc1)N(CCC)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36570103_decoy,CASP3,Decoy,0,-7.36219,-5.88,-3.37,-6.003978939919662
CCCCNC(=O)[C@@H](c1c(O)cc(O)cc1O)N(CCC)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36570136_decoy,CASP3,Decoy,0,-6.6402,-5.17,-2.38,-6.1206544359753
CCCCNC(=O)[C@H](c1ccccc1O)N(CCC)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36570159_decoy,CASP3,Decoy,0,-7.83015,-5.66,-4.73,-7.518440319129586
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])C(C)(C)C,C36586014_decoy,CASP3,Decoy,0,-6.36535,-5.36,-3.17,-5.699780787288165
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@H](O)[C@H]1O,C04475123_decoy,CASP3,Decoy,0,-8.09719,-7.49,-1.67,-6.808473653254439
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)[O-])cc4)nc32)[C@@H](O)[C@@H]1O,C03872016_decoy,CASP3,Decoy,0,-6.09463,-7.02,-3.23,-5.7763175570953065
COc1ccc2c(CCNC(/N=C(\[O-])COc3ccccc3)=N/c3nc(C)cc(C)n3)c[nH]c2c1,C08758467_decoy,CASP3,Decoy,0,-8.46532,-7.84,-2.09,-8.769944419572289
O=C([O-])CCCCCNC(=O)/C(=C\c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1,C59730030_decoy,CASP3,Decoy,0,-7.22272,-5.33,-1.19,-6.177428221484131
CCCCNC(=O)CN1CCN(c2ccc(NS(=O)(=O)c3ccc(F)cc3)c(C(=O)[O-])c2)CC1,C33259863_decoy,CASP3,Decoy,0,-8.99607,-7.41,-3.17,-9.09169129596968
CCCCNC(=O)CN1CCN(c2ccc(NS(=O)(=O)c3ccc(C)cc3)c(C(=O)[O-])c2)CC1,C33259950_decoy,CASP3,Decoy,0,-9.38383,-7.54,-3.11,-9.906957508115674
CCCCNC(=O)CN1CCN(c2ccc(NS(=O)(=O)c3ccccc3C)c(C(=O)[O-])c2)CC1,C33259984_decoy,CASP3,Decoy,0,-9.51716,-6.39,-1.54,-6.661356851402304
CCCn1c(N)c(C(=O)COC(=O)c2cc3c(s2)CCCCC3)c(=O)[nH]c1=O,C05362115_decoy,CASP3,Decoy,0,-7.31198,-5.79,-0.44,-5.433156322380079
CC(C)Cn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1ccco1,C05937653_decoy,CASP3,Decoy,0,-7.35814,-6.0,-3.24,-6.379313158914445
Cc1occc1-c1nnc(S[C@@H](C(=O)NC(N)=O)C(C)C)n1Cc1ccccc1,C06532198_decoy,CASP3,Decoy,0,-9.32152,-8.12,-1.74,-9.836088926541107
CCCCn1c(N)c(N(Cc2ccco2)C(=O)Cc2cccs2)c(=O)[nH]c1=O,C06590602_decoy,CASP3,Decoy,0,-7.72866,-6.06,-3.54,-6.556497894398762
C=CCn1c(S[C@@H](C)C(=O)Nc2sccc2C(N)=O)nnc1-c1ccoc1C,C07172229_decoy,CASP3,Decoy,0,-7.7012,-7.25,-1.25,-7.814893772494136
COc1cc2c(c3oc(=O)c(CCC(=O)NC(C)(CO)CO)c(C)c13)CCC(C)(C)O2,C08764413_decoy,CASP3,Decoy,0,-7.27516,-7.23,-0.68,-5.648000966733232
O=C(CSc1nnc(NC(=O)Nc2ccc(Cl)cc2)s1)NC[C@H]1CCCO1,C09324306_decoy,CASP3,Decoy,0,-6.44397,-7.09,-0.7,-5.490686114981324
O=C(CC[C@@H]1NC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1=O)NCc1ccco1,C09419583_decoy,CASP3,Decoy,0,-7.82555,-6.4,-0.71,-6.151680300700581
NC(=O)c1c(NC(=O)COC(=O)/C=C/c2ccc3c(c2)OCCO3)sc2c1CCC2,C09819219_decoy,CASP3,Decoy,0,-7.93156,-6.89,-0.55,-5.420489857899568
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cn(C)c3ccccc23)c1,C10736353_decoy,CASP3,Decoy,0,-7.82597,-8.24,-1.62,-6.641048952481707
O=C(Cc1c[nH]c2ccccc12)NCCNS(=O)(=O)c1cccc2nsnc12,C12406833_decoy,CASP3,Decoy,0,-8.22627,-7.95,-2.04,-8.79512045076834
COc1cc(NC(=S)/N=C(/Nc2nc(C)cc(C)n2)NC2CC2)cc(OC)c1,C14156317_decoy,CASP3,Decoy,0,-7.28203,-6.91,-1.65,-7.639848826217655
CCOC(=O)C1=C(CSCc2nc3sc(C)c(C)c3c(=O)[nH]2)NC(=O)N[C@H]1C,C14184155_decoy,CASP3,Decoy,0,-9.3703,-7.03,-1.28,-6.566935560075323
CCCCN(C(=O)c1cccnc1SC)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14624171_decoy,CASP3,Decoy,0,-6.3184,-6.03,-0.66,-5.912895151496959
NC(=O)c1ccc(-c2nnn(C[C@H](O)COc3ccc(Cl)cc3Cl)n2)cc1,C15583830_decoy,CASP3,Decoy,0,-8.04235,-7.64,-1.14,-6.708254631851891
CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C16552885_decoy,CASP3,Decoy,0,-8.21306,-6.58,-1.04,-6.764396026773088
CCOc1ccc(-c2nnc(SCC(=O)Nc3sccc3C#N)n2N)cc1,C22220996_decoy,CASP3,Decoy,0,-7.11417,-5.53,-0.36,-5.476978019668821
Cc1csc(NC(=O)CSc2nc(CC(=O)NCc3cccs3)cc(=O)[nH]2)n1,C22629320_decoy,CASP3,Decoy,0,-10.4673,-7.78,-1.47,-9.793403487223925
Cc1noc(C)c1COc1ccc(C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1,C23445440_decoy,CASP3,Decoy,0,-9.72564,-6.83,-2.69,-7.663188711832889
Cc1cc(-c2csc(S(=O)(=O)NCCc3ccc(S(N)(=O)=O)cc3)c2)on1,C33169525_decoy,CASP3,Decoy,0,-8.49482,-7.57,-0.88,-7.045346316385099
COc1ccc(Cc2nnc(SCC(=O)NC3(C#N)CCCCC3)n2N)cc1,C04915816_decoy,CASP3,Decoy,0,-8.53683,-6.41,-0.29,-8.107246408090411
CCc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](CC)(c3ccccc3)C2=O)cc1,C12989105_decoy,CASP3,Decoy,0,-6.45997,-7.72,-1.45,-8.549492435329968
O=C(NNC(=S)Nc1ccn(Cc2ccccc2F)n1)[C@H]1C=C(C2CC2)N=N1,C39237996_decoy,CASP3,Decoy,0,-9.71825,-6.85,-0.48,-7.905673828467758
N#Cc1cc2cc3c(cc2nc1NCCNC(=S)NC[C@@H]1CCCO1)OCO3,C40011616_decoy,CASP3,Decoy,0,-8.86454,-6.67,-1.04,-6.975059088963237
CC[C@H](C(=O)Nc1nc(-c2ccc(OC)cc2)cs1)n1c(N)nnc1SC,C40172169_decoy,CASP3,Decoy,0,-8.21105,-5.93,-0.62,-8.501926509269405
CCOc1ccccc1NC(=O)C(=O)NCC1CCN(C(=O)Nc2cccs2)CC1,C43943552_decoy,CASP3,Decoy,0,-8.44319,-6.74,-1.92,-8.085316607604275
C[C@H](OC(=O)c1csc(-c2ccsc2)n1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C45599829_decoy,CASP3,Decoy,0,-10.3073,-6.46,-1.31,-7.3565740405453
CC(C)(C)OC(=O)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1,C46235314_decoy,CASP3,Decoy,0,-7.92203,-5.94,-2.79,-6.208594977426639
Cc1cc(/C=C(\C#N)C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)c(C)n1CCC(C)C,C46585730_decoy,CASP3,Decoy,0,-8.95391,-5.77,-1.2,-7.387808777995298
CCCOc1ccc([C@H](C)NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1OC,C46673017_decoy,CASP3,Decoy,0,-8.02884,-6.56,-2.39,-7.033881505632986
Cc1ccc(S(=O)(=O)NCCNC(=O)Nc2ccccc2-n2cccn2)cc1,C48152495_decoy,CASP3,Decoy,0,-4.77654,-5.94,-2.02,-4.867463013553415
Cc1ccc(C(N)=O)c(OC(=O)Cc2csc(NC(=O)c3ccoc3C)n2)c1,C49400456_decoy,CASP3,Decoy,0,-7.86155,-7.04,-1.64,-7.04722172378813
CCOc1ccc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCO)cc1OC,C06753020_decoy,CASP3,Decoy,0,-7.85423,-6.97,-2.64,-8.305765651651717
CS(=O)(=O)NCCCNC(=O)Nc1cccc(Cl)c1Oc1cccnc1,C54504663_decoy,CASP3,Decoy,0,-8.9703,-6.66,-2.15,-7.125282650114973
O=C1NC(=O)[C@H](CCC(=O)OCC(=O)c2c(-c3ccccc3)[nH]c3ccccc23)N1,C57675164_decoy,CASP3,Decoy,0,-5.9385,-7.76,-2.23,-6.347791298511911
O=C(CSc1nnc(NC[C@H]2CCCO2)s1)NC(=O)NC1CCCCC1,C16330945_decoy,CASP3,Decoy,0,-8.07136,-6.33,-0.64,-6.058563297666058
CSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(C)o2)n1,C59020127_decoy,CASP3,Decoy,0,-8.13552,-5.88,-1.59,-5.674527917833849
C/C(=N/Nc1nc(SCC(=O)Nc2ccc(C)cc2F)n[nH]1)c1ccncc1,C59023711_decoy,CASP3,Decoy,0,-10.5094,-5.95,-0.68,-7.568603800421328
C/C(=N/Nc1nc(SCC(=O)Nc2cc(F)ccc2F)n[nH]1)c1ccccn1,C06213063_decoy,CASP3,Decoy,0,-8.54978,-7.7,-1.5,-7.364778343458174
O=C(CSc1n[nH]c(N/N=C/c2ccncc2)n1)NCc1cccc(C(F)(F)F)c1,C59311010_decoy,CASP3,Decoy,0,-7.51365,-6.56,-2.28,-5.392587763010175
Nn1c(N/N=C/c2cccnc2)nnc1SCC(=O)C1C2CC3CC(C2)CC1C3,C20292606_decoy,CASP3,Decoy,0,-8.48126,-7.18,-2.02,-5.700498733780125
CCN(C)C(=O)[C@@H](C)Sc1n[nH]c(N/N=C/c2cc(Br)ccc2O)n1,C59816012_decoy,CASP3,Decoy,0,-8.44402,-5.47,-1.47,-5.778189060463061
COc1cc(C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)ccc1OCc1cscn1,C59924549_decoy,CASP3,Decoy,0,-9.07075,-6.12,-4.45,-8.28112333649132
CC(C)(C)OC(=O)N1CCN(CCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1,C60090021_decoy,CASP3,Decoy,0,-8.28793,-6.65,-2.05,-7.745024171724054
CC(C)(C)OC(=O)NCCNC(=O)NCc1nn(-c2ccccc2)c2c1CCC2,C62657661_decoy,CASP3,Decoy,0,-7.78576,-7.38,-3.62,-7.296199185020723
CC(C)c1ccc(-n2ccnc2SCC(=O)NCC(=O)Nc2cn[nH]c2)cc1,C65310401_decoy,CASP3,Decoy,0,-5.55294,-7.09,-2.22,-6.568216365815936
CCCCn1c(N)c(N(Cc2nnc(SC)s2)CC(C)C)c(=O)[nH]c1=O,C65950209_decoy,CASP3,Decoy,0,-9.1347,-5.56,-0.98,-8.015809211276553
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)cc1,C66673832_decoy,CASP3,Decoy,0,-6.16684,-6.22,-1.97,-5.454743650895631
CCNC(=O)c1ccc(C)c(NC(=O)NCCCc2nnc3n2CCCCC3)c1,C67260752_decoy,CASP3,Decoy,0,-8.04989,-6.24,-3.18,-6.41170414987175
Cc1cc(NC(=O)Cn2c(-c3ccc(C(F)(F)F)cc3)nc(C)c(CCO)c2=O)[nH]n1,C67301420_decoy,CASP3,Decoy,0,-7.67918,-6.59,-2.08,-5.979680785399813
COc1ccc(CCNC(=O)c2nnn(-c3ccccc3Cl)c2N)cc1OC,C04984983_decoy,CASP3,Decoy,0,-6.87992,-6.95,-1.64,-6.643159204058239
CC(C)[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)C(=O)NC(N)=O,C06531694_decoy,CASP3,Decoy,0,-8.18219,-7.43,-2.24,-7.995172601979978
Cc1nn(-c2ccc(C(=O)OCC(=O)Nc3sccc3C(N)=O)cc2)c(C)c1Cl,C09248613_decoy,CASP3,Decoy,0,-9.48395,-7.17,-1.3,-7.131823292965777
Nc1nnc(SCC(=O)OCC(=O)Nc2nc(-c3ccccc3)cs2)s1,C03331943_decoy,CASP3,Decoy,0,-8.83909,-6.16,-1.58,-6.460750581089494
CC1CCN(c2nnc(S[C@H](C)C(=O)Nc3sccc3C(N)=O)n2C2CC2)CC1,C11986304_decoy,CASP3,Decoy,0,-7.89232,-7.08,-1.96,-6.504995505660873
NS(=O)(=O)c1cccc(NC(=O)COC(=O)/C=C/c2nc3ccccc3s2)c1,C13097331_decoy,CASP3,Decoy,0,-10.9805,-8.0,-2.8,-10.2901496115573
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1,C03430011_decoy,CASP3,Decoy,0,-7.99282,-7.13,-1.7,-7.820552212524158
CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)c1C,C14845405_decoy,CASP3,Decoy,0,-7.46475,-7.92,-1.52,-6.71310769961422
CC(C)(C)c1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(N3CCCC3=O)cc2)cc1,C14847477_decoy,CASP3,Decoy,0,-7.50039,-7.11,-2.9,-5.362100819510069
C=CCOC(=O)C1=C(C)Nc2[nH]c(=O)[nH]c(=O)c2[C@H]1c1ccc(OC(F)F)cc1,C15230827_decoy,CASP3,Decoy,0,-6.20512,-5.88,-1.0,-5.474726006261293
NC(=O)c1ccc(-c2nnn(C[C@@H](O)COc3ccc(Cl)cc3Cl)n2)cc1,C15583827_decoy,CASP3,Decoy,0,-9.3313,-6.42,-2.11,-7.440807693190248
N#CC1(NC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)CCCCC1,C16371303_decoy,CASP3,Decoy,0,-7.89983,-6.21,-2.9,-5.531443477570855
CCOc1ccc(C(=O)NCC(=O)NNC(=O)CN2CCCc3ccccc32)cc1,C17402500_decoy,CASP3,Decoy,0,-6.88436,-7.65,-2.8,-6.086578786450396
Cc1nnc(SCC(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)n1N,C20842370_decoy,CASP3,Decoy,0,-9.04653,-6.98,-1.34,-7.223557227419842
Cc1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cccnc3)n2)cc1Cl,C21038621_decoy,CASP3,Decoy,0,-7.88691,-5.39,-0.87,-5.230832033409554
CCOC(=O)c1cnn(-c2ccc(C(=O)NCc3ccc(N(C)C)cc3)cc2)c1N,C21652142_decoy,CASP3,Decoy,0,-6.84478,-7.51,-1.35,-7.144297005808848
CCCN(CC(=O)Nc1ccccc1C)C(=O)CSc1ncc(C#N)c(N)n1,C22033405_decoy,CASP3,Decoy,0,-7.04714,-4.91,-1.84,-6.565651109311504
O=C(CNC(=O)CNC(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1,C24573871_decoy,CASP3,Decoy,0,-8.61949,-6.1,-1.85,-8.38345406885454
CCCCn1c(O)nnc1S[C@H](C)C(=O)NCC(=O)Nc1c(C)cccc1C,C24662831_decoy,CASP3,Decoy,0,-6.59189,-7.45,-5.41,-6.583371085961164
C[C@]1(CSc2ccccc2C(=O)NCCCn2cnc3ccccc32)NC(=O)NC1=O,C24835933_decoy,CASP3,Decoy,0,-7.69024,-7.66,-1.93,-6.101647005310358
Cc1cc(C)cc(N(CCC#N)C(=O)COC(=O)c2ccc(CNC(N)=O)cc2)c1,C25830269_decoy,CASP3,Decoy,0,-7.78851,-7.86,-2.26,-6.7768098331661895
Cc1ccc(C(=O)CCC(=O)NN2C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C2=O)cc1C,C28851504_decoy,CASP3,Decoy,0,-7.3965,-7.45,-1.37,-5.544322286063655
Cc1cccc(-c2nnc(SCC(=O)N[C@H](C)c3ccco3)n2CC(N)=O)c1,C32745468_decoy,CASP3,Decoy,0,-6.9291,-6.8,-0.32,-5.722346271241207
CCOC(=O)c1c(C)oc2ccc(OCC(=O)Nc3sccc3C(N)=O)cc12,C32810287_decoy,CASP3,Decoy,0,-8.74383,-5.94,-0.96,-6.415077202123115
N#Cc1c(CCCNC(=O)Cc2noc3ccccc23)nn(-c2ccccc2)c1N,C33022402_decoy,CASP3,Decoy,0,-6.78008,-6.3,-1.97,-5.967432424685058
CCCCSc1nnc(NC(=O)CSc2nc(N)c(C#N)cc2C#N)s1,C39335059_decoy,CASP3,Decoy,0,-9.168,-6.17,-1.18,-6.683245836481214
CC1=C([C@@H](C)NC(=O)CCc2nnc(CCc3c[nH]c4ccccc34)o2)[C@@H](C)NN1C,C39356565_decoy,CASP3,Decoy,0,-8.41864,-8.09,-1.35,-9.216690020766976
NC(=O)c1ccc(NC(=O)COC(=O)/C=C/c2c(Cl)nc3sccn23)cc1,C39608474_decoy,CASP3,Decoy,0,-9.42837,-7.49,-1.29,-7.289246219248263
CCSc1nnc(N)n1[C@@H](C)C(=O)Nc1nc(-c2ccc(OC)cc2)cs1,C40172268_decoy,CASP3,Decoy,0,-7.777,-5.64,-0.8,-5.717211561699868
NC(=O)c1ccc(-c2nnn(C[C@H](O)COc3cc(Cl)ccc3Cl)n2)cc1,C45860768_decoy,CASP3,Decoy,0,-8.26173,-6.14,-0.66,-5.9536312160599385
CCCCOc1ccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1OC,C45887431_decoy,CASP3,Decoy,0,-7.87377,-6.66,-1.44,-6.46808939083877
Cc1ccc([C@H](CNC(=O)c2cccc(NC(=O)NC(C)C)c2)N2CCOCC2)o1,C46670134_decoy,CASP3,Decoy,0,-8.20795,-7.44,-1.31,-6.551352394874398
C=CCn1c(N)cc(=O)nc1S[C@H](C)C(=O)Nc1ccc(C(=O)OCC)cc1,C01123626_decoy,CASP3,Decoy,0,-7.15494,-6.42,-0.57,-5.660030615564546
CSCC[C@H](NC(=O)Nc1cccc(NC(C)=O)c1)c1nnc2ccccn12,C54007471_decoy,CASP3,Decoy,0,-7.94956,-6.79,-2.39,-8.312512861347212
CSCC[C@@H](NC(=O)Nc1cccc(NC(C)=O)c1)c1nnc2ccccn12,C54007472_decoy,CASP3,Decoy,0,-9.26463,-6.26,-1.68,-6.716522490803611
NC(=O)COc1ccc(/C=C/C(=O)Nc2cc(N3CCOC3=O)ccc2F)cc1,C56209411_decoy,CASP3,Decoy,0,-8.39567,-6.73,-1.27,-6.2356629126622005
Nn1c(SCCCC(=O)N/N=C/C=C/c2ccccc2)nnc1-c1ccncc1,C06337446_decoy,CASP3,Decoy,0,-6.40237,-6.72,-2.31,-5.785329407096458
O=C(CSc1n[nH]c(N/N=C/c2cccnc2)n1)Nc1ccc(F)c(Cl)c1,C59015920_decoy,CASP3,Decoy,0,-9.00852,-5.8,-2.93,-6.028806754209047
COc1ccc(CNC(=O)CSc2n[nH]c(N/N=C/c3cccs3)n2)cc1,C59016389_decoy,CASP3,Decoy,0,-9.57423,-6.96,-2.19,-6.6652097678797535
Cc1ccc(/C=N/Nc2nc(SCC(=O)NCCc3ccc(F)cc3)n[nH]2)o1,C59020052_decoy,CASP3,Decoy,0,-8.43992,-4.92,-0.87,-5.814496019287767
C/C(=N/Nc1nc(SCC(=O)Nc2ccccc2Cl)n[nH]1)c1ccccn1,C06213313_decoy,CASP3,Decoy,0,-10.7149,-6.97,-0.52,-6.446081998204733
O=C(CSc1n[nH]c(N/N=C/c2ccncc2)n1)Nc1ccc(Cl)cc1F,C59311048_decoy,CASP3,Decoy,0,-9.66668,-6.37,-1.31,-7.892813416855363
C=CCn1nc(C)c(/C=N/Nc2nnc(SCc3ccc(F)cc3)n2N)c1C,C59829879_decoy,CASP3,Decoy,0,-7.79674,-7.82,-1.13,-6.577303894703184
CC[C@@H](C)NC(=O)[C@H](C)NC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O,C60167422_decoy,CASP3,Decoy,0,-6.39621,-6.91,-1.36,-5.52665162460815
Cn1c(=O)[nH]c(=O)c2[nH]c(CCC(=O)N[C@@H](CC3CCCCC3)c3ccccc3)nc21,C60360849_decoy,CASP3,Decoy,0,-6.92188,-7.6,-1.13,-6.821083153054889
CC(C)(C)OC(=O)NCCNC(=O)NCCc1cc(Cl)c2c(c1)OCCO2,C62650432_decoy,CASP3,Decoy,0,-8.74728,-6.62,-1.18,-6.460173605746537
CC[NH+](CC)c1ccc(NC(=O)C2CCN(S(=O)(=O)c3c[nH]cn3)CC2)c(C)c1,C06746131_decoy,CASP3,Decoy,0,-6.26858,-6.0,-1.4,-4.373261178446541
Nc1c(-c2nnc(SCC(=O)NC3CC3)n2C[C@H]2CCCO2)sc2ncccc12,C64794587_decoy,CASP3,Decoy,0,-9.05793,-5.38,-1.95,-6.335271963926312
CC(C)NC(=O)Nc1ccc(C(=O)NCCCc2nnc3n2CCCCC3)cc1,C67177044_decoy,CASP3,Decoy,0,-6.48719,-6.55,-1.91,-4.910778148032314
COC(=O)N(C)c1ccc(NC(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)cc1,C67327772_decoy,CASP3,Decoy,0,-6.27541,-6.77,-2.05,-4.890653909793052
CCCc1n[nH]c2c1[C@H](c1cc(OC)c(OC(C)=O)c(OC)c1)C(C#N)=C(N)O2,C00806431_decoy,CASP3,Decoy,0,-7.07088,-5.64,-1.71,-6.540088982694412
C=CCn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1cccnc1,C02447355_decoy,CASP3,Decoy,0,-7.80548,-8.25,-3.05,-8.018341560542293
CCCn1nc(C)c2c(C(=O)NNC(=S)NC)cc(-c3cnn(C)c3C)nc21,C08782505_decoy,CASP3,Decoy,0,-7.60143,-5.38,-1.63,-6.117429630228281
COc1cc(/C=C/C(=O)Nc2nnc(SCC(N)=O)s2)cc(OC)c1OC,C08822256_decoy,CASP3,Decoy,0,-8.39336,-5.58,-1.69,-5.854067524374396
CCCCn1c(N)c(N(C)C(=O)/C=C/c2cn(CCC#N)c3ccccc23)c(=O)[nH]c1=O,C09647962_decoy,CASP3,Decoy,0,-8.97006,-7.93,-2.69,-8.214667941131202
NC(=O)c1c(NC(=O)CSc2nnnn2C[C@@H]2CCCO2)sc2c1CCCC2,C09864691_decoy,CASP3,Decoy,0,-8.89113,-7.38,-0.59,-6.801238382999259
CC(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1,C10601994_decoy,CASP3,Decoy,0,-6.14902,-6.7,-1.56,-6.605070047156855
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccc(S(N)(=O)=O)cc2)c1C,C10795749_decoy,CASP3,Decoy,0,-9.17986,-5.93,-1.88,-7.4324490728479615
Cc1nnc(SCC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)n1Cc1ccccc1,C12210150_decoy,CASP3,Decoy,0,-5.92681,-7.53,-1.1,-5.87085286387388
Cc1c(C(=O)N(C)C[C@@H](O)CO)sc2ncnc(NCc3ccc4c(c3)OCO4)c12,C12217489_decoy,CASP3,Decoy,0,-8.41635,-6.83,-1.91,-9.601679851845576
COCCCN(C(=O)c1ccc(Cl)o1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12687882_decoy,CASP3,Decoy,0,-7.37928,-4.75,-1.86,-5.239111597395708
NC(=O)c1cc([N+](=O)[O-])cn(C[C@@H](O)COc2cc(Cl)ccc2Cl)c1=O,C12766543_decoy,CASP3,Decoy,0,-8.23607,-7.41,-1.13,-8.961485390674401
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(N)=O)c2C)cc1,C03369124_decoy,CASP3,Decoy,0,-8.75846,-6.82,-1.37,-6.83830266454823
Cc1ccc(OC[C@@H](O)Cn2c(NCC(C)C)nc3c2c(=O)[nH]c(=O)n3C)cc1,C13806990_decoy,CASP3,Decoy,0,-7.88442,-7.25,-1.78,-7.344670273636542
CC(C)(C)n1nnnc1SCC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C16290493_decoy,CASP3,Decoy,0,-8.15576,-7.18,-2.99,-7.3002972682729235
COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(N(C)C)o2)sc(C(N)=O)c1C,C06825032_decoy,CASP3,Decoy,0,-8.69804,-5.73,-2.12,-8.093510582086312
C[C@H](OC(=O)c1ccc(CCNS(C)(=O)=O)s1)C(=O)NC(=O)NC(C)(C)C,C17249277_decoy,CASP3,Decoy,0,-8.31784,-6.84,-1.4,-6.713878403275007
C=CCOC(=O)c1sc(NC=C2C(=O)NC(=S)NC2=O)c(C(=O)OCC)c1C,C17297268_decoy,CASP3,Decoy,0,-8.41705,-6.38,-1.64,-9.097044187955374
COc1ccc(C(=O)CSc2nnc(-c3[nH]nc4c3CCC4)n2N)cc1OC,C09013090_decoy,CASP3,Decoy,0,-7.6884,-6.49,-0.57,-5.756018171786174
CCCCn1c(N)c(N(CC)C(=O)CSc2ccc3c(c2)OCCO3)c(=O)[nH]c1=O,C18551684_decoy,CASP3,Decoy,0,-8.15645,-6.32,-3.42,-6.953819983861244
C=CCOC(=O)C1=C(C)OC(=O)[C@]12C(C(=O)OCCOC)=C(N)Nc1ccccc12,C20569122_decoy,CASP3,Decoy,0,-7.16752,-5.09,-2.24,-6.398406956085573
CC(C)Sc1nnc(NC(=O)CSc2nnc(-c3cccnc3)n2N)s1,C20830126_decoy,CASP3,Decoy,0,-8.01019,-7.6,-1.65,-6.083346844965181
Cc1cccc(C)c1NC(=O)CSc1n[nH]c(N/N=C/c2cnn(C(C)C)c2)n1,C20910561_decoy,CASP3,Decoy,0,-9.51524,-6.09,-1.82,-6.637436149929182
CCCCN(C(=O)CN1CCO[C@H](C)C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C22130715_decoy,CASP3,Decoy,0,-7.64389,-6.39,-3.73,-6.806353654969189
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNc1nc(C)cc(C)n1,C22235971_decoy,CASP3,Decoy,0,-7.09729,-6.54,-3.59,-8.62063853276174
C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)c1cccs1,C23635322_decoy,CASP3,Decoy,0,-8.64703,-5.77,-1.39,-6.91751269469176
COC(=O)c1c(C)[nH]c(C(=O)NCCNS(=O)(=O)c2ccc(OC)cc2)c1C,C26674084_decoy,CASP3,Decoy,0,-7.00498,-5.58,-0.92,-5.500943480956854
CCNC(=O)NC(=O)COC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1,C28854789_decoy,CASP3,Decoy,0,-6.8772,-6.98,-1.41,-5.9668489283710295
Cc1cc(NC(=O)[C@H](Sc2nnc(C3CC3)n2CCC(N)=O)c2ccccc2)no1,C28910401_decoy,CASP3,Decoy,0,-8.37065,-7.93,-2.69,-8.368792402955464
C[C@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)Nc1ccccc1C#N,C29664645_decoy,CASP3,Decoy,0,-7.52458,-6.22,-1.25,-7.662830929865221
CCOC(=O)C1=C(CSc2nnc(NC[C@H]3CCCO3)s2)NC(=O)NC1,C29741783_decoy,CASP3,Decoy,0,-8.66283,-6.56,-2.11,-7.000302924448842
Cc1nc(NC(=O)CSc2nc(C)c(CCO)c(=O)[nH]2)sc1C(=O)OC(C)C,C32522954_decoy,CASP3,Decoy,0,-9.63345,-7.4,-1.21,-11.166068315320276
C=CCOC(=O)c1sc(NC(=O)[C@@H](C)n2c(N)nnc2SCC)nc1C,C32535521_decoy,CASP3,Decoy,0,-8.2319,-6.44,-1.26,-6.856862636721115
C=CCOC(=O)c1sc(NC(=O)[C@H](C)n2c(N)nnc2SCC)nc1C,C32535520_decoy,CASP3,Decoy,0,-8.23091,-5.89,-1.46,-6.716261623545413
Cc1cc(C(=O)OC[C@@H](O)[C@@H](O)[C@H](O)c2cnn(-c3ccccc3)n2)c2ccccc2n1,C34868011_decoy,CASP3,Decoy,0,-9.61054,-7.78,-1.82,-6.659164366349552
CCCCn1c(N)c(N(CC(C)C)C(=O)C[C@@H]2OC(=O)c3ccccc32)c(=O)[nH]c1=O,C12903237_decoy,CASP3,Decoy,0,-5.6931,-6.21,-1.42,-5.209529187179931
CCCCn1c(N)c(N(C)C(=O)CSc2ccc3c(c2)OCCO3)c(=O)[nH]c1=O,C36713194_decoy,CASP3,Decoy,0,-7.08301,-6.11,-1.77,-5.433176590435598
CCSc1nnc(N)n1[C@@H](CC)C(=O)Nc1c(C#N)cnn1-c1ccccc1,C40172400_decoy,CASP3,Decoy,0,-8.05159,-6.83,-1.03,-7.248540526626359
COC(=O)c1ccc(N2CCCC2)c(NC(=O)NCCCNS(C)(=O)=O)c1,C43978335_decoy,CASP3,Decoy,0,-8.36855,-7.21,-0.08,-12.807445095795993
Cc1ccc(=O)n([C@@H](C)C(=O)NCCNC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)n1,C44395265_decoy,CASP3,Decoy,0,-6.98493,-7.75,-1.16,-10.074522895513658
COc1cc(CNC(=O)Nc2cnc3c(cnn3C(C)C)c2)ccc1OCCO,C47524529_decoy,CASP3,Decoy,0,-6.51583,-5.66,-1.87,-5.821264271132763
CCn1c(CCC(N)=O)nnc1SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1,C09683428_decoy,CASP3,Decoy,0,-10.3239,-7.16,-1.27,-7.72980669413675
CCCCn1c(N)c(N(CCC(C)C)C(=O)[C@@H]2CC(=O)N(C3CC3)C2)c(=O)[nH]c1=O,C57578107_decoy,CASP3,Decoy,0,-6.88528,-6.2,-2.85,-7.290900811602713
CCOC(=O)c1c(C)[nH]c(C(=O)Nc2nc(-c3ccc(CNC(C)=O)o3)cs2)c1C,C12052372_decoy,CASP3,Decoy,0,-9.3048,-6.31,-3.06,-6.84168071497321
CC(=O)c1c(C)[nH]c(C(=O)COC(=O)CCNC(=O)c2n[nH]c3ccccc23)c1C,C58264903_decoy,CASP3,Decoy,0,-7.23648,-8.1,-1.58,-5.97776259119693
CCCc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)[nH]c(C)c1C(=O)OC,C48185408_decoy,CASP3,Decoy,0,-6.65586,-7.58,-1.98,-5.822760522439134
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)c2ccc(F)cc2)n[nH]1,C59887624_decoy,CASP3,Decoy,0,-9.56631,-6.58,-1.15,-8.148597823982692
CC(C)C(=O)NCCNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1,C61735530_decoy,CASP3,Decoy,0,-6.14579,-7.82,-2.65,-6.76790018701166
NS(=O)(=O)c1cc(NCCCS(=O)(=O)c2ccccc2)cc([N+](=O)[O-])c1,C66373099_decoy,CASP3,Decoy,0,-7.54065,-7.87,-1.42,-6.546883008968411
Cc1ccc(NC(=O)CCNC(=O)NCCCc2nnc3n2CCCCC3)nc1,C67418529_decoy,CASP3,Decoy,0,-8.01884,-6.46,-1.55,-5.63435209475694
CCCn1c(N)c(C(=O)CSc2nc3ccccc3n2CC)c(=O)[nH]c1=O,C04289536_decoy,CASP3,Decoy,0,-6.85872,-6.24,-1.52,-4.759319836472318
CC(=O)NCc1ccc(C(=O)CSc2nnc(-c3cccc(F)c3)n2N)o1,C06082960_decoy,CASP3,Decoy,0,-7.02061,-7.3,-2.53,-6.156301052362047
Cn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1cccs1,C02233356_decoy,CASP3,Decoy,0,-10.0624,-6.24,-1.39,-6.919839116261801
Nc1c(C(=O)CSc2nc(C(F)(F)F)nc3ccccc23)c(=O)[nH]c(=O)n1C1CC1,C09514963_decoy,CASP3,Decoy,0,-6.9459,-7.22,-1.42,-4.918032048924529
Cc1ccc(N2C(=O)CC[C@H](C(=O)OCC(=O)NC(N)=O)[C@H]2c2cccs2)cc1,C09603175_decoy,CASP3,Decoy,0,-10.4213,-8.23,-0.99,-8.863074463484052
CC1CCN(c2nnc(S[C@@H](C(=O)NC(N)=O)C(C)C)n2C2CC2)CC1,C11985572_decoy,CASP3,Decoy,0,-9.3567,-7.62,-2.0,-9.159879634561555
Cn1c(CC(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)nc2ccccc21,C09511905_decoy,CASP3,Decoy,0,-7.32903,-6.56,-1.41,-6.1847379564369245
O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)c1ccccn1,C15341647_decoy,CASP3,Decoy,0,-6.94636,-7.94,-0.89,-6.436291788093277
CSc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)s2)cc1[N+](=O)[O-],C15788577_decoy,CASP3,Decoy,0,-6.48948,-6.95,-1.04,-5.8332819144028045
Cc1cc(C(=O)NNC(=O)CSCc2nc3sc4c(c3c(=O)[nH]2)CCC4)c(C)o1,C15834784_decoy,CASP3,Decoy,0,-9.59241,-8.14,-0.5,-7.031266010870489
Cn1c(CC(=O)NNC(=O)CNC(=O)c2ccccc2F)nc2ccccc21,C17411370_decoy,CASP3,Decoy,0,-6.67917,-7.79,-1.63,-7.200387678423286
CCOC(=O)NC(c1c(N)n(C)c(=O)n(C)c1=O)(C(F)(F)F)C(F)(F)F,C20069566_decoy,CASP3,Decoy,0,-5.17294,-4.94,-1.66,-5.077388189549523
Cc1cc2c(c(-c3ccc(C(N)=O)cn3)c1)O[C@H](CNC(=O)[C@H](C)N1CCOCC1)C2,C20327208_decoy,CASP3,Decoy,0,-6.91053,-6.87,-0.52,-6.019251836803757
Cc1cccc(NC(=O)CSc2nnc(-c3ccco3)n2CC(N)=O)c1C,C23347919_decoy,CASP3,Decoy,0,-7.37489,-6.79,-1.59,-5.419437836130857
C[C@@H](Sc1nnc(C2CC2)n1CCC(N)=O)c1nc2ccccc2c(=O)[nH]1,C23365369_decoy,CASP3,Decoy,0,-7.58391,-7.72,-2.02,-7.673111736302905
CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)O[C@H](C)C(=O)NC(=O)NC1CC1)(C3)C2,C10532536_decoy,CASP3,Decoy,0,-7.46435,-7.86,-3.03,-8.974705642478229
O=C(Cc1csc(NC(=O)c2cccs2)n1)NNC(=O)c1cccnc1,C27764511_decoy,CASP3,Decoy,0,-8.51737,-5.76,-3.81,-5.894588200402
CC1CCC2(CC1)NC(=O)N(CC(=O)N(CCC(N)=O)c1ccccc1)C2=O,C30024835_decoy,CASP3,Decoy,0,-10.1783,-8.11,-2.08,-9.831746905570297
Cc1cc(C)n(-c2nnc(SCC(=O)N[C@@H](C)c3ccc(F)cc3F)n2N)n1,C32776497_decoy,CASP3,Decoy,0,-7.51458,-5.34,-0.69,-5.41591080474986
C[C@H]1C(=O)N(C)CCN1C(=O)CC[C@H]1NN[C@@H](CCc2c[nH]c3ccccc23)O1,C39461108_decoy,CASP3,Decoy,0,-6.75676,-7.53,-0.96,-6.012368371823975
NS(=O)(=O)c1ccc(CCNC(=O)CN2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2C=C[C@H]3C2)cc1,C04731002_decoy,CASP3,Decoy,0,-7.7858,-7.07,-2.02,-6.072891425453165
COCCNC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(O)cc1)CCC2,C40811997_decoy,CASP3,Decoy,0,-8.21644,-6.38,-1.4,-7.46415935026617
O=C(NCCc1cn2ccccc2n1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1,C41245959_decoy,CASP3,Decoy,0,-6.19304,-6.61,-0.87,-5.09882985446935
CCOC(=O)c1c(NC(=O)Cc2cn3ccccc3n2)sc(C(N)=O)c1C,C41304274_decoy,CASP3,Decoy,0,-10.528,-5.62,-1.87,-7.364730987049065
Cc1cc(C(=O)NCCCNC(=O)[C@]2(C)Sc3ccccc3NC2=O)nn1C,C41645100_decoy,CASP3,Decoy,0,-7.61804,-6.93,-0.97,-6.966629333271358
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)N[C@@H](C)c1cnn(C)c1C,C41959025_decoy,CASP3,Decoy,0,-7.9401,-8.07,-3.15,-8.413705351732418
O=C(NC[C@H]([C@@H]1CCOC1)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1,C45537711_decoy,CASP3,Decoy,0,-8.20754,-6.35,-1.28,-6.462486879104294
C[C@H](NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(OC(F)F)c1,C46611399_decoy,CASP3,Decoy,0,-6.9088,-6.47,-0.76,-5.6272569592765125
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC[C@@H](C)Cn2nc(C)cc2C)c1,C47903053_decoy,CASP3,Decoy,0,-7.73955,-7.37,-0.74,-6.695844493035219
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C,C50149924_decoy,CASP3,Decoy,0,-6.31578,-8.36,-1.47,-6.231752679301509
CCNC(=O)c1ccc(NC(=O)C(=O)NCCN2C[C@@H](C)O[C@@H](C)C2)c(C)c1,C52658033_decoy,CASP3,Decoy,0,-8.24753,-7.16,-1.53,-7.019302473297016
COCCNC(=O)NC(=O)[C@H](C)N1CCC(NC(=O)c2ccccc2C)CC1,C52747268_decoy,CASP3,Decoy,0,-7.47207,-5.48,-1.3,-6.106550927769093
Cc1cccc(C)c1OCCCNC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1,C56784912_decoy,CASP3,Decoy,0,-6.90994,-7.45,-1.89,-5.951737170082791
NC(=O)c1ccc(SCC(=O)Nc2ccc(Br)cn2)c([N+](=O)[O-])c1,C57625936_decoy,CASP3,Decoy,0,-6.80242,-6.22,-1.97,-5.80919309710428
CC(=O)Nc1cc(NC(=O)NC[C@@H]([C@H]2CCOC2)N2CCOCC2)ccc1C,C57646806_decoy,CASP3,Decoy,0,-9.07205,-6.19,-3.72,-6.813939670782304
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCCc2cc(F)cc3c2OCOC3)c1,C52900177_decoy,CASP3,Decoy,0,-8.23853,-8.26,-3.33,-7.135537170390628
CCN(CC)c1ccc([C@H]2[NH2+][C@](C)(C(=O)[O-])[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]23)c(O)c1,C15306776_decoy,CASP3,Decoy,0,-8.6679,-6.7,-1.38,-6.571164810060904
Cc1ccc(-c2cc(NC(=O)CNC(=O)[C@@H]3c4ccccc4C(=O)N3C3CC3)[nH]n2)s1,C60322240_decoy,CASP3,Decoy,0,-7.88105,-7.55,-1.03,-6.7096900054009385
CC(C)(C)NC(=O)CNC(=O)NCCS(=O)(=O)N1CCc2ccccc21,C48178053_decoy,CASP3,Decoy,0,-6.441,-7.11,-1.4,-5.992238712062586
O=C(NCc1nnc2n1CCC2)NC[C@H](O)c1ccc(OC(F)(F)F)cc1,C61858541_decoy,CASP3,Decoy,0,-7.74597,-6.45,-0.73,-6.849468912712879
COc1ccc(C)c2cc(CCNS(=O)(=O)c3c(C)n[nH]c3C)c(=O)[nH]c12,C62104450_decoy,CASP3,Decoy,0,-5.93687,-7.36,-1.46,-5.133182040773463
O=C(NC[C@H](O)c1ccc(Cl)cc1)C(=O)Nc1ccccc1-n1cncn1,C62206623_decoy,CASP3,Decoy,0,-5.58667,-7.73,-1.61,-5.671498901510112
CCNC(=O)NNC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1,C65190286_decoy,CASP3,Decoy,0,-8.26475,-6.02,-2.31,-6.543780635835263
O=C(NCC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1,C65193584_decoy,CASP3,Decoy,0,-8.49602,-5.56,-1.34,-5.889624254515981
CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(-n3ncc(C#N)c3N)cc2)C1,C66241496_decoy,CASP3,Decoy,0,-6.35937,-5.93,-1.16,-5.8583750026419255
C[C@H]1CCC[C@@H](NC(=O)CN2CCN([C@@H](C)C(=O)NC(=O)NC3CC3)CC2)C1,C66566686_decoy,CASP3,Decoy,0,-8.06124,-5.74,-0.98,-5.868241058467639
COc1nc(C)cc(C)c1CNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1,C66780369_decoy,CASP3,Decoy,0,-7.08648,-6.64,-1.01,-6.141056882127604
CCNC(=O)Cn1ccc(NC(=O)CNC(=O)c2cc3c(s2)CCCC3)n1,C67345224_decoy,CASP3,Decoy,0,-7.2936,-7.37,-1.89,-5.80194100243287
COC(=O)N(C)c1ccc(NC(=O)C(=O)NC[C@H](O)c2ccccc2F)cc1,C67346457_decoy,CASP3,Decoy,0,-7.1291,-6.65,-1.61,-6.134999415502115
CCNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(S(=O)(=O)NC)c2)C1,C67470404_decoy,CASP3,Decoy,0,-8.73449,-6.54,-1.14,-6.605224100004966
Cc1ccccc1N1C[C@H](C(=O)Nc2nnc(SCC(N)=O)s2)CC1=O,C05076554_decoy,CASP3,Decoy,0,-9.15916,-6.19,-1.58,-6.262383517896969
C[C@H](Sc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)C(=O)NC(N)=O,C05630492_decoy,CASP3,Decoy,0,-10.0877,-6.23,-0.77,-7.442942407503454
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)c2ccccn2)c(=O)[nH]c1=O,C06582555_decoy,CASP3,Decoy,0,-5.50611,-7.15,-1.33,-6.78123526391411
C[C@H]1CCc2c(sc(NC(=O)CSc3nnnn3C3CC3)c2C(N)=O)C1,C08545234_decoy,CASP3,Decoy,0,-8.81476,-5.21,-3.44,-5.524427362228282
CCCCN1C(=O)[C@H]2[C@H](CCC(=O)[O-])[NH2+][C@@]3(C(=O)Nc4c3ccc(C)c4C)[C@@H]2C1=O,C08971904_decoy,CASP3,Decoy,0,-7.58118,-7.34,-0.39,-7.167228557502004
Cn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nnc1-c1ccncc1,C03352593_decoy,CASP3,Decoy,0,-8.0366,-7.18,-2.13,-6.031742332056776
NC(=O)Cc1csc(NC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)n1,C10999995_decoy,CASP3,Decoy,0,-8.89706,-6.38,-0.42,-8.092018791172464
Cc1nn(C)c(Cl)c1C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C14364445_decoy,CASP3,Decoy,0,-9.12018,-7.13,-1.47,-7.159506080312605
C[C@H](NC(=O)CCNC(=O)NC1CCCCC1)c1ccc(-n2cncn2)cc1,C14848669_decoy,CASP3,Decoy,0,-7.7773,-6.18,-3.07,-6.214457112548559
CCn1c(S[C@@H](C)C(=O)Nc2sccc2C(N)=O)nnc1-c1ccco1,C16716469_decoy,CASP3,Decoy,0,-7.32449,-5.8,-2.56,-6.174138444646155
C[C@H]1[C@@H](NC(=S)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)CCC[C@@H]1C,C27266375_decoy,CASP3,Decoy,0,-7.00965,-5.89,-1.48,-7.243529158584271
NS(=O)(=O)c1ccc(CCNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1,C28273253_decoy,CASP3,Decoy,0,-8.94274,-7.12,-1.4,-7.348681610358973
Cc1nc(SCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)c(C(N)=O)c(C)c1C,C32819060_decoy,CASP3,Decoy,0,-6.35735,-7.92,-1.8,-5.588462353225934
CC(C)[C@@](C)(NC(=O)c1cccn(Cc2ccc3c(c2)OC(F)(F)O3)c1=O)C(N)=O,C01391173_decoy,CASP3,Decoy,0,-6.51498,-5.95,-1.37,-5.505721796510091
CC(C)[C@](C)(NC(=O)c1cccn(Cc2ccc3c(c2)OC(F)(F)O3)c1=O)C(N)=O,C01391172_decoy,CASP3,Decoy,0,-7.66717,-7.77,-1.19,-6.615172824278526
CCC[C@]1(C(=O)[O-])[NH2+][C@@H](c2cccc(OC)c2O)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@@H]21,C19848862_decoy,CASP3,Decoy,0,-6.72188,-6.97,-1.09,-6.832632262928528
Cc1onc(-c2ccccc2)c1C(=O)NC(=S)NNC(=O)c1cccnc1,C02249440_decoy,CASP3,Decoy,0,-6.68904,-7.66,-2.03,-6.198168699028285
O=C(NCCc1c[nH]c2ccccc12)c1cn(C[C@@H]2CCCO2)cc2c(=O)[nH]nc1-2,C38670602_decoy,CASP3,Decoy,0,-9.98016,-6.85,-1.91,-6.896567753958058
CCOC(=O)N1CCN([C@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1,C38695397_decoy,CASP3,Decoy,0,-9.32657,-7.01,-3.71,-6.436901809156025
O=C(CS[C@H]1Nc2ccccc2O1)NNC(=O)C1=NN=C(c2ccccc2)C1,C39367765_decoy,CASP3,Decoy,0,-6.6548,-6.89,-1.09,-5.8907441954480095
O=C(NCCc1nc2ccccc2[nH]1)[C@@H]1C[C@@H](C2CC2)N([C@@H]2CCS(=O)(=O)C2)N1,C39388816_decoy,CASP3,Decoy,0,-9.31704,-6.94,-2.44,-7.066212176457652
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NCCc2cn3ccccc3n2)c1,C41245547_decoy,CASP3,Decoy,0,-7.79767,-7.66,-2.23,-6.876994902729077
CNC(=O)c1ccc(NC(=O)C(=O)NC[C@H](C(C)C)N2CCOCC2)c(C)c1,C41308566_decoy,CASP3,Decoy,0,-8.37594,-6.2,-1.04,-5.299309034882165
O=C(CCSc1ccc(F)cc1)NNC(=O)NCc1nnc2ccccn12,C43711233_decoy,CASP3,Decoy,0,-8.11234,-6.56,-2.24,-6.3278489234584185
CC(C)NC(=O)C(=O)NNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(C)C,C45203423_decoy,CASP3,Decoy,0,-7.19373,-6.16,-2.07,-5.996506127642482
O=C(NC[C@@H]([C@@H]1CCOC1)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1,C45537710_decoy,CASP3,Decoy,0,-8.24454,-7.23,-1.72,-9.681423892746654
N#Cc1cccnc1NCCNC(=O)Nc1ccccc1C(=O)N1CCCCC1,C47115132_decoy,CASP3,Decoy,0,-6.86339,-6.24,-1.26,-5.943944977496995
NC(=O)C(=O)NC[C@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2F)CC1,C49487564_decoy,CASP3,Decoy,0,-8.13771,-8.76,-2.18,-9.283634913875542
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NCCN3C(=O)CSC3=O)cc2)C1,C54098038_decoy,CASP3,Decoy,0,-7.6992,-7.72,-0.75,-10.591764102787565
O=C(CCCNC(=O)c1ccsc1)NNC(=O)[C@@H]1COc2ccccc2O1,C57659533_decoy,CASP3,Decoy,0,-9.01579,-6.13,-3.88,-6.468923222441766
CCCn1c(N)c(C(=O)CN2CCC(c3nc4ccccc4s3)CC2)c(=O)[nH]c1=O,C58166916_decoy,CASP3,Decoy,0,-7.97772,-7.54,-2.92,-6.843995445154029
Cc1cc(NC(=O)[C@H](C)SCC(=O)Nc2[nH]nc(C(F)(F)F)c2C)no1,C60208791_decoy,CASP3,Decoy,0,-6.66966,-7.77,-1.11,-6.208644716155278
Cc1ccc(N2C(=O)C[C@H](SCC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2=O)cc1,C02708682_decoy,CASP3,Decoy,0,-9.08878,-6.67,-1.97,-6.47518394531834
O=C(C[C@H]1C(=O)NCCN1Cc1cccc(F)c1F)NCCN1CCNC1=O,C63868175_decoy,CASP3,Decoy,0,-7.44042,-6.92,-0.67,-7.046909922884383
CN1C(=O)N(CC(=O)NNC(=S)NCC(F)(F)F)C(=O)C12CCCCC2,C64081968_decoy,CASP3,Decoy,0,-6.02889,-5.02,-1.23,-4.529832626549207
CCOC(=O)C1=C(CN2CCC(NC(=O)c3cccs3)CC2)NC(=O)NC1,C64802694_decoy,CASP3,Decoy,0,-8.39024,-6.15,-3.1,-8.230525156121402
CC(C)CCNC(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1,C65133240_decoy,CASP3,Decoy,0,-6.1967,-5.36,-1.27,-5.133798503470423
Cc1oc(-c2cccs2)nc1CC(=O)NNC(=O)NCCc1ccccn1,C65144637_decoy,CASP3,Decoy,0,-8.84162,-7.19,-3.01,-6.566923481985596
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)NCC2CC2)c(C)n1C[C@@H]1CCCO1,C65192441_decoy,CASP3,Decoy,0,-7.81429,-5.49,-2.5,-7.385889446268531
COCCCNC(=O)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2,C65205115_decoy,CASP3,Decoy,0,-7.41534,-6.8,-0.1,-6.265029881164663
COc1cc([C@H]2CC(=O)Nc3c2cnn3-c2ccc(F)cc2)ccc1OCC(N)=O,C65331467_decoy,CASP3,Decoy,0,-7.3629,-6.8,-2.0,-5.404998225281074
CCS(=O)(=O)NCCCNC(=O)Nc1cc2c(cc1Cl)OCCCO2,C65366956_decoy,CASP3,Decoy,0,-8.21721,-6.24,-1.93,-6.982426155781743
Cc1cc(/C=C(/C#N)C(=O)Nc2ccn(CC(N)=O)n2)c(C)n1C1CCCCC1,C65861985_decoy,CASP3,Decoy,0,-8.76873,-5.8,-1.06,-7.332329410136261
CCN(Cc1ccccc1)C(=O)CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1,C66357159_decoy,CASP3,Decoy,0,-6.42477,-6.72,-1.62,-7.392939701862937
COC(=O)N1CCC(NC(=O)CNC(=O)NCc2ccc(Cl)cc2)CC1,C66631137_decoy,CASP3,Decoy,0,-6.13731,-5.82,-1.22,-5.162181116559583
CCOCC(=O)NNC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CC[C@H](C)C3,C66654942_decoy,CASP3,Decoy,0,-8.04725,-7.39,-0.01,-5.780631759995036
Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2cnn(C)c2C)cc1C(=O)NC(C)C,C66719408_decoy,CASP3,Decoy,0,-6.37479,-6.98,-3.72,-6.021734332937872
O=C(CCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)CC1CCCCC1,C66790480_decoy,CASP3,Decoy,0,-6.3118,-6.75,-1.82,-5.735758083198782
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1,C67105893_decoy,CASP3,Decoy,0,-7.24627,-6.17,-2.04,-6.105656581454308
O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21)NCc1nnc2n1CCCCC2,C67143263_decoy,CASP3,Decoy,0,-7.57504,-7.28,-2.46,-6.713869379215073
C#CCN(C)C(=O)C[C@@H]1c2nc(NC(=O)CCCCC)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@]21C,C04237035_decoy,CASP3,Decoy,0,-9.51971,-5.46,-1.42,-7.467962957560649
Cc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)NNC(=O)c3ccc(O)cc3)C2=O)cc1,C08819816_decoy,CASP3,Decoy,0,-8.51806,-6.3,-1.21,-6.129583948043834
CCOCCCNC(=O)c1c(N)n(-c2cccc(Br)c2)c2nc3ccccc3nc12,C08836646_decoy,CASP3,Decoy,0,-9.06994,-6.23,-3.2,-7.260927160094739
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1,C08965787_decoy,CASP3,Decoy,0,-7.76334,-7.86,-3.48,-6.536573390848116
NC(=O)c1c(NC(=O)CSc2nnc(Cc3cccs3)n2-c2ccccc2)sc2c1CCC2,C09516465_decoy,CASP3,Decoy,0,-9.50146,-7.83,-1.23,-7.451971435898096
CC[C@H](C)Oc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(OC)c(Br)c2)cc1,C10295611_decoy,CASP3,Decoy,0,-8.68189,-7.03,-2.66,-7.125198723933632
Nn1c(SCC(=O)Nc2ccccc2SC(F)F)nnc1-c1ccc(OC(F)F)cc1,C11807972_decoy,CASP3,Decoy,0,-6.7507,-7.49,-1.4,-5.920657069704774
CCOC(=O)[C@H]1C(c2cccs2)[C@H](C(=O)OCC)[C@](O)(C(F)(F)F)N[C@]1(O)C(F)(F)F,C12367875_decoy,CASP3,Decoy,0,-9.648,-5.63,-2.34,-7.9706026750229935
C=CCn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1ccc(Cl)cc1Cl,C13129298_decoy,CASP3,Decoy,0,-8.29972,-7.28,-1.45,-8.758003223003893
Cc1ccccc1CS(=O)(=O)C[C@@H]1Nc2ccc(C(=O)NCc3cccs3)cc2NC1=O,C09490848_decoy,CASP3,Decoy,0,-9.77007,-8.03,-3.21,-8.616164443206584
Cc1cc(C)c2[nH]c(C)c(CC(=O)NNC(=O)CCC(=O)N(c3ccccc3)c3ccccc3)c2c1,C13898787_decoy,CASP3,Decoy,0,-7.28351,-7.91,-1.69,-6.323493015802726
CCOc1cc(C(=O)NC(=S)Nc2cc(Cl)cc(Cl)c2O)cc(OCC)c1OCC,C14270335_decoy,CASP3,Decoy,0,-10.2822,-6.46,-1.8,-7.767641022963161
COCCOc1ccc(C(=O)NC(=S)NNC(=O)c2sc3ccccc3c2Cl)cc1,C14657166_decoy,CASP3,Decoy,0,-10.6863,-7.17,-2.33,-7.296835641113419
COCCOc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)c1cccc(C)c1,C14662940_decoy,CASP3,Decoy,0,-8.06322,-5.58,-2.48,-5.604764074005852
Nc1ccn([C@@H]2C[C@H](O)[C@@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)O2)c(=O)n1,C14960557_decoy,CASP3,Decoy,0,-6.41817,-8.98,-2.56,-7.954361490711983
CCCN(C(=O)CSc1ccc(F)c(Cl)c1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C15483556_decoy,CASP3,Decoy,0,-8.46565,-7.64,-2.32,-7.319843008304552
CCCCCN(C(=O)c1ccc(Br)cc1F)c1c(N)n(CCCC)c(=O)[nH]c1=O,C15605715_decoy,CASP3,Decoy,0,-8.67262,-6.08,-2.09,-6.822812063335287
CCCc1n[nH]c2c1[C@@H](c1cccc(OC)c1OCc1ccc(Br)cc1)C(C#N)=C(N)O2,C01114221_decoy,CASP3,Decoy,0,-8.89098,-6.2,-2.04,-7.817590460794326
CC(C)CN(C(=O)CSc1ccc(Br)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C16483663_decoy,CASP3,Decoy,0,-7.46924,-5.71,-2.87,-7.634610294662016
O=C(NCCCN1CCOCC1)c1ccc2c(c1)NC(=O)[C@H](CSCc1ccc(F)cc1Cl)N2,C20677800_decoy,CASP3,Decoy,0,-11.1795,-8.18,-2.31,-9.047080962860116
C=CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1,C20681801_decoy,CASP3,Decoy,0,-10.2484,-7.68,-2.1,-8.110451494835376
O=C(CCSc1n[nH]c(N/N=C/c2cccc(Cl)c2)n1)Nc1cccc(C(F)(F)F)c1,C20835116_decoy,CASP3,Decoy,0,-8.7616,-5.93,-1.84,-7.623244065365435
CC(C)Cn1c(SCC(=O)Nc2sccc2C(N)=O)nc2sc3c(c2c1=O)CC[C@@H](C)C3,C21135086_decoy,CASP3,Decoy,0,-9.76019,-6.66,-1.48,-7.990618324957836
Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3ccc(C(N)=O)cc3)nnc2-c2ccccc2)cc1C,C21227026_decoy,CASP3,Decoy,0,-7.09811,-6.94,-2.51,-6.498790488491372
CCSc1nn(CC(=O)Nc2ccc(F)cc2F)c(N)c1S(=O)(=O)c1ccc(Cl)cc1,C21774591_decoy,CASP3,Decoy,0,-7.00789,-7.69,-1.95,-5.856580366376048
O=C(CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCCNc1ncc(C(F)(F)F)cc1Cl,C22009117_decoy,CASP3,Decoy,0,-9.67089,-8.15,-1.92,-7.652564313125836
CCN(CC)c1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1,C22279967_decoy,CASP3,Decoy,0,-8.6978,-6.93,-1.56,-7.051039114994042
Cc1ccc(S(=O)(=O)N(CCCc2c(-c3ccccc3)[nH]c(N)nc2=O)c2ccccc2)cc1,C17040422_decoy,CASP3,Decoy,0,-8.38925,-6.76,-2.04,-7.400557143988831
CCOC(=O)[C@H]1C(c2ccc(Cl)cc2)[C@H](C(=O)OCC)[C@](O)(C(F)(F)F)N[C@]1(O)C(F)(F)F,C16682656_decoy,CASP3,Decoy,0,-8.14821,-5.11,-0.98,-6.653865362792123
Cc1ccc(OCc2nc(C(=O)NC3CCC(NC(=O)Nc4cccc(Cl)c4)CC3)cs2)cc1,C34906153_decoy,CASP3,Decoy,0,-9.29288,-6.89,-4.48,-6.065285558843455
O=C(Nc1ccccc1F)NC1CCC(NC(=O)c2csc(COc3ccccc3F)n2)CC1,C34906336_decoy,CASP3,Decoy,0,-8.52507,-6.49,-3.42,-5.894384095677888
CSc1ccc(NC(=O)N[C@H]2CCCC[C@H]2NC(=O)c2csc(COc3ccccc3F)n2)cc1,C34906385_decoy,CASP3,Decoy,0,-10.6051,-5.83,-1.88,-6.762285062093156
CCCCNC(=O)[C@@H](c1ccc(O)cc1)N(C(=O)CNC(=O)c1ccccc1)C1CCCCC1,C36490407_decoy,CASP3,Decoy,0,-6.82664,-7.35,-1.73,-7.358192784502343
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1cccc(O)c1)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548326_decoy,CASP3,Decoy,0,-8.2989,-7.27,-1.53,-8.951845146088663
Cc1ccc(CN(C(=O)c2cccc(O)c2O)[C@H](C(=O)NC2CCCCC2)c2ccccc2C)o1,C36597700_decoy,CASP3,Decoy,0,-8.88288,-8.06,-3.26,-8.275621089139035
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCCC3)cc1,C04177376_decoy,CASP3,Decoy,0,-9.21729,-6.98,-3.07,-8.037106664216955
CCN1C[C@@H](/C=C(\NC(=O)c2ccco2)C(=O)NCCc2c[nH]c3cc(F)ccc23)c2ccccc21,C39330470_decoy,CASP3,Decoy,0,-8.63212,-7.35,-3.95,-7.0601007005576895
CCCn1c(SCC(=O)Nc2sc(C)c(C)c2C(N)=O)nnc1-c1csc2c1CCCC2,C39973687_decoy,CASP3,Decoy,0,-10.2268,-6.55,-0.97,-9.333445301121836
Cc1cccc(OC[C@@H](O)CNc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@H](C)C3)c1C,C40315189_decoy,CASP3,Decoy,0,-8.82555,-7.78,-2.82,-7.619817403567902
CCCSc1nc2n(n1)[C@@H](c1cccc(OCc3ccccc3Cl)c1)C(C(N)=O)=C(C)N2,C40982074_decoy,CASP3,Decoy,0,-6.59994,-6.12,-2.68,-5.689429922515432
CCN(CC)C(=O)C[C@@H]1c2nc(Nc3cccnc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553697_decoy,CASP3,Decoy,0,-8.8173,-5.83,-3.26,-6.4842287696182
CCCCCN(C(=O)c1ccc(F)cc1Br)c1c(N)n(CCCC)c(=O)[nH]c1=O,C45416320_decoy,CASP3,Decoy,0,-7.27618,-5.77,-3.56,-5.859291690316625
Cc1nc(CSc2ccc(C(=O)Nc3ccc(NC(=O)NC[C@@H]4CCCO4)cc3)cc2)cs1,C45824125_decoy,CASP3,Decoy,0,-9.81401,-6.76,-1.88,-6.121850018858805
Cc1c(Cl)cccc1NC(=S)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1,C46773194_decoy,CASP3,Decoy,0,-7.8682,-8.4,-2.72,-6.827649996229333
CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(Cl)cc2Cl)n1,C59014583_decoy,CASP3,Decoy,0,-10.4969,-6.09,-2.14,-9.095614056100638
O=C(CSc1n[nH]c(N/N=C/c2ccc(Cl)cc2)n1)NCc1ccc(C(F)(F)F)cc1,C59015246_decoy,CASP3,Decoy,0,-7.68238,-6.48,-2.22,-5.200044696362157
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NCCc1ccc(F)cc1,C59015589_decoy,CASP3,Decoy,0,-9.016,-5.32,-1.82,-5.720579865442448
O=C(CSc1n[nH]c(N/N=C/c2cccc(Cl)c2Cl)n1)NCc1ccc(Cl)cc1,C59015733_decoy,CASP3,Decoy,0,-9.42915,-5.12,-1.32,-6.469817118118094
C/C(=N/Nc1nc(SCC(=O)Nc2ccc(C)c(C)c2)n[nH]1)c1ccc(Br)cc1,C59020786_decoy,CASP3,Decoy,0,-8.28721,-7.59,-1.51,-5.621924296563122
Cc1cc(C(=O)COC(=O)c2ccc(CNC(N)=O)cc2)c(C)n1-c1cccc(Br)c1,C21475123_decoy,CASP3,Decoy,0,-11.0708,-7.77,-2.74,-7.456905383324539
COc1ccc(C(=O)NNC(=S)NC(=O)/C=C/c2ccc(OC)c(OC)c2)cc1,C05916876_decoy,CASP3,Decoy,0,-7.28814,-6.16,-2.44,-6.173745073776628
COc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(OC(C)C)cc2)cc1OC,C08563409_decoy,CASP3,Decoy,0,-8.8918,-6.99,-3.34,-7.396612310088977
O=C(CNC(=O)C1CCC(CNS(=O)(=O)c2ccc(F)cc2)CC1)NCc1ccco1,C08992412_decoy,CASP3,Decoy,0,-7.81117,-8.03,-2.36,-6.978469972433237
Cc1ccc(S(=O)(=O)NCC2CCC(C(=O)NCC(=O)NC[C@H]3CCCO3)CC2)cc1,C09420337_decoy,CASP3,Decoy,0,-8.93536,-7.79,-1.82,-6.378500286595793
Cc1ccc(OCc2nnc(SCC(=O)Nc3ccc(C(N)=O)cc3)n2C)c(C)c1,C10145751_decoy,CASP3,Decoy,0,-7.881,-7.52,-1.38,-6.617879119246121
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)no1,C10735483_decoy,CASP3,Decoy,0,-8.55399,-5.93,-1.02,-6.263954787795558
CCOCCCNC(=O)C(=O)Nc1c(C(=O)Nc2ccccc2F)oc2ccccc12,C09705572_decoy,CASP3,Decoy,0,-7.73119,-5.54,-3.37,-5.981603499172522
Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2nnc(CCC(N)=O)n2Cc2ccco2)c1,C12821419_decoy,CASP3,Decoy,0,-9.24079,-7.48,-1.7,-7.908705299590528
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)/C=C/c2nc3ccccc3s2)cc1,C13059294_decoy,CASP3,Decoy,0,-10.6459,-7.51,-1.77,-8.174495917402934
CC(C)CCNC(=O)NC(=O)COC(=O)CNC(=O)c1cccc(Br)c1,C13165204_decoy,CASP3,Decoy,0,-6.23585,-6.81,-0.59,-5.527672597123931
CC[C@@H](C)Oc1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC(C)=O)cc2)cc1,C10121943_decoy,CASP3,Decoy,0,-9.41942,-7.27,-1.72,-9.627491740803206
O=C(CCC1CCCCC1)NC(=S)NNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1,C13630232_decoy,CASP3,Decoy,0,-7.77782,-6.99,-2.32,-6.059755722576676
CC(C)c1ccc(C(=O)NC(=S)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1,C13630321_decoy,CASP3,Decoy,0,-6.68823,-8.19,-1.63,-6.648604542207062
COCCNC(=O)CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1,C14236267_decoy,CASP3,Decoy,0,-6.51263,-7.13,-0.39,-8.2413528359546
COCCn1c(N)c(N(Cc2ccccc2)C(=O)Cc2ccccc2Cl)c(=O)[nH]c1=O,C14506387_decoy,CASP3,Decoy,0,-6.87016,-7.44,-2.97,-7.188280414707646
COc1ccccc1N(CCC(N)=O)C(=O)CSc1nnc(-c2cccs2)[nH]1,C16565591_decoy,CASP3,Decoy,0,-8.64236,-6.12,-2.54,-7.439085162127198
COCCNC(=O)CNC(=O)c1ccc(NS(=O)(=O)c2cc(C)ccc2C)cc1,C17815049_decoy,CASP3,Decoy,0,-7.4822,-5.69,-1.64,-6.817466799869678
CCOC(=O)c1c(C)oc(NC(=O)CSc2nc(-c3ccccc3)cs2)c1C(N)=O,C19317824_decoy,CASP3,Decoy,0,-8.38854,-7.59,-0.93,-6.613104809057386
O=C(CSc1nnc(CNc2ccccc2)n1-c1ccccc1)NNC(=O)C(F)(F)F,C20829045_decoy,CASP3,Decoy,0,-7.85166,-8.26,-1.09,-7.551998759461281
CCOC(=O)c1c(NC(=O)CCSc2nnc(C(F)(F)F)n2N)sc2c1CCC2,C20841504_decoy,CASP3,Decoy,0,-7.51268,-7.26,-1.31,-7.520431030012837
Cc1nnc(SCC(=O)Nc2nnc(SCCCc3ccccc3)s2)n1N,C20842480_decoy,CASP3,Decoy,0,-8.45273,-7.46,-2.36,-7.117931776832672
CCOC(=O)c1c(NC(=O)CSc2ncnc3ccsc23)sc(C(N)=O)c1C,C22188204_decoy,CASP3,Decoy,0,-11.3983,-6.28,-3.58,-9.113570391043108
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NCCc1c[nH]c2ccccc12,C23710886_decoy,CASP3,Decoy,0,-8.0908,-8.1,-1.42,-7.4236919200332
CCCCn1c(N)c(N(Cc2ccco2)C(=O)[C@@H](C)Sc2ccccc2)c(=O)[nH]c1=O,C24004677_decoy,CASP3,Decoy,0,-7.5817,-6.58,-2.28,-8.60244394068428
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CN2CCCc3ccccc32)cc1,C25261494_decoy,CASP3,Decoy,0,-7.90782,-7.87,-2.24,-7.087034215879334
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=S)NCc2ccc3c(c2)OCO3)cc1,C25262441_decoy,CASP3,Decoy,0,-6.83827,-6.69,-2.42,-5.941874010195983
NC(=O)CCn1c(SCC(=O)Nc2c(Cl)cccc2Cl)nnc1-c1ccco1,C25954981_decoy,CASP3,Decoy,0,-8.05981,-5.89,-1.57,-6.310624349245818
N#Cc1c(CCCNC(=O)/C=C/c2cnn(-c3ccccc3)c2)nn(-c2ccccc2)c1N,C31556141_decoy,CASP3,Decoy,0,-6.60136,-7.42,-1.84,-5.912144245065702
CCOC(=O)c1c(C)oc(NC(=O)[C@@H](CC)Sc2ccc3ccccc3n2)c1C(N)=O,C32528278_decoy,CASP3,Decoy,0,-7.55894,-5.96,-2.06,-6.780512249906858
Cc1ccc(C(=O)CCC(=O)N[C@@H](C)c2ccc(-n3cc(C(N)=O)nn3)cc2)cc1C,C32928203_decoy,CASP3,Decoy,0,-8.40342,-8.44,-1.73,-7.222801035102749
N#Cc1c(CCCNC(=O)CSc2ccc3c(c2)OCCO3)nn(-c2ccccc2)c1N,C33021823_decoy,CASP3,Decoy,0,-7.64491,-5.9,-0.64,-5.773490351403411
C[C@@H](Sc1nnc(CCC(N)=O)n1Cc1ccco1)C(=O)NC1CCCCCC1,C36692661_decoy,CASP3,Decoy,0,-9.37924,-7.38,-2.76,-7.5452688721578625
C[C@H](Sc1nnc(-c2ccc(OC(F)F)cc2)n1N)C(=O)NC[C@H]1CCCO1,C13013518_decoy,CASP3,Decoy,0,-6.91632,-5.61,-0.92,-5.337511899420145
COc1ccc(-c2cc(N)n(-c3ccc(C(=O)NCCCN4CCOCC4)cc3)n2)cc1,C38737233_decoy,CASP3,Decoy,0,-8.43695,-6.53,-2.05,-5.460077422207988
CC(C)OCCCn1c(S[C@H](C)C(=O)NC(N)=O)nc2cc(Cl)ccc2c1=O,C03373425_decoy,CASP3,Decoy,0,-9.43077,-6.21,-1.7,-8.001673685005334
COc1ccc([C@@H](C#N)c2cncc(NNC(=S)Nc3ccccc3)n2)cc1OC,C44551027_decoy,CASP3,Decoy,0,-6.62905,-6.35,-3.02,-5.639248270476912
Cc1ccccc1-n1cnnc1SCCC(=O)NCCc1ccc(S(N)(=O)=O)cc1,C45697051_decoy,CASP3,Decoy,0,-9.35547,-8.35,-3.09,-8.630296335439624
CC(=O)Nc1cccc(-n2c(C)nnc2SCC(=O)NCCc2c[nH]c3ccccc23)c1,C46587587_decoy,CASP3,Decoy,0,-8.56562,-7.81,-1.9,-8.817527971757265
CCOc1ccc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C06752885_decoy,CASP3,Decoy,0,-6.7786,-6.85,-2.76,-7.209422251378252
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2)[nH]1,C31652216_decoy,CASP3,Decoy,0,-7.46687,-8.07,-1.58,-6.370943158577808
[H]/N=c1/c2c(C)n[nH]c2nc(S[C@H](CC)C(=O)NCc2ccco2)n1-c1ccc(CC)cc1,C02927168_decoy,CASP3,Decoy,0,-8.84071,-6.77,-1.39,-6.872776175274112
CC[C@](C)(NC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2OC)cc1)C(N)=O,C58167447_decoy,CASP3,Decoy,0,-6.79964,-7.34,-1.15,-6.898015065858089
CCCCN(C(=O)CN1CCc2sccc2C1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C58513002_decoy,CASP3,Decoy,0,-9.44384,-5.68,-1.59,-6.212765204280035
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)NCc1ccco1,C59015579_decoy,CASP3,Decoy,0,-7.29071,-6.58,-2.47,-5.560125152205723
O=C(CSc1n[nH]c(N/N=C/c2cccnc2)n1)NCCc1ccc(Cl)cc1,C59015975_decoy,CASP3,Decoy,0,-8.19583,-4.83,-1.55,-5.809829884094929
C/C(=N/Nc1nc(SCC(=O)NCc2ccccc2Cl)n[nH]1)c1ccccn1,C06212988_decoy,CASP3,Decoy,0,-8.72189,-6.99,-2.67,-5.975807311090962
CCCn1c(CNc2ccc(Cl)cc2C(N)=O)nc2cc(S(=O)(=O)N(C)C)ccc21,C60089678_decoy,CASP3,Decoy,0,-9.48706,-7.08,-3.22,-7.686932990364763
CCn1c(SCC(=O)Nc2cccc(CS(N)(=O)=O)c2)nnc1-c1cccs1,C60211561_decoy,CASP3,Decoy,0,-10.4193,-6.25,-2.05,-7.435479662781976
CC(C)CN(C(=O)CN(C)c1ccccc1F)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C60343055_decoy,CASP3,Decoy,0,-6.92805,-7.28,-2.25,-6.929235326651715
COCCCN(C(=O)c1ccc(Cl)s1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14620589_decoy,CASP3,Decoy,0,-7.30264,-5.22,-2.93,-5.798607642318005
C=CCNc1nc(C(=O)OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)cs1,C05040218_decoy,CASP3,Decoy,0,-9.20526,-6.71,-3.15,-7.104464953821907
C=CCn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1ccc(C)cc1,C02453154_decoy,CASP3,Decoy,0,-9.01444,-6.67,-2.83,-6.391849343599224
CCCCOc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCN(C(=O)OC)C3)cc1,C09325290_decoy,CASP3,Decoy,0,-8.71493,-5.25,-0.66,-5.815078876344278
O=C(COC(=O)c1cccnc1Nc1ccccc1F)NNC(=O)c1cccs1,C09349603_decoy,CASP3,Decoy,0,-6.68417,-7.3,-0.86,-6.432957139425998
Cc1cccc(-c2nnc(SCC(=O)Nc3ccc(C(N)=O)cc3)n2Cc2ccco2)c1,C09497333_decoy,CASP3,Decoy,0,-7.05545,-6.12,-0.84,-5.557669487979407
CCNc1nnc(SCC2=C(C(=O)OCC)[C@H](c3ccccc3)NC(=O)N2)s1,C10344587_decoy,CASP3,Decoy,0,-8.73836,-4.97,-1.8,-6.704781918450439
O=S(=O)(NCCNc1ccc(Nc2ccccn2)nn1)c1ccc(C(F)(F)F)cc1,C11697461_decoy,CASP3,Decoy,0,-6.2488,-6.31,-1.83,-5.072135033633688
CC(C)COc1ccc(C(=O)N/C(=C\c2ccc3c(c2)OCO3)C(=O)NCCCO)cc1,C12652572_decoy,CASP3,Decoy,0,-7.14115,-7.68,-2.49,-8.243387284958802
CCCCN(C(=O)/C=C/c1ccccc1OC(F)F)c1c(N)n(CCC)c(=O)[nH]c1=O,C14075459_decoy,CASP3,Decoy,0,-6.75501,-6.29,-1.61,-5.6725706741246
CCCCCN(C(=O)c1cccnc1SC)c1c(N)n(CCCC)c(=O)[nH]c1=O,C14697904_decoy,CASP3,Decoy,0,-6.58146,-6.09,-2.36,-7.166095190050106
C[C@@H](OC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(=O)NC1CCCC1,C15818935_decoy,CASP3,Decoy,0,-8.27191,-8.09,-2.63,-7.364611444276282
CC1(C)Cc2cccc(OCC(=O)NNC(=S)NCc3ccc4c(c3)OCO4)c2O1,C15912906_decoy,CASP3,Decoy,0,-7.4088,-7.51,-1.63,-6.571560859377674
CCNC(=S)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(OC)cc1,C16681751_decoy,CASP3,Decoy,0,-7.47672,-5.83,-2.1,-5.936007216483552
COC(=O)c1c(NC(=O)CCSc2nnc(C(C)(C)C)n2N)sc2c1CCCC2,C20842104_decoy,CASP3,Decoy,0,-7.808,-7.93,-1.24,-6.391418080344311
Cc1ccc(O[C@H](C)C(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc1,C20969066_decoy,CASP3,Decoy,0,-6.67211,-6.08,-2.17,-6.166239154875842
CC(C)CN(C(=O)c1ccccc1OC(F)F)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C20990113_decoy,CASP3,Decoy,0,-6.22836,-6.36,-1.78,-6.229892657135487
COc1cccc(C(=O)CSc2nnc(N/N=C(\C)c3ccc(F)cc3)n2N)c1,C21323283_decoy,CASP3,Decoy,0,-8.732,-6.84,-2.01,-6.959436791706736
C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)CCNC(=O)c2ccc(Cl)cc2)C1=O,C23752142_decoy,CASP3,Decoy,0,-6.46305,-8.07,-3.3,-6.0115262945918975
CCCCn1c(N)c(N(CCOC)C(=O)CSc2c(C)cc(C)cc2C)c(=O)[nH]c1=O,C24145760_decoy,CASP3,Decoy,0,-7.70096,-6.21,-3.67,-5.723863478282513
CC(C)c1ccc(-c2csc(NC(=O)CNC(=O)CNC(=O)c3ccco3)n2)cc1,C24751831_decoy,CASP3,Decoy,0,-8.52903,-6.83,-1.9,-6.039453327700101
O=C(CNC(=O)c1ccco1)NCC(=O)Nc1ncc(Cc2ccc(Cl)cc2)s1,C24831172_decoy,CASP3,Decoy,0,-7.47953,-8.05,-0.9,-6.60149674623934
COc1cc(CCC(=O)NCCCc2nn(-c3ccc(F)cc3)c(N)c2C#N)cc(OC)c1,C25162908_decoy,CASP3,Decoy,0,-6.92536,-6.92,-2.12,-5.767351894629615
CCCCn1c(O)nnc1S[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C26265053_decoy,CASP3,Decoy,0,-7.27694,-6.36,-2.8,-5.421293120753636
Cc1cccc(O[C@H](C)C(=O)NNC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)c1C,C26531108_decoy,CASP3,Decoy,0,-7.39858,-8.15,-1.07,-7.610239157721769
CCCCN(C(=O)CN1CCCc2cc(C)cc(F)c21)c1c(N)n(CCC)c(=O)[nH]c1=O,C30153389_decoy,CASP3,Decoy,0,-7.5421,-5.85,-1.59,-6.308541898782136
CCOC(=O)C1=C(COC(=O)C(O)(c2ccccc2)c2ccccc2)NC(=O)N[C@H]1CC,C32910561_decoy,CASP3,Decoy,0,-7.89383,-7.37,-2.54,-7.565288627096465
CCCCn1c(N)c(N(Cc2ccco2)C(=O)C(F)(F)c2ccccc2)c(=O)[nH]c1=O,C32932086_decoy,CASP3,Decoy,0,-7.057,-6.92,-3.86,-6.921166799291743
C=CCn1c(S[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1C1CCCCC1,C09457123_decoy,CASP3,Decoy,0,-8.63245,-6.91,-2.65,-7.464719583209467
COc1cc(NC(=S)/N=C(\NCC(C)C)Nc2nc(C)cc(C)n2)cc(OC)c1,C14156244_decoy,CASP3,Decoy,0,-8.98582,-5.78,-1.52,-6.808951594910341
CC(C)Cn1c(S[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)nnc1-c1ccco1,C22563196_decoy,CASP3,Decoy,0,-8.17625,-5.78,-3.39,-6.016744454576885
CCn1c(CNC(=O)c2cccc(C)c2)nnc1S[C@@H](C)C(=O)Nc1ccccc1O,C39773364_decoy,CASP3,Decoy,0,-8.51852,-8.05,-1.52,-10.165716618811045
CCOC(=O)c1c(NC(=O)[C@@H](C)n2c(N)nnc2SCC)sc2c1CCCC2,C40172447_decoy,CASP3,Decoy,0,-8.38621,-6.05,-2.89,-6.562649649524692
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)[C@@H](C)n1c(N)nnc1SCC,C40172455_decoy,CASP3,Decoy,0,-8.97657,-6.23,-2.49,-7.277621415915053
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)[C@H](C)n1c(N)nnc1SCC,C40172456_decoy,CASP3,Decoy,0,-7.4976,-6.06,-1.79,-6.455320420059922
CC[C@@H](C(=O)Nc1oc(C)c(C)c1C#N)n1c(N)nnc1SCCc1ccccc1,C40172748_decoy,CASP3,Decoy,0,-7.98602,-8.29,-2.19,-8.05310868988941
CCOC(=O)CSc1nnc(N)n1[C@H](CC)C(=O)Nc1cc(Cl)cc(Cl)c1,C40174358_decoy,CASP3,Decoy,0,-8.3114,-6.8,-1.7,-7.189187507248933
CCCOc1ccc([C@@H]2C(C(N)=O)=C(C)Nc3nc(SCCC)nn32)cc1OC,C40981306_decoy,CASP3,Decoy,0,-7.86725,-5.39,-2.04,-5.750192003138257
N#CCOc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)cc1,C45824100_decoy,CASP3,Decoy,0,-8.17592,-6.42,-1.19,-5.7868659037202255
N#CCOc1ccc(/C=C/C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)cc1,C45824101_decoy,CASP3,Decoy,0,-8.51372,-6.68,-0.98,-5.592949166351252
CC(C)c1ccc(N2CCN(CC(=O)NCCc3ccc(S(N)(=O)=O)cc3)C2=O)cc1,C49403752_decoy,CASP3,Decoy,0,-8.71629,-7.45,-1.93,-7.103362622639595
CCn1nc(C)c(CN/C(=N/C(=O)c2ccc(NC(C)=O)cc2)Nc2ccc(C)cc2)c1C,C32971941_decoy,CASP3,Decoy,0,-8.85939,-6.21,-2.38,-8.111926257779185
Nc1nc(COC(=O)CCc2ccc3ccccc3n2)nc(Nc2ccc(F)cc2)n1,C16679153_decoy,CASP3,Decoy,0,-7.09139,-6.97,-1.39,-7.056820617008328
CCOCc1ccccc1CNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1,C58756273_decoy,CASP3,Decoy,0,-7.90943,-7.17,-2.31,-7.118891052065815
Nn1c(SCCCC(=O)N/N=C/c2cccc(Cl)c2)nnc1-c1cccnc1,C06330918_decoy,CASP3,Decoy,0,-7.3452,-7.98,-1.26,-6.509023958534567
CCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2ccco2)n1,C06044832_decoy,CASP3,Decoy,0,-8.0995,-5.75,-1.52,-6.044847958613236
C/C(=N/Nc1nc(SCC(=O)Nc2ccc(C(F)(F)F)cc2)n[nH]1)c1ccncc1,C59023708_decoy,CASP3,Decoy,0,-7.97391,-6.27,-3.52,-6.911872383563595
CCCCOc1ccc(C(=O)NNC(=O)c2[nH]c(C)c(C(C)=O)c2CC)cc1OC,C48313291_decoy,CASP3,Decoy,0,-7.74116,-5.39,-1.86,-7.131414251659768
CCCCn1c(N)c(N(Cc2ccco2)C(=O)C[C@H](C)c2ccc(F)cc2)c(=O)[nH]c1=O,C59850927_decoy,CASP3,Decoy,0,-6.43146,-6.31,-1.62,-6.005591534418373
COc1cc(NC(=O)c2cc(Cl)c(OCCC(C)C)c(OC)c2)c(C(N)=O)cc1OC,C60204894_decoy,CASP3,Decoy,0,-8.19113,-6.83,-2.09,-8.246925840553414
C=CCn1c(CNc2ccccc2)nnc1SCC(=O)N/[NH+]=C/c1ccccc1[O-],C00695581_decoy,CASP3,Decoy,0,-5.49869,-6.8,-2.74,-5.336551237359928
O=C(N[C@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl)c1ccco1,C01232117_decoy,CASP3,Decoy,0,-8.07401,-6.06,-0.91,-6.925426577350251
CCC(O)(CC)C(=O)NN(C(=O)CNS(=O)(=O)c1ccc(C)cc1)c1ccccc1,C02268104_decoy,CASP3,Decoy,0,-7.47699,-6.26,-2.03,-6.568292758404564
C=CCn1c(S[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1ccccc1,C03522126_decoy,CASP3,Decoy,0,-8.66461,-7.74,-3.93,-7.364718945905391
Cc1cccc(NC(=O)CNC(=O)COC(=O)C2(CC(=O)NC(C)(C)C)CCCC2)c1C,C09256897_decoy,CASP3,Decoy,0,-7.59339,-7.91,-2.74,-7.210656709164501
CCc1cc(=O)oc2c(C)c(OCC(=O)NCCc3ccc(S(N)(=O)=O)cc3)ccc12,C09510380_decoy,CASP3,Decoy,0,-9.19037,-6.85,-2.24,-8.07409318753986
CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1,C03308900_decoy,CASP3,Decoy,0,-7.60796,-5.33,-2.03,-4.831946736328788
CC(C)Cn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nnc1-c1ccco1,C09566719_decoy,CASP3,Decoy,0,-9.16277,-7.39,-0.96,-7.182706058195792
CCOC(=O)c1c(NC(=O)COC(=O)c2cccc(C(F)(F)F)c2)sc(C(N)=O)c1C,C02648976_decoy,CASP3,Decoy,0,-10.508,-7.18,-1.34,-7.372721351581847
Cc1ccccc1-c1nnc(SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)o1,C09631741_decoy,CASP3,Decoy,0,-7.18472,-6.86,-2.94,-6.400650918169002
C=CCNc1nc(C(=O)O[C@H](C)C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)cs1,C10136696_decoy,CASP3,Decoy,0,-7.94623,-6.39,-2.45,-6.13019558468605
CC[C@@H](C)Oc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(OC)c(OC)c2)cc1,C10295958_decoy,CASP3,Decoy,0,-8.88167,-7.1,-1.5,-7.75336126978003
COc1cc(C(=O)NNC(=S)NC(=O)c2cc(Cl)cc(Cl)c2)cc(OC)c1OC,C10505964_decoy,CASP3,Decoy,0,-7.05674,-7.2,-1.03,-6.257647005026873
CC(C)CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)cc1,C10632176_decoy,CASP3,Decoy,0,-8.58182,-6.7,-1.54,-6.901952464155064
O=C(NCCCO)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc(Br)c1,C12659003_decoy,CASP3,Decoy,0,-7.86028,-6.52,-3.34,-7.362079125137666
C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1,C13164811_decoy,CASP3,Decoy,0,-8.34821,-7.92,-2.03,-8.316988362933756
CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1OCC,C14242249_decoy,CASP3,Decoy,0,-9.1688,-6.87,-1.56,-6.690748489231344
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(Cl)c1,C14336776_decoy,CASP3,Decoy,0,-8.15314,-6.01,-1.23,-5.1120513488332655
COCCn1c(N)c(N(Cc2ccccc2)C(=O)c2ccc(C(C)C)cc2)c(=O)[nH]c1=O,C14506949_decoy,CASP3,Decoy,0,-6.97623,-7.23,-1.83,-6.816019909820509
O=C(NCCCO)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(Br)cc1,C16115092_decoy,CASP3,Decoy,0,-8.89186,-6.28,-1.53,-6.928501162486682
CCOC(=O)c1sc(N)c(C#N)c1CSc1nnc(NC[C@@H]2CCCO2)s1,C16331086_decoy,CASP3,Decoy,0,-10.5302,-6.72,-1.75,-10.24500653131232
CCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nnc1-c1ccncc1,C16664874_decoy,CASP3,Decoy,0,-9.1186,-6.48,-1.52,-6.380884166380491
Cc1cccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)c2ccc(OC(C)C)cc2)c1,C17294036_decoy,CASP3,Decoy,0,-9.2999,-6.5,-1.58,-6.827002813201945
NC(=O)c1c(NC(=O)COC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)sc2c1CCC2,C20865697_decoy,CASP3,Decoy,0,-8.9459,-7.93,-1.22,-10.535799344686756
C[C@H](OC(=O)CSc1nc2ccccc2o1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C21604877_decoy,CASP3,Decoy,0,-7.62069,-7.4,-1.4,-6.149555604256743
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1,C22862667_decoy,CASP3,Decoy,0,-7.37967,-6.72,-0.84,-8.205166716827227
COc1cc(C(=O)NCCCc2nn(-c3ccc(F)cc3)c(N)c2C#N)cc(OC)c1C,C25161437_decoy,CASP3,Decoy,0,-7.14171,-7.07,-1.64,-6.367272485015574
Cc1cc(C)c(NC(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)c(Cl)c1,C25955628_decoy,CASP3,Decoy,0,-8.27561,-7.61,-1.33,-7.118699709621411
C[C@H](Sc1nnc(CCC(N)=O)n1Cc1ccco1)C(=O)NC12CC3CC(CC(C3)C1)C2,C28946911_decoy,CASP3,Decoy,0,-9.80991,-6.97,-3.89,-7.55408666713413
C[C@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)Nc1ccc(N(C)C)cc1,C31252649_decoy,CASP3,Decoy,0,-9.97377,-6.03,-1.22,-8.376163254302362
CCOC(=O)C1=C(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)NC(=O)N[C@@H]1c1ccccc1,C32797374_decoy,CASP3,Decoy,0,-7.85079,-5.84,-1.68,-7.806280360676784
CCCCNC(=O)[C@@H](c1ccco1)N(Cc1ccc(C)o1)C(=O)c1cccc(O)c1O,C36597768_decoy,CASP3,Decoy,0,-7.26534,-6.51,-5.9,-7.383132289835626
CN(C)c1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C(F)(F)F)c1,C36759439_decoy,CASP3,Decoy,0,-5.29519,-6.4,-2.23,-4.989969061161699
Cc1ccccc1OCc1nnc(S[C@H](C(=O)NC(N)=O)C(C)C)n1-c1ccccc1,C36812733_decoy,CASP3,Decoy,0,-9.31402,-7.35,-1.66,-11.137486727563584
Cn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1ccc(OC2CCCC2)cc1,C39967086_decoy,CASP3,Decoy,0,-8.65148,-7.85,-1.5,-9.79501693840305
Cc1ccccc1O[C@@H](C)c1nnc(SCC(=O)Nc2ccc(C(N)=O)cc2)n1C,C39967317_decoy,CASP3,Decoy,0,-8.53404,-7.46,-1.06,-6.9496571933913165
CCc1c(C)sc(NC(=O)CSc2nnc(COc3cccc(C)c3)n2C)c1C(N)=O,C39972683_decoy,CASP3,Decoy,0,-9.22637,-7.02,-2.77,-7.364331358281959
C=CCOc1ccc([C@@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2CCO)cc1OC,C39911533_decoy,CASP3,Decoy,0,-7.58112,-5.76,-1.34,-6.171682320356127
CCOc1c(Br)cc(/C=N/NC(=O)CSc2nnc(N)s2)cc1OC,C40947146_decoy,CASP3,Decoy,0,-9.82816,-5.59,-1.59,-7.277208897866953
CCC[C@@H](C(=O)NCc1cccnc1)n1c(-c2cc(-c3ccccc3)no2)cc(C(N)=O)c1C,C43225998_decoy,CASP3,Decoy,0,-7.97908,-7.41,-1.31,-7.963938779183805
Cc1ccc(C(C)C)c(OCc2nnc(SCC(=O)Nc3nc(C)c(C)s3)n2N)c1,C45730679_decoy,CASP3,Decoy,0,-8.57916,-8.21,-2.35,-8.767080158357723
COc1cc([C@@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCOC(C)C)ccc1O,C09293140_decoy,CASP3,Decoy,0,-8.27541,-6.26,-2.33,-6.76412071032788
CCCCn1c2c(c(=O)[nH]c1=O)[C@](NC(=O)CCC1CCCCC1)(C(F)(F)F)C(=O)N2,C09420116_decoy,CASP3,Decoy,0,-7.58521,-6.77,-3.76,-6.495181403862599
NC(=O)Cc1csc(NC(=O)CSc2nnc(-c3ccccc3)n2-c2ccccc2)n1,C10377518_decoy,CASP3,Decoy,0,-9.7079,-8.02,-3.69,-8.190337728134299
COCCOC(=O)c1c(C)[nH]c(C(=O)N[C@H](CC(C)C)c2nc3ccccc3[nH]2)c1C,C58975842_decoy,CASP3,Decoy,0,-7.68298,-7.25,-0.7,-8.925183276084194
C/C(=N\NC(=O)CCCSc1nnc(-c2ccncc2)n1N)c1ccc2ccccc2c1,C58991221_decoy,CASP3,Decoy,0,-6.46609,-6.33,-1.55,-6.327438786651988
COc1ccc(/C=N/Nc2nc(SCC(=O)NCCc3ccc(F)cc3)n[nH]2)cc1,C58996125_decoy,CASP3,Decoy,0,-7.78175,-6.29,-2.62,-5.834135813045366
CCCCc1nnc(NC(=O)[C@H](C)Sc2nc(=O)cc(N)n2-c2ccccc2)s1,C59254447_decoy,CASP3,Decoy,0,-8.30493,-7.29,-2.39,-6.714485343996732
COc1ccc(/C=N/Nc2n[nH]c(SCC(=O)N[C@H]3CCCc4ccccc43)n2)cc1,C20832276_decoy,CASP3,Decoy,0,-8.41529,-6.73,-0.86,-6.80981592387878
COc1ccc(CNC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)cc1OC,C08659274_decoy,CASP3,Decoy,0,-7.11561,-7.58,-1.75,-6.425409654009757
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCc2ccc(Br)cc2)n[nH]1,C59888166_decoy,CASP3,Decoy,0,-8.96056,-5.43,-3.06,-7.301927315357842
COc1cc(OC)cc(C(=O)NNC(=S)Nc2cc(OC)c(Cl)cc2OC)c1,C00986435_decoy,CASP3,Decoy,0,-6.28964,-6.35,-1.25,-6.257548086776016
COc1cc(CNc2cccc(-c3nc4ncccc4o3)c2)cc(Cl)c1OCC(N)=O,C09186388_decoy,CASP3,Decoy,0,-10.366,-7.02,-2.5,-7.024561364884445
CC(C)[C@@](C)(C#N)NC(=O)CSc1nnc(COc2cccc(Br)c2)n1N,C09362951_decoy,CASP3,Decoy,0,-7.92255,-6.27,-2.02,-5.3959569759513055
COc1cc(C(=O)NNC(=S)NC(=O)c2ccc(Cl)cc2Cl)cc(OC)c1OC,C02258074_decoy,CASP3,Decoy,0,-7.28998,-6.39,-1.9,-6.432108103992099
CCOc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1OC,C09921055_decoy,CASP3,Decoy,0,-7.77316,-6.59,-1.41,-6.041592866025382
COC(=O)c1ccc(C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2C)cc1,C10455739_decoy,CASP3,Decoy,0,-7.30306,-7.4,-1.23,-10.187286597188647
CC(=O)NCc1ccc(-c2csc(NC(=O)CNC(=O)c3ccc(C(C)(C)C)cc3)n2)o1,C12052920_decoy,CASP3,Decoy,0,-9.26132,-6.25,-1.75,-5.7525884930004905
CCn1c(CNc2ccc(C)cc2C)nnc1SCC(=O)NNC(=O)c1ccc(C)cc1,C00899224_decoy,CASP3,Decoy,0,-8.17253,-7.74,-2.48,-6.941436750246359
CCc1ccc(-c2noc(CCC(=O)N[C@H](C)c3ccc(S(N)(=O)=O)cc3)n2)cc1,C12768768_decoy,CASP3,Decoy,0,-8.73534,-6.88,-0.8,-6.516558357601965
COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2ccc(Cl)cc2)c(=O)[nH]c1=O,C13149546_decoy,CASP3,Decoy,0,-6.89713,-6.73,-2.43,-6.431673631909499
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)cc1,C14369049_decoy,CASP3,Decoy,0,-6.95247,-7.29,-0.48,-6.0696951265743655
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CSc2ccccc2F)c(=O)[nH]c1=O,C14652787_decoy,CASP3,Decoy,0,-7.74551,-6.25,-2.05,-9.310367877998363
CCCCn1c(N)c(N(Cc2ccco2)C(=O)/C=C/c2cccc(F)c2)c(=O)[nH]c1=O,C14653408_decoy,CASP3,Decoy,0,-7.45983,-6.71,-1.43,-5.860131119928609
CCCCN(C(=O)c1ccc(-n2c(C)ccc2C)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C14720135_decoy,CASP3,Decoy,0,-7.91488,-7.73,-1.66,-7.287187800747199
CC(C)(C)NC(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C14837025_decoy,CASP3,Decoy,0,-7.30136,-6.1,-1.81,-5.6722981387654485
NS(=O)(=O)c1ccc(OCCOC(=O)c2cccnc2Nc2ccccc2F)cc1,C16694838_decoy,CASP3,Decoy,0,-7.27349,-7.45,-1.56,-9.716319404728996
Cc1cccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1,C18055060_decoy,CASP3,Decoy,0,-9.54275,-5.67,-1.61,-8.818966080355676
COCCNC(=O)c1c(NC(=O)COC(=O)c2c[nH]c3ccccc23)sc2c1CCCC2,C19420393_decoy,CASP3,Decoy,0,-8.7609,-7.8,-4.03,-7.355580486947414
CCOC(=O)c1cnn(-c2ccc(C)cc2C)c1CNCCc1ccc(S(N)(=O)=O)cc1,C20119797_decoy,CASP3,Decoy,0,-8.16422,-4.79,-3.88,-6.007961225113111
CCOCCCNC(=O)c1ccc2c(c1)NC(=O)[C@@H](CS(=O)(=O)Cc1ccccc1C)N2,C20680473_decoy,CASP3,Decoy,0,-8.27311,-6.92,-2.73,-6.646100947454132
C=CCn1c(CNc2ccc(C)cc2)nnc1SCC(=O)NNC(=O)c1ccc(F)cc1,C20923046_decoy,CASP3,Decoy,0,-9.09911,-5.82,-3.78,-6.924648244123139
Cc1c(Cl)cnc(NC(=O)COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1Cl,C21482166_decoy,CASP3,Decoy,0,-9.84837,-7.22,-1.74,-8.141233141389641
COc1ccc(C(=O)NCCCc2nc3ccccc3[nH]2)cc1S(=O)(=O)NC(C)(C)C,C21528285_decoy,CASP3,Decoy,0,-6.95762,-6.63,-2.1,-6.463255167647502
CCOc1cc(CNn2nnnc2N)cc(Br)c1OCc1ccccc1F,C22111732_decoy,CASP3,Decoy,0,-8.5046,-8.67,-1.74,-12.393540286434206
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)c1c(NC(C)=O)sc2c1CCCC2,C22863257_decoy,CASP3,Decoy,0,-9.02401,-6.16,-2.28,-7.360426974619399
CCCCn1c(N)c(N(Cc2ccccc2)Cc2nnsc2Cl)c(=O)[nH]c1=O,C27315571_decoy,CASP3,Decoy,0,-10.6152,-7.59,-1.82,-8.721982225384817
C[C@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)Nc1ccccc1C(F)(F)F,C29665456_decoy,CASP3,Decoy,0,-6.99408,-6.84,-0.46,-8.272134759368607
COCCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccc(NC(=O)NC(C)(C)C)cc1,C35729725_decoy,CASP3,Decoy,0,-7.13319,-7.35,-1.9,-5.797350209425399
CCCCN(C(=O)CN1CCCc2cc(F)cc(F)c21)c1c(N)n(CCC)c(=O)[nH]c1=O,C36754176_decoy,CASP3,Decoy,0,-7.11259,-6.28,-2.07,-6.550093152012916
CCOC(=O)CS[C@H]1Nc2ccccc2C(=O)N1NC(=O)CCc1c[nH]c2ccccc12,C39367148_decoy,CASP3,Decoy,0,-6.59183,-7.63,-1.31,-6.733476290898181
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccc(OC(F)(F)F)cc2)cc1,C39589106_decoy,CASP3,Decoy,0,-8.60666,-6.16,-2.35,-5.66061874022575
CCOC(=O)c1c(NC(=O)[C@H](CC)n2c(N)nnc2SCC)sc2c1CCCC2,C40172465_decoy,CASP3,Decoy,0,-8.31919,-6.02,-3.09,-5.549164701716432
C=CCOc1ccc([C@H]2c3c(-c4cc(C)cc(C)c4O)n[nH]c3C(=O)N2CCO)cc1OC,C39911532_decoy,CASP3,Decoy,0,-7.28313,-6.1,-1.73,-5.051829070388203
CCOc1ccc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C38704882_decoy,CASP3,Decoy,0,-5.9333,-5.56,-2.78,-5.772820525721841
CCCCn1c2c(c(=O)[nH]c1=O)[C@@](NC(=O)CCC1CCCCC1)(C(F)(F)F)C(=O)N2,C09420117_decoy,CASP3,Decoy,0,-7.23761,-5.98,-3.6,-7.694386831762506
CCOC(=O)c1c(NC(=O)CN2CCN(c3ccc(C)cc3)[C@H](C)C2)sc(C(N)=O)c1C,C35889556_decoy,CASP3,Decoy,0,-9.87797,-7.11,-2.49,-8.000362631314992
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCNS(=O)(=O)c1cccs1,C57377432_decoy,CASP3,Decoy,0,-9.54201,-7.43,-2.14,-9.794414203149634
CCOC(=O)c1c(NC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)sc(C)c1CC,C58510647_decoy,CASP3,Decoy,0,-9.14317,-5.92,-1.5,-7.1736052239420935
Nn1c(SCCCC(=O)N/N=C/c2ccc(Br)cc2)nnc1-c1ccncc1,C58989603_decoy,CASP3,Decoy,0,-7.43764,-4.95,-1.37,-5.348264686584662
CCOc1ccc(/C=N/Nc2nc(SCC(=O)NCc3ccc(F)cc3)n[nH]2)cc1,C59014672_decoy,CASP3,Decoy,0,-8.42704,-6.9,-2.59,-5.716159659822233
C/C(=N/Nc1nc(SCC(=O)Nc2ccccc2C(F)(F)F)n[nH]1)c1ccccn1,C59038574_decoy,CASP3,Decoy,0,-8.30646,-7.85,-2.08,-7.002682585187465
CC[C@H](C)Sc1nnc(NC(=O)CSc2nnc(-c3ccccc3)n2N)s1,C59266093_decoy,CASP3,Decoy,0,-9.25514,-6.67,-1.57,-6.668262662278414
Cc1cc(C)cc(N(C)CC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)c1,C59423710_decoy,CASP3,Decoy,0,-7.54697,-6.52,-1.56,-6.6292811609846325
Cc1cc(C)nc(NC(=NC(=S)NCCCN2CCOCC2)NC2CCCCC2)n1,C14156502_decoy,CASP3,Decoy,0,-8.88741,-5.5,-3.26,-6.073860396423108
O=C(CSc1nnc(CNc2ccccc2)n1-c1ccccc1)NNC(=O)c1ccccc1,C59808582_decoy,CASP3,Decoy,0,-6.90911,-6.84,-1.6,-5.975751569906175
CC(C)CN(C(=O)CN(C)c1ccc(F)c(F)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C59993443_decoy,CASP3,Decoy,0,-7.07009,-7.56,-2.59,-7.3150469487768035
CC(C)c1ccccc1-n1c(SCCCC(=O)NC(N)=O)nnc1-c1cccnc1,C60340246_decoy,CASP3,Decoy,0,-7.74801,-6.98,-0.13,-7.502093894009873
CCCCn1c(N)c(N(CC)C(=O)CN(Cc2ccsc2)c2ccccc2)c(=O)[nH]c1=O,C60349685_decoy,CASP3,Decoy,0,-9.95803,-6.87,-1.48,-8.421465289234877
CCOc1ccccc1NC(=O)[C@H](CCSC)NC(=O)N1CC(O)=Nc2ccccc21,C13626515_decoy,CASP3,Decoy,0,-7.67145,-7.12,-1.26,-6.63180566991315
O=C(CNc1ccc(OC[C@H]2CCCO2)cc1)Nc1ccc(C(=O)NCc2ccco2)cc1,C66227760_decoy,CASP3,Decoy,0,-9.37822,-7.26,-1.28,-8.919057012821382
C=CCn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)Nc1ccc(C(N)=O)cc1,C02227995_decoy,CASP3,Decoy,0,-8.37083,-6.79,-1.67,-6.609312777334828
O=C(N[C@@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl)c1ccco1,C01232116_decoy,CASP3,Decoy,0,-8.40974,-5.3,-0.96,-5.746014969089089
CCC(CC)n1c(COc2ccccc2Cl)nnc1S[C@@H](C)C(=O)NC(N)=O,C09033761_decoy,CASP3,Decoy,0,-9.11971,-7.13,-1.6,-8.72282510406936
Cc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)CCC3CCCCC3)cc2)no1,C08723364_decoy,CASP3,Decoy,0,-9.09714,-6.81,-2.93,-5.803096374072212
CCOC(=O)c1c(NC(=O)CSc2nnc(-c3cccs3)n2N)sc(C)c1C,C09284668_decoy,CASP3,Decoy,0,-9.43776,-6.9,-1.72,-6.923504504693959
CC(C)CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1C(N)=O,C08706608_decoy,CASP3,Decoy,0,-9.41936,-7.31,-2.36,-7.37292264915925
C[C@@H](Sc1nnc(-c2cccs2)n1C[C@H]1CCCO1)C(=O)Nc1ccc(C(N)=O)cc1,C09778242_decoy,CASP3,Decoy,0,-8.94825,-7.12,-0.77,-6.695693784489024
COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)COc2cc(C)cc(C)c2)cc1OC,C10041250_decoy,CASP3,Decoy,0,-7.31158,-7.36,-2.84,-6.105510951207257
Cn1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)(C)C)cc2)c2ccccc21,C10737005_decoy,CASP3,Decoy,0,-7.04154,-8.16,-1.17,-6.334608880340434
CC(C)CN(C(=O)CSc1ccc2ccccc2n1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C10961902_decoy,CASP3,Decoy,0,-7.62785,-7.6,-1.62,-7.404569818468786
CCCCN(C(=O)COc1ccc(F)cc1Cl)c1c(N)n(CCC)c(=O)[nH]c1=O,C11028253_decoy,CASP3,Decoy,0,-6.96963,-5.77,-2.19,-5.387215665959318
CN(C(=O)c1cccs1)c1ccccc1C(=O)OCC(=O)Nc1sccc1C(N)=O,C11491142_decoy,CASP3,Decoy,0,-8.24759,-7.64,-2.73,-10.464644058497637
COCCN(C(=O)CSc1c(C)cc(C)cc1C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C11646922_decoy,CASP3,Decoy,0,-7.41317,-6.11,-2.89,-7.078694408256914
COc1cc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)cc(OC)c1OCC(N)=O,C12590186_decoy,CASP3,Decoy,0,-8.60448,-6.28,-1.56,-8.184931012675339
CCCCn1c(N)c(N(CCC(C)C)C(=O)c2ccc3ccccc3n2)c(=O)[nH]c1=O,C14623512_decoy,CASP3,Decoy,0,-7.36348,-6.7,-4.9,-6.455556308573126
CC(C)=CCNc1cc(C(=O)NCc2cn3ccccc3n2)cc(S(=O)(=O)NC(C)C)c1,C14748192_decoy,CASP3,Decoy,0,-8.04428,-7.0,-3.18,-7.528522212341547
CSCC[C@H](NC(=O)Cc1csc(NC(=O)c2ccco2)n1)c1nc2ccccc2[nH]1,C16645774_decoy,CASP3,Decoy,0,-9.36856,-5.57,-1.3,-6.7849001999242935
C=CCn1c(SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)nnc1-c1ccccc1C,C16807927_decoy,CASP3,Decoy,0,-9.31978,-6.74,-1.74,-7.999889517935175
Cc1cc(C)nc(N/C(=N/C(=O)/C=C/c2ccco2)NCCc2c[nH]c3ccc(F)cc23)n1,C18077260_decoy,CASP3,Decoy,0,-8.09771,-6.09,-2.11,-6.135463887250462
CC(C)(C)NC(=O)c1cccc(NC(=S)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1,C20117120_decoy,CASP3,Decoy,0,-6.64893,-6.71,-1.72,-6.441107089662275
Cc1ccccc1NCc1nnc(SCC(=O)NNC(=O)C(C)(C)C)n1-c1ccccc1,C20831460_decoy,CASP3,Decoy,0,-7.40581,-6.96,-2.62,-6.266659011559912
COc1cccc(CN/C(=N\C(=S)NCc2ccco2)Nc2nc(C)cc(C)n2)c1,C14156120_decoy,CASP3,Decoy,0,-8.13295,-6.73,-2.84,-7.176030514388098
CCCOc1c(Br)cc(C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)cc1OC,C22577042_decoy,CASP3,Decoy,0,-8.29866,-5.33,-3.57,-6.268636745854776
CCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1OC,C23217924_decoy,CASP3,Decoy,0,-8.44302,-6.05,-0.91,-6.245376050184747
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CSc2ccc(F)cc2)c(=O)[nH]c1=O,C24004662_decoy,CASP3,Decoy,0,-7.87698,-7.16,-2.95,-7.169725797454343
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NCCNC(=O)c3ccco3)ccc2C)cc1,C25520845_decoy,CASP3,Decoy,0,-6.79172,-6.9,-3.22,-5.23941905264308
O=C([O-])C[C@H]1c2ccccc2C(=O)N(CC(=O)NCCCNc2cccc[nH+]2)c2ccccc21,C27519050_decoy,CASP3,Decoy,0,-6.99402,-6.36,-3.68,-6.056580675641995
CCNc1nc(SCC(=O)NCc2ccc(CS(=O)(=O)NC)cc2)nc2ccccc12,C27914936_decoy,CASP3,Decoy,0,-7.6439,-7.52,-2.21,-7.321667506085254
C[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)Nc1ccc(N(C)C)cc1,C31252647_decoy,CASP3,Decoy,0,-9.56149,-7.66,-3.52,-8.113556980249934
CNC(=O)Cc1csc(NC(=O)c2csc(Nc3ccc(OC(F)F)cc3)n2)n1,C35596751_decoy,CASP3,Decoy,0,-8.24807,-5.95,-1.15,-6.841686491909419
CCCCn1c(N)c(N(CC(C)C)C(=O)c2ccc(-n3c(C)ccc3C)cc2)c(=O)[nH]c1=O,C12522956_decoy,CASP3,Decoy,0,-7.48099,-6.46,-1.17,-5.552440923069122
COCCCNC(=O)[C@@H]1[C@H]2CCCC[C@@H]2S[C@@H]1NC(=O)C1=NN=C(c2ccccc2O)C1,C38994459_decoy,CASP3,Decoy,0,-7.9366,-5.8,-2.88,-5.8738422992362205
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)[C@@H](C)n1c(N)nnc1SC,C40172194_decoy,CASP3,Decoy,0,-8.40394,-5.29,-1.99,-5.918587396921173
CCOC(=O)c1c(NC(=O)[C@H](CC)n2c(N)nnc2SC)sc2c1CCCC2,C40172206_decoy,CASP3,Decoy,0,-8.53232,-6.6,-2.02,-8.498652240879835
CCOC(=O)c1c(NC(=O)CNc2ccc3nc(C)sc3c2)sc(C(=O)NC)c1C,C45887109_decoy,CASP3,Decoy,0,-10.0753,-6.58,-1.89,-7.413936460682312
CSc1ncc(C(=O)NCCCc2nn(-c3ccccc3)c(N)c2C#N)n1-c1ccccc1,C46705731_decoy,CASP3,Decoy,0,-7.0103,-5.93,-1.53,-5.813008582111148
CCOc1ccc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCO)cc1OCC,C09409212_decoy,CASP3,Decoy,0,-8.03544,-6.68,-2.93,-7.670896507847473
CCOc1cc([C@@H]2c3c(-c4cc(C)ccc4O)n[nH]c3C(=O)N2CCCOC)ccc1O,C11914912_decoy,CASP3,Decoy,0,-7.6945,-6.29,-1.59,-7.049180890404869
Cc1ccccc1N1CCN(CC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC(C)C)CC1,C20418736_decoy,CASP3,Decoy,0,-11.7942,-7.16,-2.13,-9.406211324260752
CCOc1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OCC)c1OCC,C23913995_decoy,CASP3,Decoy,0,-6.96458,-5.14,-1.17,-4.965740852790226
CC(=O)Nc1cccc(C(=O)/N=C(/NCCN2CCOCC2)Nc2cc(Cl)ccc2C)c1,C46133590_decoy,CASP3,Decoy,0,-8.34081,-8.18,-0.92,-8.862780279118141
Cc1cccc(C)c1NC(=O)CSc1n[nH]c(N/N=C/c2ccc(N(C)C)cc2)n1,C05936020_decoy,CASP3,Decoy,0,-7.74559,-7.22,-2.36,-5.753576118311594
CC(=O)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(Cl)cc3)n2)cc1,C59015291_decoy,CASP3,Decoy,0,-7.59698,-6.9,-1.82,-5.848851405618139
C/C(=N/Nc1nc(SCC(=O)Nc2ccccc2C(F)(F)F)n[nH]1)c1ccncc1,C59023658_decoy,CASP3,Decoy,0,-7.3134,-7.5,-1.27,-6.392801545044289
CCOC(=O)c1c(NC(=O)CSc2nnc(-c3ccccc3)n2N)sc2c1CCC2,C59042203_decoy,CASP3,Decoy,0,-7.41079,-7.41,-0.66,-6.064030567561536
CCCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C(/C)c2cccnc2)n1,C59310471_decoy,CASP3,Decoy,0,-8.47273,-7.16,-1.68,-6.08835892364654
CCCCN1C(=O)C[C@H](C(=O)NCCNC(=O)c2ccc(O)cc2)[C@@H]1c1ccc(OC)cc1,C59418794_decoy,CASP3,Decoy,0,-8.14015,-6.74,-1.88,-6.720782626851346
COc1ccc(/C=N/Nc2n[nH]c(SCC(=O)N[C@@H]3CCCc4ccccc43)n2)cc1,C20832273_decoy,CASP3,Decoy,0,-7.77339,-7.01,-1.96,-5.538594288987851
CC(C)(C)OC(=O)NCC1CCN(C(=O)CCCNC(=O)NC2CCCCC2)CC1,C60319906_decoy,CASP3,Decoy,0,-7.763,-5.98,-1.97,-6.05019172202841
Cc1ccc(NCCNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(C)c3)cc2)nn1,C60376899_decoy,CASP3,Decoy,0,-7.29628,-8.13,-2.88,-6.929440867477291
COCCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nnc1-c1ccccc1,C06904722_decoy,CASP3,Decoy,0,-7.39818,-7.22,-1.64,-6.778303955202717
COc1cc(/C=C/C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)ccc1OC(F)F,C09246968_decoy,CASP3,Decoy,0,-7.48974,-7.49,-0.84,-6.761502602947677
Cc1ccccc1NC(=O)c1oc2ccccc2c1NC(=O)C(=O)NCCCOC(C)C,C09705821_decoy,CASP3,Decoy,0,-7.90072,-6.73,-3.83,-5.725507032276359
Cc1ccc(S(=O)(=O)NCC(=O)NCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1,C10130740_decoy,CASP3,Decoy,0,-7.06828,-8.58,-1.42,-7.499123767177217
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)[C@H](C)SCC(=O)Nc1ccc(F)cc1,C10472702_decoy,CASP3,Decoy,0,-8.63884,-5.92,-1.45,-6.845954846597159
CC(=O)NCc1ccc(-c2csc(NC(=O)CCNC(=O)c3ccc(C(C)(C)C)cc3)n2)o1,C12050668_decoy,CASP3,Decoy,0,-8.30595,-6.63,-2.11,-6.037514254937481
CCOC(=O)/C=C/C(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2cc(C)cc(C)c2)cc1,C12495326_decoy,CASP3,Decoy,0,-8.04979,-7.08,-0.76,-9.670207666454791
COc1cc(C(=O)NNC(=S)NC(=O)c2ccc(C(C)(C)C)cc2)cc(OC)c1OC,C12573814_decoy,CASP3,Decoy,0,-7.12323,-5.95,-1.39,-5.692813938460984
CCOC(=O)c1c(NC(=O)CSc2nccn2-c2cccc(C)c2C)sc(C(N)=O)c1C,C12604493_decoy,CASP3,Decoy,0,-9.61818,-6.25,-3.21,-7.328934761397593
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CSc2ccc(C)cc2)c(=O)[nH]c1=O,C14652780_decoy,CASP3,Decoy,0,-7.16109,-6.49,-1.53,-6.7674212483385086
COCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2ccc(Cl)cc2Cl)cc1,C14657147_decoy,CASP3,Decoy,0,-8.35221,-5.56,-0.94,-6.096093114842826
CCCCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccc(Cl)cc2)cc1OC,C15476566_decoy,CASP3,Decoy,0,-7.64821,-6.9,-2.59,-7.336776508790655
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=S)NC[C@H]3CCCO3)cc2)c1,C15899951_decoy,CASP3,Decoy,0,-7.90016,-7.57,-3.07,-7.0073641311695765
Cc1ccc(OCc2nc(C(=O)NNC(=S)NCc3ccc4c(c3)OCO4)cs2)cc1,C16228975_decoy,CASP3,Decoy,0,-8.34662,-5.29,-1.99,-5.581852150604252
CCCn1c(CCC(=O)NCCOc2ccc(Cl)cc2)nc2cc(S(N)(=O)=O)ccc21,C18151038_decoy,CASP3,Decoy,0,-10.7475,-7.86,-3.22,-8.613276842628458
COc1ccc(CCNC(=O)CSc2nnc(-c3ccc(OC(F)F)cc3)n2N)cc1,C03533890_decoy,CASP3,Decoy,0,-8.11057,-6.21,-1.3,-6.335098119512398
CC(C)CN(C(=O)c1ccc(COCC(F)(F)F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C22192487_decoy,CASP3,Decoy,0,-7.58366,-6.4,-0.9,-6.88319191515877
Cc1ccc(NC(=O)Cc2nc(CSc3nnc(CCC(N)=O)n3CC(C)C)cs2)cc1,C23329684_decoy,CASP3,Decoy,0,-9.12051,-6.61,-1.25,-7.99102572775472
CCCCn1c(N)c(N(Cc2ccco2)C(=O)[C@H](C)Sc2ccccc2)c(=O)[nH]c1=O,C24004679_decoy,CASP3,Decoy,0,-6.50051,-7.04,-5.03,-7.325514327773726
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCCNc2ncc(C(F)(F)F)cc2Cl)o1,C24617553_decoy,CASP3,Decoy,0,-7.76819,-7.45,-2.81,-7.161198010211217
COC(=O)c1c(NC(=O)CSc2nnc(SCC(N)=O)s2)sc2c1CC[C@@H](C)C2,C24660125_decoy,CASP3,Decoy,0,-10.8036,-5.75,-0.84,-8.283393145634646
CC(C)N(C)S(=O)(=O)c1ccc(NCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)cc1,C25073889_decoy,CASP3,Decoy,0,-6.40149,-7.71,-1.21,-5.578595141665131
Cc1ccc(OCc2nc(C(=O)O[C@H](C)C(=O)Nc3ccc(C(N)=O)cc3)cs2)cc1,C30404893_decoy,CASP3,Decoy,0,-8.1032,-7.41,-0.63,-6.072488106190759
N#Cc1c(CCCNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)nn(-c2ccc(F)cc2)c1N,C31118415_decoy,CASP3,Decoy,0,-7.60442,-8.58,-3.26,-7.573193213056981
COc1ccc(OCc2nnc(SCC(=O)NCCSc3ccccc3)n2N)cc1,C32739545_decoy,CASP3,Decoy,0,-10.0129,-6.07,-2.93,-7.024132047251673
CCCCNC(=O)[C@H](c1cccc(O)c1)N(Cc1ccco1)C(=O)CNC(=O)c1ccccc1,C36504280_decoy,CASP3,Decoy,0,-8.98333,-5.63,-5.53,-7.702224496495673
CCCCNC(=O)[C@H](c1ccccc1O)N(Cc1ccco1)C(=O)CNC(=O)c1ccccc1,C36504330_decoy,CASP3,Decoy,0,-8.08623,-6.77,-2.3,-7.21428000762786
CCCCCCN(C(=O)[C@@H]1CCC(=O)N1)[C@H](C(=O)NC(C)(C)C)c1ccc(O)c(OC)c1,C36519698_decoy,CASP3,Decoy,0,-7.25496,-6.64,-2.58,-6.957662797734884
CCCCC[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1c(O)cccc1O,C36531155_decoy,CASP3,Decoy,0,-7.18042,-7.46,-1.02,-6.280087773401188
CCC(CC)[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1cccc(O)c1O,C36531385_decoy,CASP3,Decoy,0,-6.4018,-7.26,-3.96,-7.7645445728796
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(C(=O)[C@@H]1CCC(=O)N1)c1ccccc1Cl,C36548573_decoy,CASP3,Decoy,0,-7.99329,-7.13,-1.48,-8.934542409049547
CCCCNC(=O)[C@H](c1ccc(OC)c(OC)c1)N(CCC)C(=O)c1cccc(O)c1O,C36571383_decoy,CASP3,Decoy,0,-8.13081,-5.67,-2.78,-8.360856474966733
CCCN(C(=O)[C@@H]1CCC(=O)N1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(O)c(OC)c1,C36575964_decoy,CASP3,Decoy,0,-8.94138,-6.16,-2.51,-7.548041404133536
COc1cc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc2ccc(C)o2)C(=O)CO)ccc1O,C36600585_decoy,CASP3,Decoy,0,-8.39853,-6.08,-2.29,-7.746877951800093
CCOC(=O)c1c(NC(=O)CSc2nc(CNc3ccccc3)n[nH]2)sc(C)c1C,C08441520_decoy,CASP3,Decoy,0,-10.4329,-6.33,-1.86,-8.057385540631799
Cc1cccc(N(C)c2cc(Nc3cccc(C(=O)N(C[C@H](C)O)C[C@H](C)O)c3)ncn2)c1,C39301538_decoy,CASP3,Decoy,0,-7.94335,-7.1,-1.97,-7.4368165324540385
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1,C39484814_decoy,CASP3,Decoy,0,-7.8358,-7.49,-1.45,-6.832386132564747
CC(C)OCCCn1c(S[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)nc2ccccc2c1=O,C13038797_decoy,CASP3,Decoy,0,-7.36696,-6.85,-1.63,-6.650750965984013
CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc1ccc(Br)cc1,C40174344_decoy,CASP3,Decoy,0,-7.69387,-6.04,-3.13,-7.604855107541189
C=CCOc1ccc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C38706028_decoy,CASP3,Decoy,0,-8.07024,-5.82,-4.05,-7.323008649580459
CCCOc1c(Br)cc(/C=N/NC(=O)CSc2nnc(N)s2)cc1OC,C40947148_decoy,CASP3,Decoy,0,-9.93005,-5.84,-1.97,-8.159924688759002
CCC[C@@H](C(=O)NC[C@H]1CCCO1)n1c(-c2cc(-c3ccccc3)no2)cc(C(N)=O)c1C,C43225993_decoy,CASP3,Decoy,0,-8.11063,-7.09,-3.89,-7.79102428455908
CCOc1cc([C@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2CCCOC(C)C)ccc1O,C09409112_decoy,CASP3,Decoy,0,-7.58345,-6.73,-1.35,-6.874140846248085
CCCCN(C(=O)CN(C)Cc1c(F)cccc1Cl)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C21134228_decoy,CASP3,Decoy,0,-7.88342,-7.48,-1.84,-7.209170125060892
NS(=O)(=O)c1ccc(OCCSc2nc(COc3ccc(Cl)cc3)n[nH]2)cc1,C27334458_decoy,CASP3,Decoy,0,-8.53692,-5.54,-1.87,-6.027932631051748
COc1ccc(/C(C)=N/NC(=O)CCCSc2nnc(CCc3ccccc3)n2N)cc1,C58991883_decoy,CASP3,Decoy,0,-10.2248,-7.06,-1.46,-11.0314917344092
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)NCc3ccc(F)cc3)n[nH]2)cc1,C59005733_decoy,CASP3,Decoy,0,-8.43603,-7.06,-1.66,-7.030540816818135
Cc1ccccc1NCc1nnc(SCC(=O)NNC(=O)c2ccccc2)n1-c1ccccc1,C59811760_decoy,CASP3,Decoy,0,-6.40317,-7.94,-3.26,-8.681374986523082
CC(C)C(=O)NNC(=O)[C@@H](C)Sc1nnc(CNc2ccc(Cl)cc2)n1-c1ccccc1,C59878133_decoy,CASP3,Decoy,0,-8.26713,-7.19,-1.5,-6.447913935351098
CC[C@@H](C)NC(=O)c1cc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)cnc1N1CC[NH2+]CC1,C65025262_decoy,CASP3,Decoy,0,-7.51467,-7.63,-1.97,-6.855288735423606
CCn1c(COc2ccccc2)nnc1SCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C06878319_decoy,CASP3,Decoy,0,-8.32099,-7.72,-1.94,-6.9514068912230575
O=C(CSc1nnc(NC[C@@H]2CCCO2)s1)Nc1ccccc1C(=O)NC1CCCC1,C08778059_decoy,CASP3,Decoy,0,-9.40663,-6.13,-0.81,-7.08592859092879
COc1cc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc(Cl)c1OC(C)C,C10145750_decoy,CASP3,Decoy,0,-8.3237,-6.46,-2.68,-6.104563386246687
C=C(C)COc1ccc2c(C)c(CC(=O)NCCc3ccc(S(N)(=O)=O)cc3)c(=O)oc2c1,C13593371_decoy,CASP3,Decoy,0,-8.30457,-7.19,-1.78,-8.765155348759412
COCCCN/C(=N\C(=S)Nc1cc(Cl)ccc1OC)Nc1nc(C)cc(C)n1,C14158673_decoy,CASP3,Decoy,0,-9.16826,-5.58,-3.12,-6.986348714831171
COCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2cc(C)c(Cl)c(C)c2)cc1,C14657090_decoy,CASP3,Decoy,0,-7.81009,-7.31,-2.41,-6.643126002881107
COc1ccc(Cl)cc1C(=O)NNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1,C15893666_decoy,CASP3,Decoy,0,-8.00724,-6.55,-1.48,-5.902106307472387
CCCOc1c(Cl)cc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1OCC,C16910986_decoy,CASP3,Decoy,0,-7.61886,-6.6,-2.46,-7.266219029201207
Cc1cc(C)nc(N/C(=N/C(=O)COc2ccccc2)NCCc2c[nH]c3ccc(F)cc23)n1,C18077227_decoy,CASP3,Decoy,0,-6.27237,-6.48,-2.26,-5.995665537760566
COc1cc(OC)c(OC)cc1CNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2,C18113396_decoy,CASP3,Decoy,0,-7.2325,-6.21,-4.03,-5.253316925126503
CCOC(=O)c1cc(C(C)C)sc1NC(=O)/C(C#N)=C/c1cn(CC(N)=O)c2ccccc12,C20168618_decoy,CASP3,Decoy,0,-9.94625,-7.16,-3.56,-7.691113409217582
CCOc1ccc(/C=N/Nc2nc(SCC(=O)N[C@@H]3CCCc4ccccc43)n[nH]2)cc1,C20833136_decoy,CASP3,Decoy,0,-8.64056,-6.44,-1.75,-6.19260387117471
CCc1nnc(SCC(=O)Nc2nnc(SCCCc3ccccc3)s2)n1N,C20843030_decoy,CASP3,Decoy,0,-9.64382,-7.12,-2.19,-7.591180919014248
CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)CSc1nnc(C2CC2)n1N,C20921352_decoy,CASP3,Decoy,0,-7.02442,-5.6,-1.81,-5.4438416151724365
O=C(CSc1n[nH]c(N/N=C/c2cccnc2)n1)NC(c1ccccc1)c1ccccc1,C21039010_decoy,CASP3,Decoy,0,-7.68259,-7.29,-2.34,-6.127055897233828
Cc1cc(Cl)ccc1OCCCC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C21056857_decoy,CASP3,Decoy,0,-7.38654,-7.28,-1.79,-6.862639446516939
CCOC(=O)c1cnn(-c2ccc(C(=O)NCCOC34CC5CC(CC(C5)C3)C4)cc2)c1N,C21115437_decoy,CASP3,Decoy,0,-7.99824,-7.27,-1.85,-7.705828042794626
Cc1cc(C)nc(N/C(=N/C(=S)NCCCN2CCOCC2)NCc2ccc(F)cc2)n1,C14156934_decoy,CASP3,Decoy,0,-9.1696,-6.48,-2.62,-6.264543369756349
CCN(CC)C(=O)CSc1nnc(S[C@@H](C)C(=O)Nc2cc(C)ccc2C)n1N,C21605285_decoy,CASP3,Decoy,0,-7.03595,-6.98,-3.23,-6.52804795645685
CCCCn1c(CSc2nnc(NC3CC3)s2)nc2cc(S(N)(=O)=O)ccc21,C22174529_decoy,CASP3,Decoy,0,-10.8183,-6.9,-2.01,-9.776734880428055
Nc1nc(COC(=O)c2cccnc2SCC(F)(F)F)nc(Nc2ccccc2)n1,C22524495_decoy,CASP3,Decoy,0,-8.68886,-7.58,-3.11,-10.330003490413416
NC(=O)CCn1c(S[C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)nnc1-c1ccco1,C25955533_decoy,CASP3,Decoy,0,-8.26393,-8.06,-2.23,-7.437862180360822
NC(=O)CCn1c(SCC(=O)N[C@H](c2ccccc2)c2cccs2)nnc1-c1ccco1,C25956908_decoy,CASP3,Decoy,0,-7.65343,-7.73,-2.29,-7.414353787242326
CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1nnc(CCC(N)=O)n1Cc1ccco1,C28946922_decoy,CASP3,Decoy,0,-10.2301,-7.27,-4.61,-8.72727711081839
O=C(OC[C@H](O)[C@H](O)[C@H](O)c1cnn(-c2ccccc2)n1)c1ccc(-c2ccccc2)cc1,C09128500_decoy,CASP3,Decoy,0,-6.02885,-8.08,-1.18,-5.705715341045468
CCCCNC(=O)[C@@H](c1cccc(OC)c1)N(Cc1ccco1)C(=O)c1cccc(O)c1O,C36500726_decoy,CASP3,Decoy,0,-8.49953,-6.1,-2.79,-7.318082732587571
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1cccc(O)c1)N(Cc1ccco1)C(=O)[C@@H]1CCC(=O)N1,C36504487_decoy,CASP3,Decoy,0,-8.44362,-6.57,-3.14,-6.991533213551984
CCC(CC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1c(O)cccc1O,C36531088_decoy,CASP3,Decoy,0,-7.41588,-7.02,-2.34,-6.199696740324354
CCCCC[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1c(O)cccc1O,C36531154_decoy,CASP3,Decoy,0,-6.73049,-7.16,-2.39,-6.838053582222582
Cc1cccc(N(C)c2cc(Nc3cccc(C(=O)N(C[C@H](C)O)C[C@@H](C)O)c3)ncn2)c1,C39301537_decoy,CASP3,Decoy,0,-8.80526,-7.22,-2.61,-7.2398920201312125
CCn1c(S[C@@H](C)C(=O)Nc2cccc(C)c2)nnc1[C@H](CO)NC(=O)c1cccc(C)c1,C39753819_decoy,CASP3,Decoy,0,-8.55206,-6.81,-2.8,-8.983003602274044
CCn1c(CCNC(=O)c2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)Nc1ccccc1O,C39761492_decoy,CASP3,Decoy,0,-8.40257,-7.71,-1.15,-7.1726665923784525
C=CCn1c(Cc2ccc(OC)cc2)nnc1SCC(=O)Nc1sc(C)c(C)c1C(N)=O,C39967625_decoy,CASP3,Decoy,0,-7.67226,-7.13,-2.14,-6.384941985980071
C=CCOc1ccc([C@@H]2c3c(-c4cc(Cl)ccc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C39898115_decoy,CASP3,Decoy,0,-8.30875,-6.23,-4.02,-7.143466584940955
C=CCOc1ccc([C@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C38706027_decoy,CASP3,Decoy,0,-7.61033,-5.92,-1.31,-7.639095961768238
COc1ccc(CCNc2ncnc(N(Cc3ccccc3)c3ccccn3)c2N)cc1OC,C40683991_decoy,CASP3,Decoy,0,-8.82424,-6.99,-1.96,-6.93147627509454
CCSc1nc2n(n1)[C@H](c1ccc(OCCc3ccccc3)c(OC)c1)C(C(N)=O)=C(C)N2,C41004886_decoy,CASP3,Decoy,0,-10.0694,-6.32,-1.91,-7.53203976512993
CCCOc1ccc([C@@H]2c3c(-c4cc(C)ccc4O)n[nH]c3C(=O)N2CCO)cc1OCC,C09184755_decoy,CASP3,Decoy,0,-8.39381,-5.81,-3.79,-7.514308455873945
Cc1ccc(-c2cnc(CCC(=O)O[C@@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)o2)cc1,C21585562_decoy,CASP3,Decoy,0,-9.1357,-7.76,-2.46,-6.895348753611367
COc1ccc(/C=N/Nc2nc(SCC(=O)NCc3ccc(C(F)(F)F)cc3)n[nH]2)cc1,C58995946_decoy,CASP3,Decoy,0,-8.74608,-6.77,-3.01,-5.384611005564114
CN(C)c1ccc(/C=N/Nc2nc(SCC(=O)NCc3ccccc3Cl)n[nH]2)cc1,C59005022_decoy,CASP3,Decoy,0,-9.09705,-6.89,-1.18,-6.286746502005681
CN(C)c1ccc(/C=N/Nc2nc(SCC(=O)NCc3ccc(Cl)cc3)n[nH]2)cc1,C59005195_decoy,CASP3,Decoy,0,-8.79965,-6.45,-2.02,-6.815154349047676
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3c(C)cccc3C)n[nH]2)cc1,C59005875_decoy,CASP3,Decoy,0,-9.2995,-6.92,-1.58,-7.840729102347509
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C(\C)c2cccnc2)n1,C59310472_decoy,CASP3,Decoy,0,-11.1169,-5.72,-1.75,-7.571799498226097
CCOC(=O)COc1ccc(/C=N/NC(=O)Cc2csc(N)n2)cc1Br,C59644625_decoy,CASP3,Decoy,0,-9.85611,-5.45,-1.83,-6.5763512861648445
Nn1c(SCC(=O)Nc2nnc(SCCCc3ccccc3)s2)nnc1C1CC1,C59912388_decoy,CASP3,Decoy,0,-9.0415,-6.79,-1.29,-6.253825045145342
CCCCN(C(=O)CN(c1ccc(F)cc1)C(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C60339100_decoy,CASP3,Decoy,0,-7.43779,-6.1,-2.8,-6.409813254617965
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CN(C)c2ccccc2F)c(=O)[nH]c1=O,C60374389_decoy,CASP3,Decoy,0,-6.07053,-6.84,-2.89,-6.420223034396229
C=CCn1c(Cc2csc(NC(=O)CC3=C(C)N(CC(C)C)N[C@H]3C)n2)n[nH]c1=S,C39792004_decoy,CASP3,Decoy,0,-9.7125,-5.93,-4.93,-6.724369156901648
O=C(CS[C@@H]1NN=C(NC2CCCCC2)S1)OCCCn1c(=O)[nH]c2ccccc21,C38636946_decoy,CASP3,Decoy,0,-9.00383,-6.99,-0.09,-6.627040899385
CC(C)c1ccccc1-n1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1cccnc1,C03347751_decoy,CASP3,Decoy,0,-8.99578,-7.21,-1.93,-8.085843170290675
CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cc(Cl)c(N)cc2OC)c1C,C04916834_decoy,CASP3,Decoy,0,-6.54803,-5.35,-1.3,-5.1692344382504185
COc1ccc2[nH]cc(CCNC(=O)C3CCN(C(=O)CNC(=O)c4ccccc4)CC3)c2c1,C08764847_decoy,CASP3,Decoy,0,-7.67658,-8.46,-1.47,-6.797167923685597
COc1ccc([C@H](CNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c2c[nH]c3ccccc23)cc1,C08899330_decoy,CASP3,Decoy,0,-8.12048,-8.73,-1.84,-10.96967226986167
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1,C09534990_decoy,CASP3,Decoy,0,-8.80432,-7.91,-1.68,-7.614439859388285
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1,C09534993_decoy,CASP3,Decoy,0,-9.94529,-6.84,-1.94,-7.859164555006243
COc1ccc(CCN2C[C@H](C(=O)Nc3sc4c(c3C(N)=O)CC[C@H](C)C4)CC2=O)cc1OC,C09751036_decoy,CASP3,Decoy,0,-8.79508,-8.43,-3.04,-7.146868731534369
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)Nc2sccc2C(N)=O)c(C)n1-c1cccc(Cl)c1,C09848793_decoy,CASP3,Decoy,0,-8.06386,-7.79,-2.18,-6.558820658078829
Cc1ccc(-c2cc(NC(=O)CNc3ccccc3C(=O)NCc3ccco3)on2)cc1,C09913864_decoy,CASP3,Decoy,0,-7.81737,-7.5,-1.49,-6.092670818372904
CCOC(=O)c1cc(C#N)c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nc1C,C11509426_decoy,CASP3,Decoy,0,-9.38114,-7.15,-1.82,-6.6825235070491305
C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)o1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C12797671_decoy,CASP3,Decoy,0,-10.8676,-6.48,-1.23,-7.99222763522283
COc1ccc(N2C[C@H](C(=O)Nc3sc(SCC(N)=O)nc3-c3ccccc3)CC2=O)cc1,C12891952_decoy,CASP3,Decoy,0,-7.70626,-7.32,-1.19,-6.857223654931139
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CNC(=O)c3ccc(C)c(C)c3)cc2)n1,C12946168_decoy,CASP3,Decoy,0,-8.33796,-7.11,-1.19,-5.943409101992066
O=C(COC(=O)CNC(=O)c1sc2ccccc2c1Cl)NNC(=O)c1ccc(Cl)cc1,C13100719_decoy,CASP3,Decoy,0,-7.16952,-7.61,-1.61,-6.217875413563245
COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2ccc(Cl)c(Cl)c2)c(=O)[nH]c1=O,C14506317_decoy,CASP3,Decoy,0,-7.66281,-5.55,-1.45,-5.654558784319349
COCCn1c(N)c(N(Cc2ccccc2)C(=O)c2cccc(C(F)(F)F)c2)c(=O)[nH]c1=O,C14506894_decoy,CASP3,Decoy,0,-7.623,-6.99,-2.16,-8.084796391896178
COCCn1c(N)c(N(Cc2ccccc2)C(=O)CC23CC4CC(CC(C4)C2)C3)c(=O)[nH]c1=O,C14506951_decoy,CASP3,Decoy,0,-7.18728,-6.6,-2.46,-6.770403362440792
C[C@@H](NC(=O)c1nn(CCO)c2c1CN(C(=O)CCc1c[nH]c3ccccc13)CC2)c1ccccc1,C14537803_decoy,CASP3,Decoy,0,-9.08403,-8.03,-2.96,-7.5060569307323455
C[C@H](NC(=O)c1nn(CCO)c2c1CN(C(=O)CCc1c[nH]c3ccccc13)CC2)c1ccccc1,C14537804_decoy,CASP3,Decoy,0,-9.68064,-6.52,-1.37,-7.306854825784801
Cc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3ccc(Cl)cc3)cc2)no1,C14833773_decoy,CASP3,Decoy,0,-7.57222,-8.0,-0.91,-6.357632276844456
CCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)nnc1-c1ccccc1OC,C16659108_decoy,CASP3,Decoy,0,-9.12754,-6.79,-1.56,-7.949526351255262
C[C@@H](SCc1nc2scc(-c3ccccc3)c2c(=O)[nH]1)C(=O)NNC(=O)OC(C)(C)C,C17398756_decoy,CASP3,Decoy,0,-9.75875,-5.97,-1.39,-6.4757257300023126
Cc1nn(Cc2cccc(C(=O)Nc3sc(C(=O)OC(C)C)c(C)c3C(N)=O)c2)c(C)c1Cl,C02747107_decoy,CASP3,Decoy,0,-9.78761,-6.69,-3.82,-7.209543995947389
CCc1nnc(SCC(=O)Nc2nnc(SCc3cccc(Br)c3)s2)n1N,C20842896_decoy,CASP3,Decoy,0,-8.92018,-5.86,-2.83,-5.644469438033869
CCOC(=O)c1cnc(SCC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)nc1N,C21402920_decoy,CASP3,Decoy,0,-7.58352,-7.88,-1.15,-6.966849140950862
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1,C26772843_decoy,CASP3,Decoy,0,-7.80266,-6.8,-4.08,-5.783797628048785
NS(=O)(=O)c1ccc(CNC(=O)c2ccn(COc3cccc(C(F)(F)F)c3)n2)cc1,C27973246_decoy,CASP3,Decoy,0,-8.56893,-6.72,-1.43,-9.055874230733384
Cc1nc(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)sc1SCC(N)=O,C31119139_decoy,CASP3,Decoy,0,-10.3311,-6.54,-1.02,-8.838139006963228
Cc1oc(-c2ccccc2)nc1CC(=O)NCCCc1nn(-c2ccc(F)cc2)c(N)c1C#N,C31795878_decoy,CASP3,Decoy,0,-6.97371,-7.36,-3.53,-6.257612197287244
CCCCS(=O)(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c1,C32926223_decoy,CASP3,Decoy,0,-8.63079,-7.06,-2.06,-8.441251610589239
Cc1cccc(C)c1NC(=O)Nc1ccc(N(C)C)c(C(=O)NCCCN2CCOCC2)c1,C16568135_decoy,CASP3,Decoy,0,-8.53117,-6.48,-1.84,-6.975564228967066
CCc1nn(-c2ccc(OC)cc2)c2sc(C(=O)NCCNC(=O)NC(C)(C)C)cc12,C35989122_decoy,CASP3,Decoy,0,-9.37593,-6.3,-2.52,-7.315155694016772
CN(C)c1ccc([C@H](C(=O)NC(C)(C)C)N(Cc2ccco2)C(=O)c2c(O)cccc2O)cc1,C36500656_decoy,CASP3,Decoy,0,-8.06357,-5.33,-1.55,-6.120598168978664
CCCCNC(=O)[C@H](c1ccc2c(c1)OCO2)N(CCC)C(=O)c1c(O)cccc1O,C36571183_decoy,CASP3,Decoy,0,-7.41613,-5.71,-3.35,-6.560077313902127
C/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)c1cccc(O)c1O)C(C)(C)C,C36587050_decoy,CASP3,Decoy,0,-7.38806,-6.69,-2.5,-7.268067359247012
CSc1ncc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1-c1ccc(F)cc1,C36849853_decoy,CASP3,Decoy,0,-9.93686,-7.72,-1.04,-9.145923551967613
NS(=O)(=O)c1ccc(NC(=O)CSc2nnc(Cc3cccs3)n2-c2ccccc2)cc1,C02865822_decoy,CASP3,Decoy,0,-10.903,-7.68,-2.82,-9.066271885908444
CC(C)OCCCNC(=O)[C@H](C)NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H]2c3ccccc3C(=O)N21,C08791599_decoy,CASP3,Decoy,0,-8.59195,-8.29,-3.23,-6.969480165942653
C=CCn1c(Cc2csc(NC(=O)C[NH+]3C(C)=C(c4csc(C)n4)C[C@@H]3C)n2)n[nH]c1=S,C38798892_decoy,CASP3,Decoy,0,-8.42665,-8.04,-3.19,-6.675737941302055
O=C([O-])CCCCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2,C39682857_decoy,CASP3,Decoy,0,-7.90879,-6.27,-1.68,-8.16247365358737
CCOc1cc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCOC)ccc1O,C38705036_decoy,CASP3,Decoy,0,-7.81617,-7.14,-3.0,-7.866216038816757
CCOc1ccc([C@H]2c3c(-c4cc(Cl)c(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1OC,C09124278_decoy,CASP3,Decoy,0,-8.36383,-6.54,-3.22,-8.29229345529947
COc1ccc(CCNc2ncnc(N3CCN(c4cccc(C)c4C)CC3)c2N)cc1OC,C54522747_decoy,CASP3,Decoy,0,-8.31356,-7.3,-3.67,-6.346331264946522
COc1ccc(S(=O)(=O)NCCCc2nn(-c3ccccc3)c(N)c2C#N)c2ccccc12,C32433603_decoy,CASP3,Decoy,0,-6.4036,-6.58,-1.21,-5.978152818146593
C/C(=N\NC(=O)CCCSc1nnc(-c2cccnc2)n1N)c1ccc2ccccc2c1,C58991219_decoy,CASP3,Decoy,0,-8.14622,-5.71,-1.67,-5.761511729613456
C/C(=N\NC(=O)CCCSc1nnc(-c2ccc(Br)cc2)n1N)c1ccccn1,C58991597_decoy,CASP3,Decoy,0,-7.75467,-8.19,-1.43,-7.484802757396577
C/C(=N/NC(=O)CCCSc1nnc(-c2ccccc2Br)n1N)c1ccccn1,C58991601_decoy,CASP3,Decoy,0,-8.09304,-6.8,-1.83,-5.767304048764617
Cc1cc(C)nc(N/C(=N/C(=S)Nc2ccccc2)NCc2ccc3c(c2)OCO3)n1,C14157768_decoy,CASP3,Decoy,0,-8.17678,-6.98,-1.17,-6.42614300701434
O=C(NCCCO)/C(=C\c1ccccc1)NC(=O)c1ccc(N2C(=O)c3ccccc3C2=O)cc1,C59730341_decoy,CASP3,Decoy,0,-6.84707,-7.28,-1.85,-6.101187494264583
Cc1ccc(NC(=O)CSc2ccccc2C(=O)NNC(=O)C2=NN=C(c3ccccc3)C2)cc1,C39943209_decoy,CASP3,Decoy,0,-6.90043,-9.37,-0.63,-7.126196251722083
COC(=O)[C@H](NC(=O)[C@@H]1[C@@H](NC(=O)Nc2cccc(SC)c2)CCN1C(=O)C=C(C)C)C(C)C,C03839223_decoy,CASP3,Decoy,0,-7.8327,-5.78,-5.52,-6.488193941776914
C=CNC(=S)n1nc(-c2ccccc2NC(=O)C(F)(F)F)c(=O)n(C(=S)NC=C)c1=S,C01617158_decoy,CASP3,Decoy,0,-9.15547,-5.32,-1.52,-6.663171296588744
C=CCN(c1ccc(Cl)cc1)S(=O)(=O)c1cccc(C(=O)O[C@@H](C)C(=O)NC(N)=O)c1,C03492211_decoy,CASP3,Decoy,0,-8.43737,-8.44,-1.75,-8.590195396053556
CC(C)Oc1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1,C09269607_decoy,CASP3,Decoy,0,-8.7906,-7.51,-0.84,-7.092191419920377
O=C(CNC(=O)C1CCC(CNS(=O)(=O)c2ccc(F)cc2)CC1)NC[C@H]1CCCO1,C09476628_decoy,CASP3,Decoy,0,-8.64958,-6.91,-2.09,-6.606423856618885
COc1ccc(OCc2nnc(S[C@@H](C)C(=O)Nc3sc4c(c3C(N)=O)CCC4)n2C)cc1,C09516799_decoy,CASP3,Decoy,0,-8.76646,-7.05,-2.98,-6.9015867016125805
CCOC(=O)c1c(C)oc(NC(=O)CSc2nc(C3CC3)nc3ccccc23)c1C(N)=O,C10947304_decoy,CASP3,Decoy,0,-8.6784,-5.95,-1.43,-7.326226870656287
C[C@@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1,C12667508_decoy,CASP3,Decoy,0,-10.343,-7.75,-2.69,-7.9880173395898435
CCOC(=O)C1=C(COC(=O)c2c(NC(C)=O)sc(C)c2C)NC(=O)N[C@@H]1c1ccccc1,C12689902_decoy,CASP3,Decoy,0,-9.90613,-7.31,-2.18,-8.496895428341503
COCCCN(C(=O)Cc1cccc(C(F)(F)F)c1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C12816363_decoy,CASP3,Decoy,0,-7.14503,-5.86,-1.39,-6.777060603602388
CCCCN(C(=O)Cn1c(C(F)(F)F)nc2ccccc21)c1c(N)n(CCC)c(=O)[nH]c1=O,C12525350_decoy,CASP3,Decoy,0,-6.35409,-5.94,-2.42,-5.176176242866972
CC(C)C(=O)NNC(=O)CSc1nnc(CNc2nc(-c3ccccc3)cs2)n1C,C13502692_decoy,CASP3,Decoy,0,-8.27858,-7.74,-2.19,-7.211496593696431
CCC(CC)CNc1cc(C(=O)N2CCC[C@@H](C(N)=O)C2)cc(S(=O)(=O)N(C)C)c1,C14538483_decoy,CASP3,Decoy,0,-8.02993,-7.22,-3.54,-7.906525561203571
COCCn1c(N)c(N(Cc2ccccc2)C(=O)/C=C/c2cc(C)ccc2OC)c(=O)[nH]c1=O,C14634657_decoy,CASP3,Decoy,0,-7.2372,-7.39,-2.28,-6.907897982475238
CCCCn1c(N)c(N(Cc2ccco2)C(=O)c2ccc(OC(F)(F)F)cc2)c(=O)[nH]c1=O,C14653441_decoy,CASP3,Decoy,0,-6.36189,-7.06,-3.7,-6.435178400469682
O=C(NCCc1c[nH]c2ccccc12)C(=O)NC[C@@H](c1ccco1)S(=O)(=O)c1ccccc1,C17190985_decoy,CASP3,Decoy,0,-8.12907,-6.95,-3.24,-6.145807915803828
Cc1ccccc1-n1ccnc1SCC(=O)N(CC(C)C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C19472443_decoy,CASP3,Decoy,0,-7.56804,-6.44,-2.23,-6.667057935299921
COCCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)ccc1OC,C21971199_decoy,CASP3,Decoy,0,-9.14946,-6.53,-2.78,-6.809851871831572
COCCn1c(N)c(N(Cc2ccccc2)C(=O)CSc2ccc(F)cc2)c(=O)[nH]c1=O,C22379284_decoy,CASP3,Decoy,0,-7.04382,-6.39,-0.94,-6.6930920960048965
NC(=O)CCn1c(SCC(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)nnc1C1CC1,C22749371_decoy,CASP3,Decoy,0,-9.44633,-5.55,-3.09,-6.197082918338528
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCCCO)N2CCN(c3ccc(F)cc3)CC2)cc1,C22856409_decoy,CASP3,Decoy,0,-9.03439,-6.06,-2.71,-7.725121445966124
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)ccc1OC,C23009373_decoy,CASP3,Decoy,0,-8.9086,-5.86,-0.81,-8.875237298440814
CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1C,C23593170_decoy,CASP3,Decoy,0,-9.89811,-6.63,-1.87,-7.208264815551831
COc1ccc(-c2nc(C(=O)OCC(=O)Nc3sccc3C(N)=O)cs2)cc1OC,C24508391_decoy,CASP3,Decoy,0,-8.82241,-7.15,-1.24,-6.090403805113641
CC(C)Cn1c(SCC(=O)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)nnc1-c1ccccc1F,C24765939_decoy,CASP3,Decoy,0,-8.36956,-6.91,-1.18,-5.472440673927941
CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N(CCC(N)=O)Cc2ccccc2)C1=O,C24770259_decoy,CASP3,Decoy,0,-10.049,-7.39,-1.56,-7.991317852695006
Cc1noc(C)c1COc1cccc(C(=O)NCCCc2nn(-c3ccc(F)cc3)c(N)c2C#N)c1,C25161194_decoy,CASP3,Decoy,0,-8.06581,-6.3,-1.54,-6.839840623126546
CCCCN1C(=O)[C@H]2[C@@H](c3ccc(OCCC)cc3)[NH2+][C@@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@@H]2C1=O,C35395927_decoy,CASP3,Decoy,0,-6.96873,-7.54,-2.8,-6.675337757399107
C=CCO[C@@H]1C[C@](OCc2cccc(C(F)(F)F)c2)(C(=O)NN2CCOCC2)C[C@@H](O)[C@H]1O,C35591919_decoy,CASP3,Decoy,0,-7.84506,-7.09,-2.74,-6.622176108855741
N#Cc1ccc(CO[C@H]2C[C@](OCc3cccc(F)c3)(C(=O)NC[C@@H]3CCCO3)C[C@@H](O)[C@H]2O)cc1,C35592645_decoy,CASP3,Decoy,0,-9.84617,-8.24,-3.26,-7.907507849974453
CC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)CNC(=O)c1ccccc1,C36504281_decoy,CASP3,Decoy,0,-7.05553,-7.03,-2.18,-6.838472031742557
CCCCn1c(N)c(N(CC(C)C)C(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)c(=O)[nH]c1=O,C14670028_decoy,CASP3,Decoy,0,-7.97072,-5.8,-0.8,-6.8187469553588205
CCOC(=O)c1c(NC(=O)CSc2nnc(Cc3csc(N)n3)n2C)sc(C)c1C,C02586450_decoy,CASP3,Decoy,0,-11.1948,-6.33,-1.9,-10.766317261326948
N#Cc1ccsc1NC(=O)COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1,C39615664_decoy,CASP3,Decoy,0,-9.82994,-6.51,-2.58,-7.61779437371357
COC(=O)[C@@H]1C2=C(CCC2)S[C@H]1NC(=O)CSc1nc(C)c(CCC(=O)O)c(=O)[nH]1,C39667863_decoy,CASP3,Decoy,0,-9.01709,-6.74,-2.43,-6.121127194052481
CCn1c(S[C@H](C)C(=O)Nc2nccs2)nnc1[C@H](CO)NC(=O)c1ccc(Cl)cc1,C39742339_decoy,CASP3,Decoy,0,-9.16937,-8.29,-3.21,-10.31710688246013
CCn1c(SCC(=O)N[C@@H](C)c2ccccc2)nnc1[C@@H](CO)NC(=O)c1cccc(C)c1,C39748749_decoy,CASP3,Decoy,0,-8.51943,-8.14,-3.45,-6.21756831448797
C=CCn1c(SCC(=O)NCc2ccc(C)cc2)nnc1[C@@H](CO)NC(=O)c1ccccc1F,C39772012_decoy,CASP3,Decoy,0,-8.54371,-7.21,-3.76,-9.960432249649402
C=CCn1c(SCC(=O)Nc2sc(C(N)=O)c(C)c2C#N)nnc1-c1cccc(N(C)C)c1,C39972657_decoy,CASP3,Decoy,0,-8.69968,-6.86,-1.0,-7.198781671941683
COc1cc(OC)cc(C(=O)N[C@@H](N/C(=N/C#N)Nc2cccnc2C)C(C)(Cl)Cl)c1,C40421892_decoy,CASP3,Decoy,0,-8.1538,-6.37,-1.01,-6.854866208731359
CCCCN(C)S(=O)(=O)c1ccc(C(=O)Nc2sccc2C(=O)NNC(C)=O)cc1,C44453297_decoy,CASP3,Decoy,0,-8.18711,-6.3,-2.6,-6.9340488649372105
NC(=O)c1c(NC(=O)COC(=O)CCc2nc(-c3cccs3)no2)sc2c1CCC2,C45494618_decoy,CASP3,Decoy,0,-9.36637,-7.69,-0.64,-7.309448526416794
NC(=O)CCc1nnc(SCC(=O)Nc2ccc(C(F)(F)F)cc2)n1C[C@@H]1CCCO1,C45898018_decoy,CASP3,Decoy,0,-9.48991,-7.14,-2.72,-6.798510419286741
CCc1noc(CN(CCC2=CCCCC2)c2c(N)n(Cc3ccccc3)c(=O)[nH]c2=O)n1,C58597277_decoy,CASP3,Decoy,0,-7.32687,-6.65,-1.52,-7.197045674166168
CCSc1nc2ccc(NC(=O)CSc3n[nH]c(N/N=C/c4cccnc4)n3)cc2s1,C59016008_decoy,CASP3,Decoy,0,-7.82453,-5.59,-3.65,-5.646358608509733
CCOC(=O)c1c(NC(=O)CCSc2nnc(-c3cccnc3)n2N)sc2c1CCCC2,C20290669_decoy,CASP3,Decoy,0,-7.84882,-7.43,-2.01,-6.440087094476228
CCOC(=O)c1c(NC(=O)CCSc2nnc(-c3ccncc3)n2N)sc2c1CCCC2,C20290886_decoy,CASP3,Decoy,0,-8.35674,-6.17,-2.19,-7.049992489886632
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)N[C@H]3CCCc4ccccc43)n[nH]2)c1C,C59831534_decoy,CASP3,Decoy,0,-8.88438,-7.08,-2.21,-6.105216094726307
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(Br)cc3C)n[nH]2)cn1,C59831836_decoy,CASP3,Decoy,0,-8.8624,-7.26,-2.11,-5.849659518044382
COc1ccc(Cn2ncc3cc(C(=O)NCCc4cccc(C(N)=O)c4)cnc32)c(OC)c1,C60366350_decoy,CASP3,Decoy,0,-8.47219,-8.25,-3.03,-6.655965964022309
Cc1ccccc1OC[C@H](O)Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C,C00626142_decoy,CASP3,Decoy,0,-7.67444,-8.42,-2.0,-7.651616559339417
CCC(O)(CC)C(=O)NN(C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1)c1ccc(C)cc1,C02217934_decoy,CASP3,Decoy,0,-6.28853,-5.99,-4.24,-5.886850294752821
O=C(CCCc1nc2ccccc2s1)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1,C02623244_decoy,CASP3,Decoy,0,-8.97968,-7.22,-2.63,-8.45566633015701
CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)Cc3cccs3)cc2)s1,C03079289_decoy,CASP3,Decoy,0,-9.5653,-7.56,-0.97,-7.007198922211218
CCn1c(COc2ccccc2C)nnc1SCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C06878320_decoy,CASP3,Decoy,0,-8.44341,-7.65,-2.33,-7.951911154739581
O=C(NNC(=S)NC[C@@H]1CCCO1)c1cc(C2CC2)nc2c1c(C1CC1)nn2-c1ccccc1,C08782502_decoy,CASP3,Decoy,0,-8.90114,-6.62,-1.14,-8.815895845305754
CC(C)OCCCn1c(SCC(=O)Nc2sccc2C(N)=O)nc2cc(Cl)ccc2c1=O,C09014411_decoy,CASP3,Decoy,0,-8.75983,-6.22,-1.66,-7.364160452705065
Cc1ccc(S(=O)(=O)NCC2CCC(C(=O)N[C@H](C)C(=O)NC[C@H]3CCCO3)CC2)cc1,C09133965_decoy,CASP3,Decoy,0,-8.08181,-7.96,-1.71,-6.748345968484002
COc1cc(/C=C/C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)ccc1OC(F)F,C09246969_decoy,CASP3,Decoy,0,-8.69667,-6.91,-1.41,-6.766945162427176
CCOC(=O)c1ccc(NC(=O)CSc2nnc(NC(=O)NC(C)(C)C)s2)cc1,C09743987_decoy,CASP3,Decoy,0,-7.39436,-5.66,-3.58,-5.875478038740441
CCOCCOc1ccc(C(=O)NC(=S)NNC(=O)COc2ccc(C)cc2C)cc1,C09821691_decoy,CASP3,Decoy,0,-8.99137,-6.23,-2.73,-6.540580391732931
CCOCCOc1ccc(C(=O)NC(=S)NNC(=O)Cn2ccc3ccccc32)cc1,C09697319_decoy,CASP3,Decoy,0,-8.68408,-7.53,-2.1,-7.61808162287995
COCC(=O)Nc1cc(C(=O)NCCc2c[nH]c3ccccc23)cc2ncn(CCc3ccccc3)c12,C12244148_decoy,CASP3,Decoy,0,-9.46343,-8.2,-4.65,-8.231451620242652
COc1ccc(C(=O)NNC(=S)NC(=O)CCCOc2ccc(Cl)cc2Cl)cc1OC,C12291909_decoy,CASP3,Decoy,0,-8.30656,-7.12,-1.34,-7.305951919754359
CCOCCCNC(=O)c1c(N)n(-c2ccc(OC)cc2OC)c2nc3ccccc3nc12,C02335255_decoy,CASP3,Decoy,0,-7.8601,-6.06,-2.74,-6.421878318344912
Cc1ccc(SCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1,C12673850_decoy,CASP3,Decoy,0,-7.61866,-6.83,-2.76,-6.194765744383949
Cc1ccc(N(C(=O)CCC(=O)Nc2ccccn2)[C@@H](C(=O)NC(C)(C)C)c2ccc(O)cc2)cc1,C13501465_decoy,CASP3,Decoy,0,-7.86664,-8.26,-4.58,-9.030922321640476
O=C(NC(=S)NNC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1)C(c1ccccc1)c1ccccc1,C13630157_decoy,CASP3,Decoy,0,-9.83399,-7.48,-1.11,-10.03327875536855
CCCOC(=O)CCC(=O)NC(=S)NNC(=O)c1ccc(OC)c(I)c1,C13997402_decoy,CASP3,Decoy,0,-7.95222,-6.21,-1.24,-6.757678736170647
Cc1cc(C)nc(N/C(=N/C(=S)NCc2ccco2)NCc2ccc3c(c2)OCO3)n1,C14157845_decoy,CASP3,Decoy,0,-8.49308,-6.69,-1.56,-6.920993837130273
CCCCn1c(N)c(N(Cc2ccco2)C(=O)COc2ccc(Cl)cc2)c(=O)[nH]c1=O,C14653320_decoy,CASP3,Decoy,0,-8.02037,-6.95,-2.17,-7.160934813762208
CCCCn1c(N)c(N(C)C(=O)/C=C/c2cc(Cl)c(OC)c(OCC)c2)c(=O)[nH]c1=O,C14654719_decoy,CASP3,Decoy,0,-6.43149,-5.14,-4.22,-4.9145869917129374
CCCCn1c(N)c(N(C)C(=O)c2cc(Cl)c(OCCC)c(OC)c2)c(=O)[nH]c1=O,C14655599_decoy,CASP3,Decoy,0,-7.74723,-5.18,-2.96,-6.094740358390875
COCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(OCC(C)C)cc2)cc1,C14657333_decoy,CASP3,Decoy,0,-8.59582,-5.5,-0.91,-7.352292238155993
CCCCc1ccc(-n2nnnc2SCC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1,C15226466_decoy,CASP3,Decoy,0,-9.85504,-7.76,-1.95,-7.578500426020153
CCN(CC)S(=O)(=O)c1cc(NCC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)ccc1C,C15335461_decoy,CASP3,Decoy,0,-7.74495,-7.55,-2.47,-6.290464411414535
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)NNC(=S)NC[C@@H]2CCCO2)c1,C15899384_decoy,CASP3,Decoy,0,-9.17174,-7.51,-2.46,-8.047772033731937
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1oc2ccccc2c1C,C17448071_decoy,CASP3,Decoy,0,-10.6369,-7.09,-4.12,-7.742898239808214
CC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)c2cccs2)c1C,C18248323_decoy,CASP3,Decoy,0,-8.69402,-7.61,-2.74,-7.8020037915261025
CCCCn1c(N)c(N(CCC)C(=O)COc2ccc(C3SCCS3)cc2)c(=O)[nH]c1=O,C19626699_decoy,CASP3,Decoy,0,-9.85088,-6.9,-2.39,-7.114425430474961
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(Cl)cc3)n[nH]2)cc1,C20905619_decoy,CASP3,Decoy,0,-9.03329,-4.94,-1.8,-6.283750823120728
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(C)c(F)c3)n[nH]2)cc1,C20905857_decoy,CASP3,Decoy,0,-9.61561,-6.98,-2.26,-7.539372418021154
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SC(C)C)s3)n[nH]2)cc1,C20908380_decoy,CASP3,Decoy,0,-8.89549,-7.29,-1.2,-6.026974552083691
CCCCCN(C(=O)c1cc2ccccc2oc1=O)c1c(N)n(CCCC)c(=O)[nH]c1=O,C21336053_decoy,CASP3,Decoy,0,-7.30904,-5.33,-3.93,-5.837163189547173
Cc1cc(C)nc(N/C(=N/C(=S)NCCCN2CCOCC2)NCCc2ccccc2)n1,C14157018_decoy,CASP3,Decoy,0,-7.95293,-5.9,-2.88,-6.741342697632124
NC(=O)c1ccsc1NC(=O)COC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1ccccc1,C22342215_decoy,CASP3,Decoy,0,-9.69437,-8.12,-1.42,-7.845589843004483
CCCc1ccc(-c2csc(NC(=O)CSc3nnc(C4CC4)n3CCC(N)=O)n2)cc1,C22749302_decoy,CASP3,Decoy,0,-7.29074,-7.24,-4.44,-6.347521824658203
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCCc2c[nH]c3ccccc23)N2CCOCC2)cc1,C22856287_decoy,CASP3,Decoy,0,-7.92463,-6.96,-1.85,-5.908273972131565
Cc1ccc(S(=O)(=O)NCC(=O)NCC(=O)NCCc2ccc(-c3csc(C)n3)s2)cc1,C24657587_decoy,CASP3,Decoy,0,-8.80581,-7.53,-2.02,-8.712213642237563
NC(=O)c1ccsc1NC(=O)CSc1nnc(COc2ccccc2Cl)n1-c1ccccc1,C25118606_decoy,CASP3,Decoy,0,-8.4125,-7.81,-2.52,-7.695132268411672
CC(=O)NCCCc1ccc(C(=O)COC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)cc1,C25495176_decoy,CASP3,Decoy,0,-8.09506,-6.36,-1.97,-6.16424030236243
CCCCn1c(N)c(N(CCC(C)C)C(=O)CCOc2cc(C)cc(C)c2)c(=O)[nH]c1=O,C28266507_decoy,CASP3,Decoy,0,-7.38165,-7.33,-1.61,-7.533384862212293
CN(C)c1ccc([C@@H](CNC(=O)COCc2nc3ccccc3c(=O)[nH]2)c2c[nH]c3ccccc23)cc1,C30894334_decoy,CASP3,Decoy,0,-7.41147,-7.55,-1.07,-6.69780234927341
CCCN(C(=O)c1ccccc1O)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1cccc(O)c1,C36567557_decoy,CASP3,Decoy,0,-7.77328,-8.43,-3.22,-7.237776727886508
Cc1ccc(CN(C(=O)CNC(=O)c2ccccc2)[C@@H](C(=O)NC2CCCCC2)c2cccc(O)c2)o1,C36600871_decoy,CASP3,Decoy,0,-8.46134,-7.32,-1.51,-7.257671953304264
Cc1ccc(CN(C(=O)[C@@H]2CCC(=O)N2)[C@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccc(O)cc2)o1,C36601056_decoy,CASP3,Decoy,0,-6.68497,-7.92,-2.76,-7.519435262796438
CCOc1cc(/C=C2\N=C(S[C@H](C)C(N)=O)N(c3ccc(OC(F)F)cc3)C2=O)ccc1O,C09031599_decoy,CASP3,Decoy,0,-9.26385,-6.43,-1.55,-6.44643375202262
CC(C)CN1C(S[C@H](C)C2=NC(=O)C3=C(c4cccs4)CSC3=N2)=NN[C@@H]1CCC(N)=O,C39729383_decoy,CASP3,Decoy,0,-12.5358,-7.3,-3.44,-7.89496652915502
O=C(CCCCCNC1=NS(=O)(=O)c2ccccc21)NCCCNc1ccc(C(F)(F)F)cn1,C46815339_decoy,CASP3,Decoy,0,-7.94484,-6.94,-1.65,-5.847448638310245
CC(=O)NCCc1ccc(C(=O)CSc2nnc(COc3cc(C)ccc3C(C)C)n2N)cc1F,C46876175_decoy,CASP3,Decoy,0,-7.86573,-8.19,-2.3,-6.732964080287609
O=C1NC(=S)N(CCC2=CCCCC2)C(=O)/C1=C/NNC(=O)c1ccncc1,C05119842_decoy,CASP3,Decoy,0,-7.43893,-7.45,-2.23,-6.556438958251343
NC(=O)c1ccc(NC(=O)CSc2nnnn2-c2ccc(Cl)cc2)cc1,C03493349_decoy,CASP3,Decoy,0,-8.35466,-6.07,-0.7,-6.385652583002993
Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccco2)c1C,C08238406_decoy,CASP3,Decoy,0,-7.27486,-7.42,-1.48,-6.733249324827332
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2nc3c(s2)C[C@@H](C)CC3)cc1,C10022924_decoy,CASP3,Decoy,0,-10.3347,-7.36,-1.53,-8.922841509843835
Cc1ccc(C)c(NC(=S)NNC(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)c1,C11777511_decoy,CASP3,Decoy,0,-6.87455,-7.09,-2.65,-6.015994776436888
COC[C@@H](C)N1C(=S)N[C@@H](c2ccccc2F)[C@@H](C(=O)Nc2cc(C)on2)[C@@]1(C)O,C12949156_decoy,CASP3,Decoy,0,-8.51243,-5.84,-1.04,-7.336920682358718
C[C@H](Sc1nnc(-c2cccs2)o1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C14231082_decoy,CASP3,Decoy,0,-10.1565,-6.58,-0.42,-7.413976997120752
C[C@@H](NC(=O)CCNC(=O)NC1CCCCC1)c1ccc(-n2cncn2)cc1,C14848666_decoy,CASP3,Decoy,0,-6.7399,-7.01,-0.74,-7.6066007669596285
Cc1ccccc1-n1c(C)nnc1S[C@@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1,C17105482_decoy,CASP3,Decoy,0,-8.8861,-8.13,-1.94,-7.207102490964431
CC(=O)Nc1sc2c(c1C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)(C)C)CCCC2,C21602476_decoy,CASP3,Decoy,0,-7.62501,-6.5,-2.73,-6.036193128693243
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)CNC(=O)c2ccc(C)s2)C1=O,C24641582_decoy,CASP3,Decoy,0,-7.26491,-7.06,-2.31,-6.396161727938004
Cn1cc(/C=C/C(=O)NNC(=S)Nc2cccc(Cl)c2)c(=O)n(C)c1=O,C26858215_decoy,CASP3,Decoy,0,-5.71794,-6.22,-1.4,-5.926460441836029
CN(CC(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1)C(=O)c1cccs1,C28872850_decoy,CASP3,Decoy,0,-7.20104,-6.78,-0.89,-5.976040858966572
CC[C@](C)(CNC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1)N1CCOCC1,C31924833_decoy,CASP3,Decoy,0,-7.75739,-6.36,-1.95,-6.085910954976032
CCn1c(=O)[nH]c(=O)c2c(C(=O)NCCc3c[nH]c4ccccc34)cc(C3CC3)nc21,C32059937_decoy,CASP3,Decoy,0,-7.27373,-6.51,-0.8,-7.722589023135898
CCOC(=O)[C@H]1[C@H](c2ccc(N3CCOCC3)cc2)NC(=O)N[C@]1(O)C(F)(F)F,C35023422_decoy,CASP3,Decoy,0,-8.09357,-6.8,-1.57,-6.258905377647375
Cc1ccc(CC(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cn1,C40150780_decoy,CASP3,Decoy,0,-7.47584,-5.69,-2.0,-6.35665878593409
COC(=O)c1c(NC(=O)[C@H](C)n2c(N)nnc2SC)sc2c1CCCC2,C40172184_decoy,CASP3,Decoy,0,-7.76578,-6.52,-2.3,-5.897712758378711
COC[C@@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(O)cc1)CCC2,C40811989_decoy,CASP3,Decoy,0,-8.64587,-5.88,-2.33,-6.143789319464545
Cc1cc(C)n2nc(S[C@@H](C(=O)Nc3ccc(C(N)=O)cc3)C(C)C)nc2n1,C42858155_decoy,CASP3,Decoy,0,-7.81666,-5.93,-0.81,-6.046095589499722
Cc1ccccc1-n1cnnc1S[C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1,C07188533_decoy,CASP3,Decoy,0,-9.46832,-6.81,-3.18,-7.797932041118268
C[C@H](CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)N(C)c1ccccc1,C46339836_decoy,CASP3,Decoy,0,-7.386,-7.12,-1.45,-6.432452308955347
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)C1=O,C46577714_decoy,CASP3,Decoy,0,-8.20885,-7.57,-2.11,-6.523336044451046
CC[C@H](C)NC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1,C48574761_decoy,CASP3,Decoy,0,-7.47248,-5.64,-0.87,-5.452127496874715
CCOC(=O)c1c(NC(=O)c2cn3ccc(C)cc3n2)sc(C(N)=O)c1C,C49750020_decoy,CASP3,Decoy,0,-10.2002,-6.67,-2.23,-8.192087855710922
C#CCNC(=O)CCNC(=O)N1CCc2[nH]c3ccc(C(=O)OC)cc3c2C1,C50136424_decoy,CASP3,Decoy,0,-6.66277,-6.61,-0.95,-5.920435201130399
CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@H](c2ccncc2)n2nc(CCCO)nc2N1,C01890423_decoy,CASP3,Decoy,0,-8.44301,-6.25,-2.2,-7.062414213789534
Cc1cccc(C(=O)NCCNC(=O)Nc2nnc(-c3ccccn3)s2)c1,C56633286_decoy,CASP3,Decoy,0,-7.94006,-8.18,-0.98,-6.962254051798954
CC(C)NC(=O)CCNC(=O)N1CCC(C(=O)Nc2ccc(Cl)cn2)CC1,C56833202_decoy,CASP3,Decoy,0,-7.86164,-7.64,-1.14,-6.700377053095131
NS(=O)(=O)CCNC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1,C56862699_decoy,CASP3,Decoy,0,-10.3176,-7.9,-0.8,-9.0257158476896
CCc1sc(C(=O)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1C,C12676380_decoy,CASP3,Decoy,0,-7.66935,-7.66,-0.63,-6.292023913169486
CC(=O)Nc1ccc(C)c(NC(=O)NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c1,C57562023_decoy,CASP3,Decoy,0,-8.42022,-6.27,-1.52,-6.061550063085503
CCCCn1c(N)c(N(CC)C(=O)C2=Cc3ccccc3OC2)c(=O)[nH]c1=O,C57884685_decoy,CASP3,Decoy,0,-6.66558,-6.72,-0.97,-5.996992530078591
CCNC(=O)c1ccc(NC(=O)C(=O)NCCc2c(C)nn(C)c2C)c(C)c1,C57947792_decoy,CASP3,Decoy,0,-6.5636,-6.85,-0.51,-5.696870286190243
O=C(CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)NCc1ccco1,C44243382_decoy,CASP3,Decoy,0,-7.65845,-6.24,-1.67,-5.539964863836754
CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O,C60164728_decoy,CASP3,Decoy,0,-7.17992,-6.67,-1.0,-7.653826425651311
CC[C@@H](C)NC(=O)[C@H](C)NC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O,C60164733_decoy,CASP3,Decoy,0,-6.63241,-6.93,-1.79,-6.492459564090919
CNC(=O)NC(C)(C)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccncc1,C61606611_decoy,CASP3,Decoy,0,-6.43771,-6.31,-1.49,-5.691160218111089
Cc1cc(O)c2c(c1)OC(=O)[C@@H](CC(=O)N[C@@H](CC1=c3ccccc3=[NH+]C1)C(=O)[O-])[C@@H]2C,C63362752_decoy,CASP3,Decoy,0,-8.97496,-8.64,-0.45,-7.733924508457162
CCOC(=O)[C@H]1C(C)=C(C)S[C@@H]1NC(=O)CSC1=NC(=O)CC(N)=N1,C63540905_decoy,CASP3,Decoy,0,-7.95978,-5.16,-2.44,-6.647040989155116
O=C(CCC1=N[C@@H](NC(=O)c2ccc[nH]c2=O)SC1)Nc1nc2ccccc2s1,C64409242_decoy,CASP3,Decoy,0,-8.2929,-7.45,-2.23,-6.388350595379273
Cc1cc(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)n(CCC#N)n1,C65772244_decoy,CASP3,Decoy,0,-7.34572,-6.25,-1.14,-8.009914245913881
Cc1cc(NC(=O)NCCNc2ncc(Cl)cc2Cl)n(CCC#N)n1,C65798243_decoy,CASP3,Decoy,0,-7.94828,-7.15,-3.19,-6.88323112446108
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)NC2CCCC2)c1C,C65919861_decoy,CASP3,Decoy,0,-7.93196,-6.81,-2.62,-6.503523538606633
NC(=O)CC[C@H]1CCCN(C(=O)C(=O)Nc2nnc(-c3ccccc3)s2)C1,C66222008_decoy,CASP3,Decoy,0,-8.96492,-7.6,-0.82,-7.244097272213074
COc1ccc([C@H](C)NC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc1OC,C66240467_decoy,CASP3,Decoy,0,-8.06434,-7.98,-2.32,-6.024308404350541
N#Cc1c(CCCNC(=O)c2ccnc(C3CC3)n2)nn(-c2ccccc2)c1N,C66374359_decoy,CASP3,Decoy,0,-7.62183,-6.43,-1.19,-7.181566225093708
CC(C)NC(=O)NC(=O)[C@H](C)N1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1,C66566680_decoy,CASP3,Decoy,0,-7.48661,-7.25,-1.52,-6.284033979944491
O=C(Cc1ccccc1F)NNC(=O)NCc1cccc(Cn2cncn2)c1,C66909110_decoy,CASP3,Decoy,0,-6.47764,-6.58,-0.99,-7.442584490142573
C[C@H](NC(=O)NCCCc1nnc2n1CCCCC2)c1nc2ccccc2[nH]1,C67410741_decoy,CASP3,Decoy,0,-8.30713,-6.66,-3.08,-5.918894625238015
COCC(=O)N(CC(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2)C1CCCCC1,C04881703_decoy,CASP3,Decoy,0,-9.53559,-7.01,-1.54,-8.6474220687596
CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2sccc2C(N)=O)ccc1C,C03352130_decoy,CASP3,Decoy,0,-8.95912,-7.62,-2.35,-7.507681859730061
C[C@H](Sc1nnc(C2CC2)n1Cc1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1,C06532048_decoy,CASP3,Decoy,0,-8.66484,-7.69,-0.4,-7.423657482551307
CCCCN(C(=O)CSc1ccc(F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C07624399_decoy,CASP3,Decoy,0,-7.84325,-6.48,-1.3,-7.362141029459813
Cc1cccc(N2CCN(C(=O)[C@@H](CCC(N)=O)NC(=O)c3ccc(Cl)cc3)CC2)c1,C08746103_decoy,CASP3,Decoy,0,-10.797,-6.08,-1.84,-7.946696911185618
Cc1cccc(-n2ccnc2SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1,C08862456_decoy,CASP3,Decoy,0,-8.91594,-7.68,-2.73,-10.06461821946928
Cn1c(Cc2cccs2)nnc1SCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C08898392_decoy,CASP3,Decoy,0,-9.5785,-6.86,-1.3,-6.778232734646143
COc1ccc(-n2c(SCC(=O)Nc3sccc3C(N)=O)nc3ccccc32)cc1,C09441505_decoy,CASP3,Decoy,0,-9.05425,-7.32,-1.89,-6.812232483958868
CCOC(=O)N1CCc2c(sc(NC(=O)CCSc3ccccc3)c2C(N)=O)C1,C09638970_decoy,CASP3,Decoy,0,-9.39332,-6.05,-2.38,-5.925096121861064
COc1cc(C(=O)NCCCn2ccc3ccccc32)cc(Cl)c1OCC(N)=O,C10469981_decoy,CASP3,Decoy,0,-7.6368,-6.48,-1.33,-7.562417274682325
O=C(NNC(=S)NCCc1cccs1)c1cccc(N2CCCS2(=O)=O)c1,C11523914_decoy,CASP3,Decoy,0,-8.83935,-6.74,-1.12,-7.071500361105048
Cc1c(C(=O)N(C)C[C@@H](O)CO)sc2ncnc(NCc3cc4ccccc4s3)c12,C12159904_decoy,CASP3,Decoy,0,-11.0924,-7.17,-2.76,-7.240406832862215
C[C@@H](NC(=S)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCO3)c1ccccc1,C06283202_decoy,CASP3,Decoy,0,-7.51901,-5.99,-1.13,-6.070670703292638
Cc1ccccc1C(=O)NCCC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C,C12690089_decoy,CASP3,Decoy,0,-9.20682,-6.18,-2.26,-7.1618035692630855
C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1sccc1C(N)=O,C12801548_decoy,CASP3,Decoy,0,-9.19423,-7.48,-1.75,-7.221513891057318
CCn1c(SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)nc2ccccc21,C04289438_decoy,CASP3,Decoy,0,-8.97285,-6.42,-2.23,-6.702564491733559
COc1ccc2cc(/C=C(\NC(=O)c3ccccc3)C(=O)NCCO)c(Cl)nc2c1,C13576335_decoy,CASP3,Decoy,0,-8.93184,-6.15,-1.09,-6.173554800815941
COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1OC,C13977313_decoy,CASP3,Decoy,0,-6.72569,-7.23,-1.04,-5.877778145600808
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)c2ccc(C)s2)c(=O)[nH]c1=O,C14625301_decoy,CASP3,Decoy,0,-6.07083,-6.53,-0.66,-5.240134109983754
Cc1cc(=O)c(C(=O)NNC(=S)NCc2ccccc2)nn1-c1ccc(Cl)cc1,C15429123_decoy,CASP3,Decoy,0,-6.67574,-7.63,-0.97,-6.27052847045689
CC(=O)NCc1ccc(C(=O)N/C(=N/c2ccc(C)c(C)c2)NC[C@H]2CCCO2)cc1,C15828130_decoy,CASP3,Decoy,0,-8.90549,-6.12,-3.3,-6.700581677054212
COC(=O)c1c(NC(=S)NNC(=O)c2ccc(Br)o2)sc(C)c1C,C17097812_decoy,CASP3,Decoy,0,-7.2164,-5.8,-4.12,-5.436353349881562
CCCn1c(CCC(=O)N[C@H](C)c2cccs2)nc2cc(S(N)(=O)=O)ccc21,C17842383_decoy,CASP3,Decoy,0,-10.9772,-8.52,-3.25,-12.773102324651926
Cc1cc(Br)ccc1NC(=O)CNC(=O)CCNC(=O)OC(C)(C)C,C17958837_decoy,CASP3,Decoy,0,-8.38053,-5.5,-3.54,-5.753637853220546
CCOCCCNC(=O)[C@@]1(O)c2cc(Br)ccc2NC(=O)N1c1ccccc1,C09836209_decoy,CASP3,Decoy,0,-7.16408,-6.17,-1.27,-6.421043396783207
Cc1ccc(CCNC(=O)CN(C)S(=O)(=O)c2cc(Br)cnc2N)cc1,C20484304_decoy,CASP3,Decoy,0,-7.25543,-5.37,-3.72,-5.871451635468794
Cc1cccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)Nc3sccc3C(N)=O)c2C)c1,C21602492_decoy,CASP3,Decoy,0,-7.94516,-7.45,-1.55,-6.968999529603108
NC(=O)c1ccccc1NC(=O)CN(c1ccccc1F)S(=O)(=O)c1cccs1,C22400531_decoy,CASP3,Decoy,0,-9.21581,-7.2,-1.65,-7.569628156955187
CCCn1c(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)nc2ccccc2c1=O,C28471466_decoy,CASP3,Decoy,0,-7.34049,-7.58,-1.21,-8.831639283957099
C[C@H](Sc1nc(C(C)(C)C)n[nH]1)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F,C28855209_decoy,CASP3,Decoy,0,-7.76769,-5.95,-1.21,-6.274045194287964
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)s1,C17159107_decoy,CASP3,Decoy,0,-8.98621,-5.64,-1.51,-5.764256198179443
CSCC[C@@H](NC(=O)CCc1c(C)[nH]c(=O)c(C#N)c1C)c1nc2ccccc2[nH]1,C32739212_decoy,CASP3,Decoy,0,-7.51861,-5.8,-2.12,-6.545052563549428
CCCCNC(=O)[C@@H](c1ccccc1O)N(C(=O)[C@@H]1CCC(=O)N1)C1CCCCC1,C36490722_decoy,CASP3,Decoy,0,-7.5491,-6.12,-2.41,-7.371697053346604
COC(=O)/C(=C\Nc1cc(-c2ccc(OC)cc2)sc1C(N)=O)C(=O)C(F)(F)F,C04284909_decoy,CASP3,Decoy,0,-7.77052,-7.37,-0.93,-6.868074085925585
CC(C)CN(C(=O)CC12CC3CC(CC(C3)C1)C2)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C36799711_decoy,CASP3,Decoy,0,-7.47622,-6.93,-2.07,-8.766790982353205
COCCNC(=O)[C@@H](C)NC(=O)c1csc(Nc2cccc(C(F)(F)F)c2)n1,C37426396_decoy,CASP3,Decoy,0,-7.92711,-6.39,-1.48,-7.3334254675472605
CCC(CC)[C@H]1NN=C(NC(=O)[C@H]2CC(=O)N(CCc3c[nH]c4ccc(F)cc34)C2)S1,C39252293_decoy,CASP3,Decoy,0,-8.47642,-7.47,-1.14,-7.506618109585213
CCCc1cc2c(c(=O)n1CCO)[C@H](c1ccc(Cl)cc1)C(C(=O)OC)=C(N)O2,C40568792_decoy,CASP3,Decoy,0,-7.90974,-5.24,-0.84,-6.724641319347402
C[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)N[C@H]1CCCC[C@@H]1C,C45512173_decoy,CASP3,Decoy,0,-9.24838,-7.74,-0.4,-8.237576256273066
Cc1ccc(-n2nc(C)c(CC(=O)NCCNC(=O)c3ccc(O)cc3)c2C)cc1Cl,C48289577_decoy,CASP3,Decoy,0,-9.27203,-8.5,-3.76,-8.47789126555846
Cc1cccc(N2CCN([C@H](C)C(=O)NCCc3ccc(S(N)(=O)=O)cc3)CC2)c1C,C14915711_decoy,CASP3,Decoy,0,-6.9082,-7.76,-2.3,-6.199088279739876
COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NCc2cccc(C(N)=O)c2)c1,C25332906_decoy,CASP3,Decoy,0,-8.58016,-7.48,-1.57,-10.237674552320126
N#Cc1c(CCCNS(=O)(=O)c2ccc(F)c(Cl)c2)nn(-c2ccccc2)c1N,C31584336_decoy,CASP3,Decoy,0,-7.85546,-6.09,-1.75,-6.435743049158389
Cc1ccc(S(=O)(=O)NCCCc2nn(-c3ccc(F)cc3)c(N)c2C#N)cc1,C47926548_decoy,CASP3,Decoy,0,-7.41453,-5.86,-4.79,-6.906158610856076
Cc1ccc(F)cc1S(=O)(=O)NCCCc1nn(-c2ccccc2)c(N)c1C#N,C32433606_decoy,CASP3,Decoy,0,-7.13633,-8.04,-0.9,-6.292268795162365
Nn1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nnc1-c1cccnc1,C08283200_decoy,CASP3,Decoy,0,-7.68948,-6.34,-1.67,-5.911218276679188
CCOC(=O)c1c(NC(=O)CCSc2nnc(N)s2)sc2c1CCCC2,C20290707_decoy,CASP3,Decoy,0,-8.99027,-5.86,-2.89,-7.6895598735074016
CCC(CC)C(=O)N1CCC(NC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)CC1,C59849347_decoy,CASP3,Decoy,0,-7.56181,-7.57,-1.39,-6.643354093754531
CNc1ccc(S(=O)(=O)NC)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1,C60341715_decoy,CASP3,Decoy,0,-7.37642,-7.38,-2.68,-7.032744408254413
O=C(CCCNC(=O)N1CC(O)=Nc2ccccc21)NCCc1ccc(Cl)cc1,C13624001_decoy,CASP3,Decoy,0,-6.27096,-7.67,-1.69,-5.2925908898838605
COCCNC(=O)[C@@H](C)[C@H]1CC[C@@]2(C)Cc3sc(NC(=O)C4CC4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840770_decoy,CASP3,Decoy,0,-9.03221,-5.83,-1.29,-6.971866903034186
Cc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1,C03488113_decoy,CASP3,Decoy,0,-8.0429,-6.62,-2.08,-5.871423684607498
CC[C@H](C)[C@@H]([NH2+]Cc1c2occ(Oc3ccc(F)cc3)c(O)c-2ccc1=O)C(=O)[O-],C05909004_decoy,CASP3,Decoy,0,-7.45639,-7.72,-0.16,-7.531570417905881
CCOc1ccccc1/C=C/C(=O)OCC(=O)Nc1sc2c(c1C(N)=O)CCC2,C06009620_decoy,CASP3,Decoy,0,-8.0227,-6.1,-1.1,-6.232396087476408
CCOC(=O)[C@@H]1[C@H](c2ccc(OCC)c(OC)c2)NC(=S)N[C@@]1(O)C(F)(F)F,C06148035_decoy,CASP3,Decoy,0,-7.5028,-5.54,-3.78,-6.3710950156570405
CC[C@H](C)n1c(SCC(=O)Nc2sccc2C(N)=O)nc2ccccc2c1=O,C06542033_decoy,CASP3,Decoy,0,-6.62193,-7.75,-3.32,-7.345526020983946
COc1cc(CC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc(OC)c1OC,C02640124_decoy,CASP3,Decoy,0,-7.45475,-6.89,-1.95,-6.411014412581138
CCCCn1c(N)c(N(CC)C(=O)CSc2ccc(Cl)cc2)c(=O)[nH]c1=O,C07889523_decoy,CASP3,Decoy,0,-6.95858,-6.57,-1.66,-6.493303926967109
Cc1cccc(N2CCN(C(=O)[C@H](CCC(N)=O)NC(=O)c3ccc(Cl)cc3)CC2)c1,C08746104_decoy,CASP3,Decoy,0,-10.5323,-8.37,-1.56,-9.569083653588514
CC[C@H](C)Nc1nnc(SCC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)s1,C09218808_decoy,CASP3,Decoy,0,-7.77215,-6.75,-1.58,-8.28739355859301
CCOC(=O)N1CCc2c(sc(NC(=O)c3ccccc3SCC)c2C(N)=O)C1,C09346891_decoy,CASP3,Decoy,0,-8.98088,-6.35,-2.06,-7.139764322103443
CCOC(=O)N1CCc2c(sc(NC(=O)c3cccc(SC(C)C)c3)c2C(N)=O)C1,C09619401_decoy,CASP3,Decoy,0,-9.06856,-6.56,-1.91,-5.818360111654997
Nn1c(SCC(=O)N[C@@H]2CCCc3ccccc32)nnc1-c1ccc(OC(F)F)cc1,C03315423_decoy,CASP3,Decoy,0,-6.30502,-6.66,-1.26,-5.317453940080903
CCc1ccc(Cl)c(CC)c1NC(=O)COC(=O)c1sccc1S(N)(=O)=O,C10938256_decoy,CASP3,Decoy,0,-9.14422,-6.7,-1.61,-7.59580170410312
O=C(CNC(=O)c1ccc(F)cc1F)NNC(=O)Cc1csc(-c2ccc(F)cc2)n1,C11668294_decoy,CASP3,Decoy,0,-7.09783,-8.76,-0.96,-6.706507443769767
CC(=O)NCc1ccc(-c2csc(NC(=O)CCCc3c[nH]c4ccccc34)n2)o1,C12052016_decoy,CASP3,Decoy,0,-7.86433,-6.5,-2.32,-5.621661578469721
Cc1c(C(=O)N(C)C[C@H](O)CO)sc2ncnc(NCc3cc4ccccc4s3)c12,C12159911_decoy,CASP3,Decoy,0,-10.2778,-6.42,-2.32,-7.426416234875605
O=C(CNC(=O)c1ccc2nc(-n3cccc3)sc2c1)NC[C@H](O)c1ccccc1,C12389380_decoy,CASP3,Decoy,0,-7.93091,-7.12,-1.8,-9.160736521281574
C[C@H](NC(=S)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCO3)c1ccccc1,C06283094_decoy,CASP3,Decoy,0,-9.23773,-6.49,-1.31,-7.3998464998953635
COc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(OC)c(Br)c2)cc1,C12570367_decoy,CASP3,Decoy,0,-7.30423,-6.54,-1.5,-6.090910284839177
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)Nc1ccccc1SCC(N)=O,C12993539_decoy,CASP3,Decoy,0,-9.84106,-7.79,-2.44,-7.075039721827134
Cc1nc(-c2ccsc2)sc1C(=O)O[C@@H](C)C(=O)Nc1sccc1C(N)=O,C12998406_decoy,CASP3,Decoy,0,-10.5233,-6.96,-3.19,-9.793356303069263
CCn1cc(/C=C(\NC(=O)c2ccc(OC)cc2)C(=O)NCCCO)c2ccccc21,C04919196_decoy,CASP3,Decoy,0,-8.19794,-6.27,-3.01,-7.410980292725594
CNS(=O)(=O)Cc1ccc(CNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)cc1,C09735179_decoy,CASP3,Decoy,0,-8.07899,-7.51,-2.4,-7.023008418866308
O=C(COc1ccc(Br)cc1Cl)NNC(=S)NC(=O)c1ccco1,C13979215_decoy,CASP3,Decoy,0,-7.96752,-6.91,-0.92,-6.70960277850072
CCn1c(C)nc2cc(C(=O)NNC(=S)NCCc3ccc(OC)cc3)ccc21,C16211736_decoy,CASP3,Decoy,0,-7.8402,-6.46,-2.08,-5.429547410633621
CC(C)CN(C(=O)CSc1ccc(F)cc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C16657447_decoy,CASP3,Decoy,0,-7.51363,-5.64,-2.73,-6.577824308104397
C/C(=N\Nc1nc(SCC(=O)N[C@@H]2CCCc3ccccc32)n[nH]1)c1cccs1,C20835860_decoy,CASP3,Decoy,0,-9.76471,-7.7,-2.13,-6.8193785601261165
CCSc1nn(CC(=O)Nc2c(C)cccc2C)c(N)c1S(=O)(=O)c1ccccc1,C21910995_decoy,CASP3,Decoy,0,-7.86653,-7.64,-2.77,-8.666039045868924
COC(=O)c1c(NC(=O)CSc2nc(C)c(CC(N)=O)s2)sc2c1CCCC2,C24901454_decoy,CASP3,Decoy,0,-10.3033,-6.42,-1.27,-6.748620603072236
C[C@@H](Sc1nnc(SCC(N)=O)s1)C(=O)/C(C#N)=C1\Nc2ccccc2S1,C26109210_decoy,CASP3,Decoy,0,-10.4637,-5.46,-3.71,-7.8234459825776606
Nc1ccc(-c2ccc(OC[C@@](O)(Cn3cncn3)c3ccc(F)cc3F)cc2)cn1,C29046931_decoy,CASP3,Decoy,0,-8.15803,-6.98,-3.39,-6.377286286632715
Cc1cccc(-c2nnc(SCC(=O)Nc3ccc(F)cc3F)n2CC(N)=O)c1,C32741923_decoy,CASP3,Decoy,0,-8.0645,-6.14,-1.31,-6.523652319583105
C=C1[C@@H]2C[NH+](CCO[P@@](=O)([O-])OC[C@H](O)CO)C[C@H]3[C@@H]2[C@@H](C(C)C)CC[C@@]13C,C35457387_decoy,CASP3,Decoy,0,-7.99359,-5.49,-1.65,-6.106502586589401
CC(C)C(=O)Nc1ccc2c([C@H](C(=O)[O-])[NH+]3CCN(Cc4cccs4)CC3)c[nH]c2c1,C36360670_decoy,CASP3,Decoy,0,-8.18671,-0.2,-1.07,-3.405750950949676
Nn1c(SCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)nnc1C(F)(F)F,C36799248_decoy,CASP3,Decoy,0,-5.68018,-6.35,-6.36,-5.77756459460606
NC(=O)CSc1nnc(SCc2nc3scc(-c4ccccc4)c3c(=O)[nH]2)s1,C24980366_decoy,CASP3,Decoy,0,-9.0544,-7.44,-3.44,-6.122876574771824
Nc1cc(-c2ccc(Cl)cc2)nn1-c1ccc(C(=O)NCCCN2CCOCC2)cc1,C38736520_decoy,CASP3,Decoy,0,-8.43797,-6.94,-0.98,-6.5783002247635
CS[C@@H]1NN[C@H](CCNC(=O)[C@@H]2C=C(c3ccccc3)N=N2)N1c1ccc(F)cc1,C39353582_decoy,CASP3,Decoy,0,-7.82074,-5.42,-1.16,-6.464259981498854
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCC2CCC(C(=O)[O-])CC2)C2(CC[NH2+]CC2)C1,C39662819_decoy,CASP3,Decoy,0,-9.07805,-5.98,-1.48,-6.140837022165805
O=C(CCCc1c(-c2ccccn2)[nH]c2ccc(Cl)cc12)NNC(=O)c1ccncc1,C39852762_decoy,CASP3,Decoy,0,-8.43864,-8.3,-0.76,-8.127493491581166
O=C(CSc1ncn[nH]1)N[C@H]1S[C@H]2CCCC[C@@H]2[C@H]1C(=O)NCc1ccccc1,C39940658_decoy,CASP3,Decoy,0,-7.43397,-6.69,-0.52,-6.882612630651896
CCCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H](O)[C@H]2CC(=O)N2CCCC2)[C@]1(C)CO,C43553858_decoy,CASP3,Decoy,0,-8.85732,-6.08,-1.96,-8.23575367682776
S=C(Nc1ccccc1)N[C@H]1CO[C@H]2[C@@H]1OC[C@@H]2Nc1nccc(C2CCCC2)n1,C05398850_decoy,CASP3,Decoy,0,-6.8832,-8.51,-1.47,-5.69082594558714
NC(=O)c1ccc(OCC(=O)Nc2ccnn2Cc2ccc(Cl)cc2Cl)cc1,C59408349_decoy,CASP3,Decoy,0,-8.73118,-6.89,-2.36,-7.06496912204325
C#CCOc1cc(Br)c(/C=N/NC(=O)Cc2csc(N)n2)cc1OC,C59645090_decoy,CASP3,Decoy,0,-9.06379,-5.46,-2.97,-6.180747972186473
CCOc1cc(/C=N/NC(=O)Cc2csc(N)n2)c(Br)cc1OC,C59645377_decoy,CASP3,Decoy,0,-9.99194,-5.08,-3.21,-6.682265237399027
COc1cc(CC(=O)Nc2sc3c(c2C(N)=O)CCCCC3)cc(OC)c1OC,C60389880_decoy,CASP3,Decoy,0,-8.66794,-6.37,-1.2,-7.545937192725096
CCCN1C(C)=C(c2csc(NC(=O)CCc3c(C)[nH]c(=S)[nH]c3=O)n2)C[C@@H]1C,C39929947_decoy,CASP3,Decoy,0,-8.34809,-6.91,-1.55,-5.667141638784823
COc1cccc2c(=O)cc(CS[C@@H]3NN[C@@H](COc4cccc(C)c4)N3C)[nH]c12,C63686666_decoy,CASP3,Decoy,0,-8.63757,-7.4,-1.55,-6.489672640673514
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1OC,C03408867_decoy,CASP3,Decoy,0,-7.70515,-8.8,-0.81,-7.394944748586819
COc1cc(NS(=O)(=O)c2ccc(NC(=O)/C=C/C(=O)[O-])cc2)nc(OC)n1,C04244705_decoy,CASP3,Decoy,0,-6.28723,-5.91,-0.99,-7.445397403358437
COc1ccc(C(=O)NCC(=O)NCc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-],C06881970_decoy,CASP3,Decoy,0,-5.44477,-7.22,-1.01,-5.792591769837581
[H]/N=C(\N/N=C/c1cccc([N+](=O)[O-])c1)S[C@H]1CC(=O)N(c2ccc(C(=O)[O-])cc2)C1=O,C08815606_decoy,CASP3,Decoy,0,-6.87192,-6.0,-1.48,-4.891179876716329
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)[O-])C3=O)c(NCCO)nc12,C02992775_decoy,CASP3,Decoy,0,-7.02002,-5.96,-1.54,-5.868877389507301
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NCc3ccco3)n2CC(=O)[O-])cc1,C13020703_decoy,CASP3,Decoy,0,-6.48176,-6.38,-3.68,-4.952379748159073
Cc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccco3)n2CC(=O)[O-])cc1,C13033384_decoy,CASP3,Decoy,0,-6.97353,-7.4,-1.33,-12.13117510948825
CCOC(=O)N1CCC(Nc2ccc(C(=O)N[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])CC1,C13037324_decoy,CASP3,Decoy,0,-6.33298,-6.71,-1.26,-9.709345540512462
Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13045499_decoy,CASP3,Decoy,0,-7.47259,-8.21,-1.87,-6.742302010411605
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)Nc1ccc(F)cc1[N+](=O)[O-],C13045510_decoy,CASP3,Decoy,0,-6.7665,-7.17,-1.38,-6.298115021355626
C[C@H](Sc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)C(=O)NCc1ccc2c(c1)OCO2,C13045677_decoy,CASP3,Decoy,0,-7.0648,-6.78,-1.16,-6.798485414568962
C[C@H](O)Cn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nc2cc(C(=O)[O-])ccc2c1=O,C13051354_decoy,CASP3,Decoy,0,-7.85296,-6.35,-2.12,-6.492765081646279
C[C@H](O)Cn1c(SCC(=O)Nc2ccc(F)cc2[N+](=O)[O-])nc2cc(C(=O)[O-])ccc2c1=O,C13051456_decoy,CASP3,Decoy,0,-7.35155,-6.84,-1.15,-5.990625659180956
C[C@H](Sc1nc2ccccc2c(=O)n1CCC(=O)[O-])C(=O)NC(=O)NCc1ccco1,C13055226_decoy,CASP3,Decoy,0,-7.11924,-8.02,-2.71,-7.504938516049342
CNC(=O)CN(C)c1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])cc1[N+](=O)[O-],C13211585_decoy,CASP3,Decoy,0,-6.68859,-7.18,-2.73,-5.019764534206453
N#CCCNc1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])cc1[N+](=O)[O-],C13211834_decoy,CASP3,Decoy,0,-5.40107,-6.83,-2.56,-5.998110668227104
Cc1cc(C)c(NC(=O)CNC(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)c(C)c1,C13222285_decoy,CASP3,Decoy,0,-6.72463,-7.28,-2.77,-6.590145148008
Cc1ccccc1OC[C@H](O)Cn1c(SCC(=O)[O-])nc2c1c(=O)[nH]c(=O)n2C,C13232319_decoy,CASP3,Decoy,0,-8.27716,-6.45,-1.61,-6.168042313330824
Cn1c(SCC(=O)N(CCC(N)=O)c2ccccc2Cl)nc2cc(C(=O)[O-])ccc2c1=O,C13244740_decoy,CASP3,Decoy,0,-7.59129,-7.43,-1.97,-7.791147667830273
Cc1ccc(-c2nnc(SCc3ccc(C(N)=O)cc3[N+](=O)[O-])n2CC(=O)[O-])cc1,C13246005_decoy,CASP3,Decoy,0,-5.0565,-5.9,-1.06,-4.515292058757613
O=C(CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1)NC1CC1,C13277602_decoy,CASP3,Decoy,0,-7.52308,-6.46,-4.56,-6.478006744309822
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)NCCC(=O)[O-])cc2)c1C,C13300711_decoy,CASP3,Decoy,0,-7.89953,-6.25,-4.29,-6.626482703758657
C/C(=N\NC(=O)Cn1nc(C)cc1C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1,C13365199_decoy,CASP3,Decoy,0,-8.85366,-8.09,-4.54,-8.292031084456555
CCOCCCNC(=O)NC(=O)Cn1cnc2sc(C(=O)[O-])c(C)c2c1=O,C13418190_decoy,CASP3,Decoy,0,-8.28006,-4.75,-0.5,-5.599495570873672
CCCc1nnc(SCC(=O)N2C[C@@H](C(N)=O)Oc3ccccc32)n1CC(=O)[O-],C13442891_decoy,CASP3,Decoy,0,-8.08503,-7.45,-0.27,-5.577391390876911
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)O[C@@H](C)C(N)=O)cc1,C21275816_decoy,CASP3,Decoy,0,-6.38071,-6.5,-1.74,-6.715348504854829
CCOC(=O)NNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1,C21772619_decoy,CASP3,Decoy,0,-6.63918,-6.35,-1.86,-5.479912250840956
COc1ccc(CSCCc2c([O-])[nH]c(NC(C)=O)nc2=O)cc1[N+](=O)[O-],C16854194_decoy,CASP3,Decoy,0,-6.3934,-7.5,-3.26,-7.639463458826739
CCOC(=O)c1cc(C(=O)OCC)c(N/N=C2\C(=O)NC(=S)N=C2[O-])s1,C06016462_decoy,CASP3,Decoy,0,-8.43048,-6.38,-0.82,-5.887698030070754
O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ccc([O-])nn2)c1C(F)(F)F,C33180711_decoy,CASP3,Decoy,0,-7.77647,-6.57,-0.85,-8.469391403947261
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(Cc3ccco3)[C@H]2c2ccc(OCC(N)=O)cc2)s1,C35567736_decoy,CASP3,Decoy,0,-9.53566,-7.34,-3.78,-7.41739488993072
CCOC(=O)[C@H]1C([O-])=NC(SCC(N)=O)=C(C#N)[C@@H]1c1ccccc1[N+](=O)[O-],C03668367_decoy,CASP3,Decoy,0,-7.26373,-6.17,-1.54,-6.622913691837752
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1ccc(CSc2ncn[nH]2)cc1,C09126880_decoy,CASP3,Decoy,0,-10.4277,-6.22,-1.91,-6.194980024461396
CCOc1cc([C@H]2C(C(=O)c3ccc(Br)cc3)=C([O-])C(=O)N2CCCO)ccc1O,C40047756_decoy,CASP3,Decoy,0,-8.50733,-5.59,-1.98,-6.896142560304411
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(O)cc2)s1,C40098522_decoy,CASP3,Decoy,0,-8.27565,-6.48,-2.23,-6.525140171498385
O=C([O-])c1ccc(Nc2ncnc(NCCCN3CCOCC3)c2[N+](=O)[O-])cc1,C40623390_decoy,CASP3,Decoy,0,-7.25961,-5.67,-0.68,-5.897243930045173
O=C([O-])c1ccc(Nc2ncnc(NCCN3CCOCC3)c2[N+](=O)[O-])cc1,C40661170_decoy,CASP3,Decoy,0,-7.02859,-6.05,-1.1,-5.845813890326679
C/C=C\CN1C(=O)[C@H]2[C@@H](c3ccc(Oc4ccccc4)cc3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C43218423_decoy,CASP3,Decoy,0,-6.61335,-7.7,-1.6,-6.705059824425431
CCCCN1C(=O)[C@H]2[C@@H](c3ccccc3O)N[C@@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C33864229_decoy,CASP3,Decoy,0,-6.8626,-5.35,-0.94,-5.500391913552561
CCc1cccc(CC)c1N1C(=O)[C@H]2[C@H](/C=C/c3ccccc3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C33929178_decoy,CASP3,Decoy,0,-7.44438,-5.67,-1.08,-5.945832028881771
CCc1cccc(CC)c1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CC(=O)[O-])(C(=O)[O-])[NH2+][C@@H]2/C=C/c1ccccc1,C44174723_decoy,CASP3,Decoy,0,-8.44509,-6.29,-2.09,-7.042922553994601
O=C(CSc1nnc(-c2ccc3c(c2)OCO3)o1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13414127_decoy,CASP3,Decoy,0,-7.88619,-7.62,-1.66,-5.8634267183962745
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=S)Nc3cccc([N+](=O)[O-])c3)cc2)no1,C03613294_decoy,CASP3,Decoy,0,-6.53153,-6.11,-0.11,-5.442636996978196
O=[N+]([O-])c1ccc(NCCO)c([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1,C26540662_decoy,CASP3,Decoy,0,-6.75551,-5.81,-1.14,-6.25249320033078
COc1cc(C(=O)NC/C([O-])=N/c2nc(-c3ccccn3)n[nH]2)cc(OC)c1OC,C53525230_decoy,CASP3,Decoy,0,-7.76751,-7.17,-1.47,-6.3452639566884965
O=C([O-])c1ccc(CNC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1,C20153137_decoy,CASP3,Decoy,0,-6.26775,-5.95,-0.65,-5.074699952215865
O=C([O-])Cc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1,C20153311_decoy,CASP3,Decoy,0,-6.25615,-6.4,-1.09,-6.134714393665846
O=C([O-])CCNC(=O)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1cccc([N+](=O)[O-])c1,C59730162_decoy,CASP3,Decoy,0,-8.10373,-7.05,-1.78,-6.028057254084965
COC(=O)C1=C(C)N=C(C)/C(=C(/[O-])OC)[C@H]1c1cccc(OCc2nonc2C(N)=O)c1,C27621423_decoy,CASP3,Decoy,0,-8.50294,-8.06,-2.39,-9.842759335349148
CNC(=S)N1N/C(=C2/C(=O)N=C([O-])N(CCCOC)C2=O)C[C@H]1c1ccc(OC)cc1,C09171454_decoy,CASP3,Decoy,0,-8.35514,-6.17,-1.67,-6.413789817489858
CC(=O)OCC1=C[C@@H](OC(C)=O)[C@@H]2C=CO[C@H](O[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3O)[C@@H]12,C04268355_decoy,CASP3,Decoy,0,-7.12812,-6.27,-1.14,-6.606287103398077
CCN(CC)c1nc(N(CCO)CCO)nc2c(N(CC)CC)nc(N(CCO)CCO)nc12,C05543856_decoy,CASP3,Decoy,0,-9.46453,-4.7,-3.17,-7.864116578396292
CCCC[NH+](CCCC)C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])/C(C)=N/NC(=S)NN,C05809924_decoy,CASP3,Decoy,0,-6.59852,-7.28,-4.3,-7.462189996524896
CCSCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1N=[N+]=[N-],C05855955_decoy,CASP3,Decoy,0,-8.22661,-5.91,-3.42,-6.054026888568661
CO[C@H]1C[C@@H](O[C@@H]([C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H]([NH+](C)C)[C@@H]2O)C(C)C)[C@@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@@H](C)C(=O)[C@]2(C)CO2)O[C@@H](C)[C@H]1O,C08214804_decoy,CASP3,Decoy,0,-6.72274,-7.33,-4.07,-6.855719920871625
CO[C@H]1C[C@@H](O[C@@H]([C@H](C)[C@@H](O[C@@H]2O[C@@H](C)C[C@H]([NH+](C)C)[C@@H]2O)C(C)C)[C@@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@@H](C)C(=O)[C@]2(C)CO2)O[C@@H](C)[C@H]1O,C08214805_decoy,CASP3,Decoy,0,-6.90423,-6.41,-2.6,-6.268349047281005
CO[C@H]1C[C@@H](O[C@@H]([C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([NH+](C)C)[C@@H]2O)C(C)C)[C@@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@@H](C)C(=O)[C@]2(C)CO2)O[C@@H](C)[C@H]1O,C08214806_decoy,CASP3,Decoy,0,-8.34836,-7.18,-3.35,-7.180006095169832
CO[C@H]1C[C@@H](O[C@@H]([C@H](C)[C@@H](O[C@@H]2O[C@@H](C)C[C@@H]([NH+](C)C)[C@@H]2O)C(C)C)[C@@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@@H](C)C(=O)[C@]2(C)CO2)O[C@@H](C)[C@H]1O,C08214807_decoy,CASP3,Decoy,0,-7.81313,-7.27,-2.66,-7.9955508385807805
COC(=O)[C@@H](CCSC)NC(=O)C1(OC(C)=O)C[C@H](OC(C)=O)C(OC(C)=O)[C@@H](OC(C)=O)C1,C08740202_decoy,CASP3,Decoy,0,-10.4004,-6.27,-2.69,-8.17231134117024
CCOC(=O)c1sc(NC(=O)COC(=O)c2cc(OC)c(OC)c(OC)c2)c(C(=O)OCC)c1C,C08798835_decoy,CASP3,Decoy,0,-8.79923,-5.99,-1.54,-6.65019379775905
COCCOC(=O)c1c(NC(=O)COC(=O)CCCc2nc3ccccc3s2)sc(C(N)=O)c1C,C12579270_decoy,CASP3,Decoy,0,-9.66624,-6.0,-2.63,-6.541638176154365
CC(=O)OC[C@@H]1O[C@@H](n2cc(/C=C/C(=O)OCCC(C)C)c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C12654735_decoy,CASP3,Decoy,0,-7.27893,-6.23,-2.52,-6.227891058765151
COC(=O)[C@@]1(O)C[C@H](OC(C)=O)[C@@H](NC(C)=O)[C@@H]([C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O)O1,C13306903_decoy,CASP3,Decoy,0,-6.19293,-6.19,-3.6,-6.67557077776771
CCOC(=O)c1c(NC(=O)C[NH+](C)CC(=O)N(CC)CC)sc(C(=O)OCCOC)c1C,C15484776_decoy,CASP3,Decoy,0,-8.48051,-5.9,-3.72,-9.564210374048129
CCOCCCNC(=O)c1coc(CN(CCCOCC)C(=O)c2cc(OC)cc(OC)c2)n1,C16456770_decoy,CASP3,Decoy,0,-7.64385,-6.42,-3.45,-6.051516634161064
CCCCOC(=O)/C=C/c1cn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)[nH]c1=O,C16808861_decoy,CASP3,Decoy,0,-6.3222,-5.79,-2.22,-5.534811118924093
CC(=O)OC[C@H]1O[C@@H](n2cc(/C=C/C(=O)OCCC(C)C)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16808873_decoy,CASP3,Decoy,0,-6.96062,-6.37,-3.49,-6.138338640131468
CCCCOC(=O)CNC(=O)OC/C=C/C#CC#C/C=C/COC(=O)NCC(=O)OCCCC,C17214358_decoy,CASP3,Decoy,0,-8.87068,-5.71,-1.46,-8.029530330264476
Cc1cn([C@H]2C[C@@H](N=[N+]=[N-])[C@@H](COC(=O)CCCCCCCCCCBr)O2)c(=O)[nH]c1=O,C17223506_decoy,CASP3,Decoy,0,-7.5379,-5.86,-2.34,-5.888195429398084
CCOC(=O)CNC(=O)CCCCSc1ncnc2c1ncn2CCCCC(=O)NCC(=O)OCC,C19892530_decoy,CASP3,Decoy,0,-9.14512,-5.9,-2.21,-6.617967345477843
COC(=O)C1=C[C@@H](OC(C)=O)[C@H](NC(C)=O)[C@@H]([C@@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O)O1,C22047629_decoy,CASP3,Decoy,0,-9.09126,-5.07,-2.95,-7.131648483129371
CS(=O)(=O)SCCNC(=O)CCOCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21,C22052131_decoy,CASP3,Decoy,0,-9.50724,-5.67,-2.83,-7.1716137376725415
COC(=O)[C@H](CC[NH2+][C@@H](CC[NH+]1CC[C@@H]1C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)OC(C)=O,C22053539_decoy,CASP3,Decoy,0,-7.05832,-6.11,-3.61,-6.554267934456204
CC(C)(C)C(=O)OC[C@@H](O)[C@@H]1O[C@@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@@H]1OC(=O)C(C)(C)C,C22066916_decoy,CASP3,Decoy,0,-6.3749,-6.5,-3.56,-5.60102997992089
CCN(CC)CC[NH+](C[C@H](O)COCc1ccc2c(c1)OCO2)C[C@H](O)COCc1ccc2c(c1)OCO2,C22921097_decoy,CASP3,Decoy,0,-8.38183,-6.06,-2.31,-8.188604607520436
CCCN(CC1CC1)C(=O)C(=O)c1cn(CC(=O)OCC)c2ccc(NC(=O)C(C)(C)OC(C)=O)cc12,C23326121_decoy,CASP3,Decoy,0,-7.69799,-7.32,-2.13,-7.47774384224665
CCOC(=O)c1[nH]c(CC(=O)Cc2[nH]c(C(=O)OCC)c(C)c2C(=O)OCC)c(C(=O)OCC)c1C,C25781690_decoy,CASP3,Decoy,0,-8.35958,-7.0,-2.32,-10.491174275095492
CCOC(=O)CCCNC(=O)COC(=O)c1ccc(-n2nc(C)c(CCC(=O)OC)c2C)cc1,C26166768_decoy,CASP3,Decoy,0,-7.91628,-6.07,-2.37,-7.694648320559084
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,C31161882_decoy,CASP3,Decoy,0,-10.4424,-6.08,-2.43,-7.420098998679328
CCCCOC(=O)CNC(=O)OC/C=C\C#CC#C/C=C/COC(=O)NCC(=O)OCCCC,C17214356_decoy,CASP3,Decoy,0,-9.11758,-5.8,-3.17,-8.892122001204422
CCOCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)NCC(=O)OCC,C33683622_decoy,CASP3,Decoy,0,-8.94917,-6.57,-1.41,-7.61377258056478
NNC(=O)CCCCCNC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21,C34603374_decoy,CASP3,Decoy,0,-8.39067,-6.64,-2.61,-9.728986808231287
CC[C@H](C)[C@H](O)C(=O)O[C@H](C(=O)O[C@H](C(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H](C)CC)[C@@H](C)CC,C35458341_decoy,CASP3,Decoy,0,-9.10479,-6.33,-1.07,-9.076427168372716
COCCOC(=O)c1sc2nc(C[NH+](Cc3ccco3)C[C@H](O)COC(C)C)[nH]c(=O)c2c1C,C35746623_decoy,CASP3,Decoy,0,-9.38034,-6.75,-1.7,-7.627396202091963
CCOCCOc1nc(-c2ccc3c(c2)OCO3)n(-c2ccc(NC[C@@H](O)COCC(C)C)cc2)n1,C36145585_decoy,CASP3,Decoy,0,-9.0179,-6.76,-0.8,-7.163352422261935
COCCC[NH+](Cc1nc2sc(C(=O)OC(C)C)c(C)c2c(=O)[nH]1)C[C@@H](O)COCc1ccco1,C36207453_decoy,CASP3,Decoy,0,-9.92173,-7.09,-2.53,-7.681141750501198
CCCCCCN(C(=O)COC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)c1ccc([N+](=O)[O-])cc1,C36521072_decoy,CASP3,Decoy,0,-7.44663,-6.77,-1.94,-7.48798905272074
CC(=O)N[C@H]1[C@H](OCCCCCCCl)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C08834026_decoy,CASP3,Decoy,0,-6.5314,-6.02,-2.14,-6.0406549160619685
CCOP(=O)(OCC)[C@H](NCC[NH2+][C@@H](c1ccccn1)P(=O)(OCC)OCC)c1ccccn1,C22852011_decoy,CASP3,Decoy,0,-6.34116,-5.39,-3.55,-5.94305346805476
CCOC(=O)C1=C(C)[C@H](C(=O)OCC)N=C1/C=C/Cc1[nH]c(C(=O)OCC)c(C)c1C(=O)OCC,C39948027_decoy,CASP3,Decoy,0,-7.9634,-5.98,-2.58,-8.280658280348776
CCCn1c(CCc2cn(CC)nc2C)nnc1SCc1nc(NCC)ncc1C(=O)OCC,C41347428_decoy,CASP3,Decoy,0,-8.74662,-6.23,-2.22,-6.424384991606732
C=CCn1c(COc2ccc(OC)cc2)nnc1SCc1nc(NCC)ncc1C(=O)OCC,C41661111_decoy,CASP3,Decoy,0,-8.23505,-6.93,-2.55,-7.301652803159672
COC(=O)[C@]1(Cl)C[C@H](OC(C)=O)[C@@H](NC(C)=O)[C@H]([C@@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O)O1,C44069279_decoy,CASP3,Decoy,0,-8.35809,-6.86,-1.81,-9.14771889927613
CCCCCOC(=O)/C=C/c1cn([C@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)c(=O)[nH]c1=O,C44608067_decoy,CASP3,Decoy,0,-7.70572,-6.18,-1.67,-7.006465790444475
CC(=O)OC[C@H]1O[C@H](n2cc(/C=C/C(=O)OCCC(C)C)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44608071_decoy,CASP3,Decoy,0,-7.10002,-5.62,-1.4,-5.635199446198127
[NH3+]C(CO)(CO)CCc1ccc(OCCCCCCNc2ccc([N+](=O)[O-])c3nonc23)cc1,C44676009_decoy,CASP3,Decoy,0,-6.95627,-6.44,-1.54,-5.433047736058107
CCOP(=O)(OCC)[C@@]1(C)[C@@H](COC(=O)NCCCNC(=O)CCCC[C@H]2SC[C@H]3NC(=O)N[C@@H]32)CC=[N+]1[O-],C64857826_decoy,CASP3,Decoy,0,-9.08902,-6.77,-3.24,-6.495747352161104
CCOP(=O)(OCC)[C@@]1(C)[C@@H](COC(=O)NCCCNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]23)CC=[N+]1[O-],C64857833_decoy,CASP3,Decoy,0,-8.44344,-6.64,-2.73,-6.016499346553202
CCCCC/C=C\C/C=C\C=C/C=C\[C@@H](SC[C@](N)(C(=O)NCC(=O)[O-])N1C(=O)CC[C@H]1C(=O)[O-])[C@@H](O)CCCC(=O)OC,C64858748_decoy,CASP3,Decoy,0,-10.5188,-7.44,-3.05,-9.126222173027214
CO[S@@](=O)(=S)CCNC(=O)[C@H]([NH3+])CCCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21,C33696505_decoy,CASP3,Decoy,0,-8.66268,-5.19,-3.27,-5.958219967517633
Nc1ncnc2c1nc(NCCCCCC[NH3+])n2[C@H]1O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O,C03871260_decoy,CASP3,Decoy,0,-5.88919,-6.86,-1.98,-6.967500043677373
CC(=O)OC[C@@H]1OC[C@@](OC(C)=O)(n2cnc3c(=O)[nH]c(=O)[nH]c32)[C@H]1OC(C)=O,C04293779_decoy,CASP3,Decoy,0,-7.11415,-5.42,-0.58,-6.34934697142383
OCCNc1nc(N(CCO)CCO)nc2c(NCCO)nc(N(CCO)CCO)nc12,C05543810_decoy,CASP3,Decoy,0,-9.55674,-5.74,-3.74,-7.805603961955076
CC(=O)Nc1ncnc2c1ncn2[C@H]1O[C@@H](COC(C)=O)[C@@H](NC(=O)C(F)(F)F)[C@@H]1OC(C)=O,C05554015_decoy,CASP3,Decoy,0,-6.67998,-5.48,-1.47,-5.758735741418828
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,CASP3,Decoy,0,-8.06633,-6.18,-2.05,-7.8167917137175325
CCOc1ncn(-c2ccc(NC(=S)N[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)cc2)n1,C05733612_decoy,CASP3,Decoy,0,-7.57001,-7.13,-2.41,-7.664212764375069
CC(=O)Nc1cc(/N=N\c2cc(/N=N\c3cc(NC(C)=O)cc(S(=O)(=O)[O-])c3)c(N)cc2N)cc(S(=O)(=O)[O-])c1,C04701179_decoy,CASP3,Decoy,0,-10.1295,-7.97,-3.04,-7.989136217468916
O=S1(=O)C[C@@H](O)[C@H](S(=O)(=O)NCCCc2nnc(S(=O)(=O)Cc3ccccc3F)o2)C1,C09027410_decoy,CASP3,Decoy,0,-8.35827,-7.96,-1.81,-7.213702020505197
CCSc1nnc(NC(=O)Cn2cc(S(=O)(=O)NC)c(S(=O)(=O)NC)c2)s1,C09225014_decoy,CASP3,Decoy,0,-10.6397,-6.13,-2.42,-7.899685284576724
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNC2=NS(=O)(=O)c3ccccc32)cc1,C09507297_decoy,CASP3,Decoy,0,-7.17442,-7.23,-1.65,-5.839834583471683
CCn1c(CCC(N)=O)nnc1SCC(=O)c1c(N)n(C2CC2)c(=O)[nH]c1=O,C09641774_decoy,CASP3,Decoy,0,-8.06571,-6.21,-0.91,-6.406444992734718
CCNc1nc2c(c(=O)[nH]c(=O)n2C)n1CCCn1c(NCC)nc2c1c(=O)[nH]c(=O)n2C,C10049599_decoy,CASP3,Decoy,0,-8.67132,-7.36,-1.63,-6.879864899181816
CCNc1nc2c(c(=O)[nH]c(=O)n2C)n1CCCCn1c(NCC)nc2c1c(=O)[nH]c(=O)n2C,C10049614_decoy,CASP3,Decoy,0,-8.23134,-7.06,-1.3,-6.926303534481813
CCOC(=O)c1c(C)oc(NC(=O)CSc2nc3ncccn3n2)c1C(N)=O,C10075571_decoy,CASP3,Decoy,0,-7.0987,-7.23,-1.29,-6.1817027114008445
O=C(/C=C\c1cccs1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1,C12368454_decoy,CASP3,Decoy,0,-9.29949,-5.86,-1.98,-6.556956912266765
Cc1cc([N+](=O)[O-])nn1CCC(=O)NNC(=O)CCn1cc([N+](=O)[O-])cn1,C02735343_decoy,CASP3,Decoy,0,-5.80891,-8.06,-0.12,-6.3671333731959
CCCCn1c(N)c(N(Cc2ccco2)C(=O)Cn2[nH]c(=O)ccc2=O)c(=O)[nH]c1=O,C12685539_decoy,CASP3,Decoy,0,-7.1304,-5.83,-1.53,-6.477823914994606
Cn1cnc2c1c(=O)n(CCCSc1nnc(CCC(N)=O)n1C1CC1)c(=O)n2C,C12535019_decoy,CASP3,Decoy,0,-8.9678,-6.62,-1.12,-8.348791520892124
Cc1nn(CC(=O)NNC(=O)[C@H](C)Cn2nc(C)c([N+](=O)[O-])c2C)c(C)c1[N+](=O)[O-],C02786026_decoy,CASP3,Decoy,0,-6.17058,-6.95,-3.12,-5.885386711500505
CCOP(=O)(OCC)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O,C16940491_decoy,CASP3,Decoy,0,-6.32808,-6.08,-1.08,-5.854418922715032
CC(NCCCCCCNC(C)=C1C(=O)N(C)C(=O)N(C)C1=O)=C1C(=O)N(C)C(=O)N(C)C1=O,C20790387_decoy,CASP3,Decoy,0,-7.56744,-6.64,-1.34,-7.099448927116442
COc1cc(/C=N/Nc2nnc(SCC(N)=O)n2N)cc(OC)c1OC,C20827155_decoy,CASP3,Decoy,0,-8.57453,-4.88,-0.55,-6.766285738688561
Cc1nnc(NC(=O)CSc2nnc(N/N=C/c3cnn(C(C)C)c3)n2N)s1,C20921765_decoy,CASP3,Decoy,0,-7.83161,-6.12,-1.15,-5.774445483056318
CC(=O)OC[C@H]1O[C@H](n2cnc3c(N)nc(=O)[nH]c32)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22061523_decoy,CASP3,Decoy,0,-6.26222,-5.54,-1.13,-5.991937817453621
N#Cc1ccc(NCC(F)(F)c2ccccn2)[n+]([O-])c1CC(=O)NCc1ncccc1-n1cncn1,C28523291_decoy,CASP3,Decoy,0,-7.57537,-8.65,-3.43,-5.831554020641115
C[C@@H](CCc1ccc(O)cc1)O[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,C31156029_decoy,CASP3,Decoy,0,-5.28321,-8.79,-1.97,-6.660236320953911
CCCCn1nc(C(=O)OCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)ccc1=O,C32829895_decoy,CASP3,Decoy,0,-6.64344,-6.13,-2.36,-5.458214146614182
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,CASP3,Decoy,0,-8.4809,-6.01,-1.46,-7.182208490645617
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,CASP3,Decoy,0,-7.73844,-7.55,-2.62,-6.364613420395772
COc1cccc([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)c1O,C35352855_decoy,CASP3,Decoy,0,-9.29119,-8.23,-3.56,-8.397733914613134
CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C,C03313385_decoy,CASP3,Decoy,0,-6.66269,-6.48,-1.84,-5.078087377149572
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,CASP3,Decoy,0,-7.22157,-7.65,-1.34,-6.298880720532841
CCOC(=O)c1c(C)oc(NC(=O)Cn2c(N)nnc2SCC#N)c1C(N)=O,C40173564_decoy,CASP3,Decoy,0,-8.7306,-5.19,-1.81,-6.140193429232508
CC[C@H](C(=O)Nc1c(C#N)cnn1C)n1c(N)nnc1SCC(=O)OC,C40173912_decoy,CASP3,Decoy,0,-6.65346,-4.72,-2.04,-6.058422263828366
[NH3+]CCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@@H]2CO[P@@](=O)([O-])O[C@H]2[C@H]1O,C42854014_decoy,CASP3,Decoy,0,-6.61614,-5.67,-1.14,-5.207140168168339
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,CASP3,Decoy,0,-6.13015,-6.05,-1.34,-5.305130340486677
Cc1ccccc1[C@H]1[NH2+][C@](CCCNC(N)=O)(C(=O)[O-])[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12,C33476162_decoy,CASP3,Decoy,0,-9.10974,-6.62,-1.32,-7.367725945480162
N#Cc1ccc([C@@H]2[NH2+][C@@](CCCNC(N)=O)(C(=O)[O-])[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@H]32)cc1,C33519196_decoy,CASP3,Decoy,0,-9.26014,-6.28,-2.56,-7.047725981919759
NC(=O)NCCC[C@]1(C(=O)[O-])[NH2+][C@@H](c2ccccn2)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21,C33904193_decoy,CASP3,Decoy,0,-8.92489,-8.48,-3.86,-7.85131372480333
C=CCNC(=O)O[C@@H]1C[C@@](O)(C(=O)NCC(N)=O)C[C@H](NC(=O)NC2CCCCC2)[C@H]1O,C43536952_decoy,CASP3,Decoy,0,-10.0588,-7.5,-1.42,-8.56211824896112
CC(=O)OC[C@H]1O[C@@H](n2cnc3c(N)nc(=O)[nH]c32)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C44171185_decoy,CASP3,Decoy,0,-6.70746,-6.77,-1.03,-6.609326449496317
Cc1nnc(NC(=O)CSc2nnc(NC(=O)CN(C)S(C)(=O)=O)s2)s1,C48984846_decoy,CASP3,Decoy,0,-10.0816,-6.7,-1.72,-7.647145874738623
CC(=O)O[C@H](O)[C@H]1O[C@@H](n2cnc3c(N)nc(F)nc32)[C@@](O)(OC(C)=O)[C@@]1(O)OC(C)=O,C55161902_decoy,CASP3,Decoy,0,-7.30042,-7.05,-4.16,-5.287693834660835
CCNc1nc(NCC)n2c(SCC(=O)Nc3cc(=O)n(C)c(=O)n3C)nnc2n1,C16689854_decoy,CASP3,Decoy,0,-6.75135,-7.5,-1.36,-5.91835544000877
O=c1[nH]c2cc3c(cc2cc1CN(CCCO)Cc1nnnn1Cc1ccco1)OCCO3,C57640514_decoy,CASP3,Decoy,0,-7.80137,-6.85,-2.01,-7.183838411972379
O=c1[nH]c2cc3c(cc2cc1CN(CCCO)Cc1nnnn1C[C@@H]1CCCO1)OCO3,C57642776_decoy,CASP3,Decoy,0,-8.9722,-7.64,-2.08,-7.0850896181520335
O=c1[nH]cnc2c1ncn2[C@@H]1O[C@@H](CO[P@@](=O)([O-])O[P@@](=O)([O-])OP(=O)([O-])[O-])[C@H](O)[C@H]1O,C35189270_decoy,CASP3,Decoy,0,-5.14179,-6.25,-1.73,-5.127010745464826
COc1cc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(C)=O)n[nH]2)c([N+](=O)[O-])cc1O,C59881603_decoy,CASP3,Decoy,0,-6.22987,-7.72,-1.86,-5.948656297577541
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2nccs2)n1N,C59914548_decoy,CASP3,Decoy,0,-10.6058,-5.57,-4.77,-7.453464898592149
O=C(CCn1nc([O-])c2ccccc2c1=O)NNC(=O)NCCCn1cc[nH+]c1,C64886744_decoy,CASP3,Decoy,0,-6.49398,-6.71,-6.27,-5.617042319121786
O=C([O-])c1ccccc1-n1ncc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1=O,C13036310_decoy,CASP3,Decoy,0,-5.93381,-6.56,-1.29,-5.589888085687162
Cc1cc(C)c(NC(=O)CNC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C)c(C)c1,C13200676_decoy,CASP3,Decoy,0,-7.40369,-8.31,-1.81,-6.852526222217616
Nn1c(COc2ccccc2F)nnc1SCC(=O)N1CCC(C(=O)[O-])CC1,C13218640_decoy,CASP3,Decoy,0,-6.87584,-6.19,-2.33,-6.002824198365191
CC[C@@H](C)NC(=O)NC(=O)CSc1nc2nc(C)c(CC(=O)[O-])c(C)n2n1,C13222198_decoy,CASP3,Decoy,0,-6.69859,-7.23,-0.89,-5.253165734343302
CNC(=O)c1ccc(NC(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)cc1,C13222452_decoy,CASP3,Decoy,0,-6.32672,-6.84,-0.88,-5.669665657289609
O=C(CSc1n[nH]c(=O)n1C1CC1)Nc1ccc(I)cc1C(=O)[O-],C13245973_decoy,CASP3,Decoy,0,-6.34258,-5.76,-2.73,-5.340529139298814
Cc1ccc(-c2nnc(S[C@H](C)C(=O)NC(=O)NC3CC3)n2CC(=O)[O-])cc1,C13270435_decoy,CASP3,Decoy,0,-6.24435,-5.8,-1.29,-5.270718946929689
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)NCC(=O)[O-])cc2)c1C,C13300855_decoy,CASP3,Decoy,0,-7.17691,-8.23,-1.65,-9.545493497958542
COc1c(O)cccc1[C@H]1C=C(c2ccc(O[C@@H](C)C(=O)[O-])cc2)Nc2nnnn21,C13462239_decoy,CASP3,Decoy,0,-7.38035,-7.46,-0.77,-5.990472577971046
O=C1NC(=S)N(c2ccccc2)C(=O)[C@H]1/C=N/[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C09130742_decoy,CASP3,Decoy,0,-7.02763,-8.07,-1.24,-7.4858864765428095
O=C([O-])Cc1csc(NC(=O)C[C@H]2SC(=O)N(c3cccc(O)c3)C2=O)n1,C16925997_decoy,CASP3,Decoy,0,-8.41668,-7.92,-1.87,-7.953257891676058
Cc1noc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]3[C@@H](C(=O)[O-])[C@H]4CC[C@@H]3O4)cc2)c1C,C17099488_decoy,CASP3,Decoy,0,-7.3097,-7.73,-2.63,-5.342185487204039
N#Cc1c(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)sc2c1CCCC2,C04259603_decoy,CASP3,Decoy,0,-7.74847,-5.99,-4.04,-6.468800287567345
COC(=O)C1=C(C)Nc2nc(=S)[nH]c([O-])c2[C@H]1c1cc(OC)c(OC)c(OC)c1,C28465895_decoy,CASP3,Decoy,0,-9.42689,-5.68,-1.87,-8.040038412186734
Cc1nc(-c2cc(C)n(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3[O-])c2C)cs1,C32902525_decoy,CASP3,Decoy,0,-8.05199,-7.74,-1.45,-6.2472990469890615
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CC(=O)[O-])(C(=O)[O-])[NH2+][C@H]3c2cccc3ccccc23)cc1,C33401021_decoy,CASP3,Decoy,0,-7.24477,-6.55,-2.31,-4.982791258880852
CCCCN1C(=O)[C@H]2[C@@H](c3ccc4c(c3)c3ccccc3n4CC)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C34258482_decoy,CASP3,Decoy,0,-7.88997,-7.35,-1.36,-6.855129484747902
O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1,C32999871_decoy,CASP3,Decoy,0,-6.57889,-7.1,-1.06,-6.795609064229113
CC(C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2[N-]S(=O)(=O)c2cccs2)C1,C36754574_decoy,CASP3,Decoy,0,-9.59013,-7.92,-2.04,-9.53854792147677
COC(=O)[C@@H]1Nc2cc(OC)ccc2[C@H]1NS(=O)(=O)c1ccc2nc([O-])sc2c1,C39217254_decoy,CASP3,Decoy,0,-10.7532,-6.95,-3.05,-7.407161444301663
COc1cc([N+](=O)[O-])cc(/C=N\NC(=O)[C@H]2C(=O)NC[C@@H]2c2ccccc2)c1[O-],C32528775_decoy,CASP3,Decoy,0,-6.62666,-8.67,-1.83,-6.963560841046132
Cc1cc(C(=O)[O-])cc(S(=O)(=O)NNC(=O)[C@@H]2C=C(c3ccccc3)N=N2)c1C,C39701226_decoy,CASP3,Decoy,0,-5.94953,-6.05,-1.45,-5.066114685787741
Cc1nc2nc(SCC(=O)NC(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)nn2c(C)c1CC(=O)[O-],C39715698_decoy,CASP3,Decoy,0,-7.36144,-7.94,-1.71,-6.302094146570074
C/C(=C1/SC(=S)N([C@H](CCC(N)=O)C(=O)[O-])C1=O)c1ccc([N+](=O)[O-])cc1,C39862256_decoy,CASP3,Decoy,0,-8.95823,-5.02,-1.94,-6.089402295001123
Cc1ccccc1N1C(=O)[C@H]2[C@H](/C=C/c3ccccc3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C33929162_decoy,CASP3,Decoy,0,-8.14277,-7.75,-2.3,-6.979661733012223
Cc1c(C(=O)[O-])sc2nc(CSc3nc4ccccc4c(=O)n3CCCO)[nH]c(=O)c12,C13363625_decoy,CASP3,Decoy,0,-7.64206,-7.26,-0.95,-6.5484706852748005
N#Cc1cc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2NCCO)ccc1Cl,C55582501_decoy,CASP3,Decoy,0,-8.11075,-6.25,-1.81,-6.367522000784755
CS(=O)(=O)[N-]c1ccc(/C=C/C(=O)NNC(=O)c2ccc(Cl)nc2)cc1,C58382021_decoy,CASP3,Decoy,0,-7.16104,-5.92,-1.77,-7.399877161476571
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cnn(-c3ccc([O-])nn3)c2C)c1C,C29819176_decoy,CASP3,Decoy,0,-7.92823,-6.32,-2.26,-6.034690106109174
[H]/N=C1\S[C@@H](C(=O)Nc2ccc(C(=O)[O-])cc2)CC(=O)N1/N=C/c1ccc(N(C)C)cc1,C58837432_decoy,CASP3,Decoy,0,-7.61645,-4.29,-4.24,-4.449744951262337
COC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@@H]1c1ccc(OC)cc1,C59293855_decoy,CASP3,Decoy,0,-5.88379,-5.39,-0.88,-3.819466783863608
CCOC(=O)C1=C(N)N2C(=O)[C@@H](CC(=O)[O-])SC2=C(C#N)[C@@H]1c1ccccc1Cl,C59293927_decoy,CASP3,Decoy,0,-7.21446,-6.38,-2.7,-8.146413893075655
CCOC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@H]1c1ccccc1F,C59293936_decoy,CASP3,Decoy,0,-7.46383,-6.31,-1.28,-4.779637212803334
CCOC(=O)C1=C(N)N2C(=O)[C@H](CC(=O)[O-])SC2=C(C#N)[C@H]1c1sccc1C,C59293996_decoy,CASP3,Decoy,0,-8.23715,-5.84,-0.85,-6.620192764708014
C=CCn1c([S-])nnc1CC1=N[C@H](NC(=O)c2ccc3c(c2)OCC(=O)N3)SC1,C39791945_decoy,CASP3,Decoy,0,-8.41378,-6.05,-3.1,-6.143459321108956
O=C([O-])[C@H](CC1=c2ccccc2=[NH+]C1)/N=C/c1c([O-])[nH]c(=O)n(-c2cccc3ccccc23)c1=O,C63448372_decoy,CASP3,Decoy,0,-8.11942,-6.53,-0.89,-7.515313427370399
O=C1c2ccccc2N[C@@H](SC/C([O-])=N/c2ncn[nH]2)N1Cc1ccc2c(c1)OCO2,C63763368_decoy,CASP3,Decoy,0,-8.39076,-6.17,-3.06,-6.259660999424823
O=C1c2ccccc2N[C@H](SC/C([O-])=N/c2ncn[nH]2)N1Cc1ccc2c(c1)OCO2,C63763372_decoy,CASP3,Decoy,0,-9.46492,-6.68,-3.18,-7.223723020582442
C[C@H]1C(C(=O)NCc2cccnc2OCc2ccccc2)=CNN1c1ccc([O-])nn1,C63937545_decoy,CASP3,Decoy,0,-9.07139,-8.96,-2.17,-11.526829483917346
Cn1c([S-])nnc1CC1=N[C@@H](NC(=O)CNC(=O)Cc2ccccc2)SC1,C64064789_decoy,CASP3,Decoy,0,-9.4949,-7.04,-1.38,-8.296383296652282
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CCC(=O)[O-])C(=O)Nc2c(Cl)cccc21,C20567148_decoy,CASP3,Decoy,0,-7.81559,-5.66,-1.18,-4.805764069928012
CCOC(=O)C1=C(C)[C@H](S(=O)(=O)[N-]c2ccc(S(N)(=O)=O)cc2)C(C)=N1,C64491227_decoy,CASP3,Decoy,0,-8.01556,-5.97,-1.83,-7.256371933509641
CCOc1ccccc1[N-]S(=O)(=O)C1=CN=C([C@H]2NN[C@H](c3ccccc3)O2)C1,C64612845_decoy,CASP3,Decoy,0,-7.56674,-6.48,-1.29,-6.884717841073818
CS(=O)(=O)[N-]c1ccccc1CNC(=O)N1CCC[C@H](C(=O)NC2CC2)C1,C51272765_decoy,CASP3,Decoy,0,-8.75994,-7.51,-0.38,-7.477720045916474
Cc1ccc(/C=C/S(=O)(=O)NC/C([O-])=N/c2nc(-c3ccccn3)n[nH]2)cc1,C65880056_decoy,CASP3,Decoy,0,-8.07435,-7.12,-0.6,-7.992013688541674
COc1cc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)c3cccc(Cl)c3)cc2)ncn1,C66200666_decoy,CASP3,Decoy,0,-9.15318,-8.14,-1.43,-6.98415514824212
C[C@@H](C/C([O-])=N/S(=O)(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1)C(C)(C)C,C66730344_decoy,CASP3,Decoy,0,-5.53959,-6.0,-2.45,-5.001592031540419
CCc1nc(CNC(=O)c2cc(NC(C)=O)ccc2[N-]S(C)(=O)=O)cs1,C67072457_decoy,CASP3,Decoy,0,-9.43249,-6.35,-0.62,-6.603082640932816
O=C(NCCc1n[nH]c(=S)n1C1CC1)c1cccc(-n2nc([O-])ccc2=O)c1,C67078669_decoy,CASP3,Decoy,0,-8.63462,-6.6,-0.82,-6.854014923988231
CCNC(=O)Cn1ccc([N-]S(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)n1,C67245171_decoy,CASP3,Decoy,0,-7.26271,-6.36,-0.63,-6.382983182962408
O=C([O-])CCCCCN1C(=O)C(O)=C(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(O)cc1,C06460111_decoy,CASP3,Decoy,0,-7.38015,-8.31,-0.72,-15.071142202470597
CSC[C@H](NC(=O)C1CCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CC1)C(=O)[O-],C12866456_decoy,CASP3,Decoy,0,-9.6765,-5.83,-2.61,-8.591532079883123
CCOc1ccc(-c2nnc(S[C@H](C)C(=O)NC(=O)NC(C)(C)C)n2CCC(=O)[O-])cc1,C13018073_decoy,CASP3,Decoy,0,-7.98437,-7.26,-2.88,-6.786658574077626
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NCc3ccco3)n2CCC(=O)[O-])cc1,C13018086_decoy,CASP3,Decoy,0,-8.86617,-6.37,-1.67,-7.79832710964769
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NCc3ccco3)n2CC(=O)[O-])cc1,C13018620_decoy,CASP3,Decoy,0,-7.31685,-6.34,-4.73,-5.431693477002167
CCOc1ccc(-c2nnc(S[C@H](C)C(=O)NC(=O)NCc3ccco3)n2CC(=O)[O-])cc1,C13018622_decoy,CASP3,Decoy,0,-7.8443,-6.12,-0.72,-7.103646180982771
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccco3)n2CCC(=O)[O-])cc1,C13033371_decoy,CASP3,Decoy,0,-6.73394,-5.89,-2.07,-6.97297166616029
CCOc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccco3)n2CC(=O)[O-])cc1,C13033386_decoy,CASP3,Decoy,0,-7.88219,-5.95,-1.43,-6.264805164339711
Cc1nc2nc(SCC(=O)Nc3ccccc3SCC(N)=O)nn2c(C)c1CCC(=O)[O-],C13035584_decoy,CASP3,Decoy,0,-8.63945,-6.81,-2.22,-5.879706828317495
COc1cc(/C=N/n2c(SCC(=O)[O-])nnc2-c2ccoc2C)ccc1OCC(N)=O,C13078030_decoy,CASP3,Decoy,0,-8.76964,-5.45,-1.16,-6.266357851609542
COc1ccc(-c2nnc(SCC(=O)NCc3ccc(S(N)(=O)=O)cc3)n2CC(=O)[O-])cc1,C13232014_decoy,CASP3,Decoy,0,-8.42951,-7.61,-1.88,-6.382934574746262
Cc1ccc(SCCNC(=O)CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1,C13236480_decoy,CASP3,Decoy,0,-7.43662,-6.65,-1.9,-5.965768983060963
O=C(CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-])NCCSc1ccc(Cl)cc1,C13236531_decoy,CASP3,Decoy,0,-7.46261,-7.55,-2.2,-7.006322934989438
Cc1cccc(-c2nnc(SCC(=O)N(CCC(N)=O)c3ccccc3Cl)n2CC(=O)[O-])c1,C13244871_decoy,CASP3,Decoy,0,-10.7186,-7.68,-4.08,-9.362362765623168
COc1ccc(N(CCC(N)=O)C(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)cc1,C13245523_decoy,CASP3,Decoy,0,-8.48822,-6.82,-4.32,-7.377754016942921
CCOc1cc2c(cc1CNC(=O)CNC(=O)N[C@H](CC(=O)N1CCCC1)C(=O)[O-])O[C@H](C)C2,C13245809_decoy,CASP3,Decoy,0,-6.70114,-7.58,-0.89,-6.146331895711564
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1OC,C13247306_decoy,CASP3,Decoy,0,-8.40341,-7.86,-2.67,-8.233129228952453
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1OC,C13247308_decoy,CASP3,Decoy,0,-5.7405,-7.63,-1.61,-6.489085439123085
CCCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1,C13250693_decoy,CASP3,Decoy,0,-9.38192,-8.29,-0.94,-7.931391418508871
CCCCN(C(=O)/C=C/c1ccc(CCC(=O)[O-])o1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,C13259317_decoy,CASP3,Decoy,0,-8.42353,-7.81,-2.62,-7.684835742570916
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1OC,C13262341_decoy,CASP3,Decoy,0,-8.73583,-6.92,-1.38,-7.676196611616761
CS(=O)(=O)c1ccc(NCCNS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c([N+](=O)[O-])c1,C13314242_decoy,CASP3,Decoy,0,-6.10178,-6.61,-2.65,-5.49916373902634
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)c1,C13344549_decoy,CASP3,Decoy,0,-7.76254,-7.28,-3.25,-6.250133880842114
CCCCn1c(N)c(N(CCC(C)C)C(=O)/C=C/c2cc(C(=O)[O-])c(C)o2)c(=O)[nH]c1=O,C13450509_decoy,CASP3,Decoy,0,-6.88895,-5.42,-1.59,-6.044599507506396
CCCCN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1c(N)n(CCCC)c(=O)[nH]c1=O,C13451869_decoy,CASP3,Decoy,0,-6.92383,-5.36,-4.54,-5.866592004724367
COc1ccc(C(=O)NCC(=O)N/N=C/c2ccc(OC)c(OC)c2C(=O)[O-])cc1OC,C02272648_decoy,CASP3,Decoy,0,-7.40824,-6.78,-1.52,-5.632035628973795
COc1cc([C@@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)ccc1O,C09460840_decoy,CASP3,Decoy,0,-7.60755,-6.41,-2.38,-6.757214098559113
COc1cc([C@@H]2C(C(=O)c3cccc([N+](=O)[O-])c3)=C([O-])C(=O)N2CCOCCO)ccc1O,C09458672_decoy,CASP3,Decoy,0,-7.55362,-6.4,-2.47,-6.527458219811908
O=S(=O)([N-]c1ncccn1)c1ccc(NC(=S)NNC(=S)Nc2ccc(F)cc2F)cc1,C20534557_decoy,CASP3,Decoy,0,-9.28985,-6.02,-2.1,-6.39389466039433
CCCCCn1nc(C(=O)NNC(=O)Cn2c([S-])nnc2CCC)c2ccccc2c1=O,C17398073_decoy,CASP3,Decoy,0,-8.22003,-5.66,-3.55,-6.55281294229017
COc1cc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NCC(=O)[O-])cc(OC)c1OC,C22147623_decoy,CASP3,Decoy,0,-7.56407,-6.06,-3.02,-6.504339991352692
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1,C03312843_decoy,CASP3,Decoy,0,-6.41798,-6.77,-0.84,-7.722998822527439
COCCCNC(=O)C[NH+]1CCN(c2ccc([N-]S(=O)(=O)c3ccccc3)c(C(=O)[O-])c2)CC1,C33259883_decoy,CASP3,Decoy,0,-8.97809,-6.41,-2.26,-6.971433283516803
CCCCC(=O)N[C@@]1(C(F)(F)F)C(=O)N=C2C1=C([O-])NC(=O)N2CCc1ccc(OC)c(OC)c1,C01900391_decoy,CASP3,Decoy,0,-7.83885,-7.89,-2.23,-8.779818796192046
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CCC(C(=O)N[C@H](C(=O)[O-])C(C)C)CC2)cc1,C08918207_decoy,CASP3,Decoy,0,-7.66711,-6.72,-1.63,-6.425403194674762
CSCC[C@@H](NC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)[O-],C13544794_decoy,CASP3,Decoy,0,-9.37382,-7.21,-3.22,-7.717068797085687
CCOC(=O)[C@](NC(=O)CC)(Nc1ccc(S(=O)(=O)[N-]c2cc(C)on2)cc1)C(F)(F)F,C04001717_decoy,CASP3,Decoy,0,-7.11248,-6.99,-2.37,-6.936698253631908
C=CCn1c([S-])nnc1CC1=N[C@@H](NC(=O)CCNC(=O)NCc2ccccc2)SC1,C38798831_decoy,CASP3,Decoy,0,-9.63316,-5.51,-2.7,-6.39445763684656
C=CCN1[C@@H](SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])NN[C@@H]1c1ccoc1C,C39691824_decoy,CASP3,Decoy,0,-9.20058,-8.06,-2.6,-7.971240420202157
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(OCC(N)=O)cc2)cc1C,C40049074_decoy,CASP3,Decoy,0,-8.49335,-6.92,-1.22,-7.8029328249767715
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N[C@@H]2c2ccc(OCC(N)=O)cc2)cc1C,C40124142_decoy,CASP3,Decoy,0,-8.48552,-6.88,-1.13,-7.795073624193566
C=CCn1c(SCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])nnc1-c1ccc(Cl)cc1,C13395934_decoy,CASP3,Decoy,0,-9.20347,-7.63,-1.01,-8.046720644410573
CCO/C([O-])=C1\C(COC[C@@](C)(O)CO)=NC(C)=C(C(=O)OC)[C@H]1c1cccc(Cl)c1Cl,C26480246_decoy,CASP3,Decoy,0,-10.4214,-4.6,-3.49,-7.507436567046768
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)c1ccccc1[N-]S(C)(=O)=O,C22110619_decoy,CASP3,Decoy,0,-8.42342,-5.46,-1.37,-6.509569176406518
COc1ccc(/C=C\C(=O)NC(=S)Nc2ccc(S(=O)(=O)[N-]c3cc(C)on3)cc2)cc1OC,C35342106_decoy,CASP3,Decoy,0,-9.08167,-7.85,-1.9,-6.561295715387903
CCCOc1ccc(N2C(=O)C[C@@H](N(Cc3ccc(S(N)(=O)=O)cc3)C(=O)/C=C/C(=O)[O-])C2=O)cc1,C59489531_decoy,CASP3,Decoy,0,-8.35214,-6.81,-1.75,-6.766345611287977
[O-]/C(CSc1n[nH]c(NN=C(Cc2ccccc2)Cc2ccccc2)n1)=N\c1ncn[nH]1,C20908880_decoy,CASP3,Decoy,0,-10.4903,-8.62,-1.58,-8.705410829354191
CCOC(=O)C1=C(C)N=C(C(=O)N(Cc2ccccc2)[C@H]2C(=O)N=C([O-])N(CCOC)[C@H]2N)[C@H]1C,C63726772_decoy,CASP3,Decoy,0,-7.08983,-5.15,-2.06,-5.848660531049934
COc1nccnc1[N-]S(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccc(OC(C)C)c2)cc1,C66200619_decoy,CASP3,Decoy,0,-7.34636,-7.65,-2.77,-6.361659769535665
COc1cc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)c3cccc(OC(C)C)c3)cc2)ncn1,C66200690_decoy,CASP3,Decoy,0,-8.46544,-6.47,-0.79,-10.309074796905232
CC(C)=CCC[C@@]1(C)OC(=O)N(CCCCCC(=O)[O-])[C@]1(C)O,C02491266_decoy,CASP3,Decoy,0,-6.99915,-6.85,-0.91,-6.764321590853044
O=C([O-])CCCNC(=O)CCN1C(=O)/C(=C\C=C\c2ccccc2)SC1=S,C12032600_decoy,CASP3,Decoy,0,-6.08477,-6.87,-1.43,-6.664975124938608
COCCCNC(=O)CN(C)S(=O)(=O)c1cc(C(=O)[O-])cc(C)c1C,C12975497_decoy,CASP3,Decoy,0,-5.84499,-6.21,-1.3,-7.043439869463017
CC[C@@H](NS(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC)c1ccc(C)cc1,C13074535_decoy,CASP3,Decoy,0,-6.88344,-8.01,-3.53,-7.075166180288121
CCN(CCCNc1ccc(C(=O)[O-])cc1[N+](=O)[O-])c1ccccc1,C13212936_decoy,CASP3,Decoy,0,-5.05906,-6.89,-1.93,-5.738472670130104
CCn1c(SCC(=O)N[C@@H](C)CCCC(C)C)nc2cc(C(=O)[O-])ccc2c1=O,C13220100_decoy,CASP3,Decoy,0,-7.98125,-5.5,-0.91,-6.942312333172144
Cc1ccc(-c2nnc(SCC(=O)N[C@@H](C)CCCC(C)C)n2CC(=O)[O-])cc1,C13220697_decoy,CASP3,Decoy,0,-7.3206,-7.21,-1.95,-6.068207678652839
CCCCCC[C@@H](C)NC(=O)CSc1nc2ccccc2c(=O)n1CCC(=O)[O-],C13221563_decoy,CASP3,Decoy,0,-8.13752,-5.4,-0.65,-6.839098735718492
CCCCCC[C@@H](C)NS(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC,C13250654_decoy,CASP3,Decoy,0,-7.90993,-6.44,-1.78,-6.736847814832301
CCOc1ccc(OCCNS(=O)(=O)c2ccc(CC(=O)[O-])s2)cc1,C13311582_decoy,CASP3,Decoy,0,-7.73313,-6.22,-0.86,-6.739800405519634
CCCCOC(=O)c1ccc(NC(=O)CSc2nncc([O-])n2)cc1,C05867738_decoy,CASP3,Decoy,0,-8.16018,-6.69,-1.19,-7.47898680848887
CCCc1cc([O-])nc(SCC(=O)NCc2ccccc2Cn2cccn2)n1,C22930484_decoy,CASP3,Decoy,0,-7.9031,-7.35,-1.74,-6.368338611500397
CCCc1cc([O-])nc(S[C@H](C)C(=O)NCCCOCC)n1,C22931092_decoy,CASP3,Decoy,0,-8.29627,-4.24,-1.76,-6.34677365083
CCOc1ccc(-c2nnc([S-])n2CC(=O)NCCCOC2CCCCC2)cc1,C11356105_decoy,CASP3,Decoy,0,-10.4715,-6.77,-1.17,-8.217432449311671
CCCc1cc([O-])nc(SCC(=O)NCCCC(=O)OC)n1,C08204965_decoy,CASP3,Decoy,0,-8.60501,-5.68,-1.48,-5.645784884518334
C=CCCOc1ccc(-c2nnc(CCC(=O)NCCC(C)C)c([O-])n2)cc1,C34764276_decoy,CASP3,Decoy,0,-7.05074,-6.47,-2.43,-5.331750514979846
CCCCCCc1c([O-])nc(SCCN2CCOCC2)[nH]c1=O,C13555544_decoy,CASP3,Decoy,0,-8.77861,-6.09,-1.3,-6.708481236952079
CCCCCNC(=O)Cn1c([S-])nnc1-c1ccc(OCC)cc1,C17322553_decoy,CASP3,Decoy,0,-9.00033,-4.99,-1.44,-7.42491504629036
CCCCN(C)C(=O)CSc1nc([O-])c(CCC(C)C)c(=O)[nH]1,C08964384_decoy,CASP3,Decoy,0,-7.63637,-6.55,-1.52,-6.455394393591916
CCCCC[C@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC,C13220104_decoy,CASP3,Decoy,0,-8.00382,-5.55,-1.65,-6.51194916924564
C=CCOc1ccccc1[C@@H]1C(C(=O)c2cccs2)=C([O-])C(=O)N1CCCO,C40046421_decoy,CASP3,Decoy,0,-7.96417,-4.72,-1.51,-6.662124149147044
CCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCO)cc1,C40068185_decoy,CASP3,Decoy,0,-8.0394,-6.37,-2.08,-8.01850539621493
CN(C)c1ccc([C@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCOCCO)cc1,C40075969_decoy,CASP3,Decoy,0,-5.88376,-5.7,-1.3,-5.362040109022566
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2/C=C/c2ccccc2)cc1C,C40092314_decoy,CASP3,Decoy,0,-7.37349,-7.02,-1.66,-7.364640581976718
COc1ccc(CCn2c(CCCO)nc3cc(C(=O)[O-])ccc32)cc1OC,C40406859_decoy,CASP3,Decoy,0,-7.74168,-7.97,-0.64,-11.259419656683914
CC(C)(C)OC(=O)NCCO/N=C(\CCCC(=O)[O-])c1ccc(C(F)(F)F)cc1,C44136081_decoy,CASP3,Decoy,0,-6.00286,-5.75,-3.0,-6.089760492716627
COC(C)(C)CCC[C@@H](C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-],C44299790_decoy,CASP3,Decoy,0,-6.88266,-5.65,-0.68,-6.902676927646401
CCCOc1ccc(/C=C/C([O-])=C(\C#N)C(=O)NCCCOCC)cc1OC,C48934805_decoy,CASP3,Decoy,0,-8.15675,-6.18,-0.87,-6.802969211482473
CCOCCCN/C([O-])=C(\C#N)C(=O)/C=C/c1ccccc1OCC,C48935379_decoy,CASP3,Decoy,0,-7.15051,-5.56,-0.6,-6.155656533225554
CCOCCCN/C([O-])=C(\C#N)C(=O)c1ccc(OC2CCCC2)c(OC)c1,C48939152_decoy,CASP3,Decoy,0,-7.62638,-5.66,-1.86,-6.045290597867603
CCCc1ccc(/C([O-])=C(\C#N)C(=O)CCNC(=O)OCC)cc1,C49111740_decoy,CASP3,Decoy,0,-5.76315,-6.49,-0.61,-5.5352992488974895
CCOc1ccc(/C([O-])=C(\C#N)C(=O)NCCCOC(C)C)cc1OCC,C49217580_decoy,CASP3,Decoy,0,-7.51527,-5.57,-1.7,-5.942528112170348
CCOc1cc(/C=C/C([O-])=C(/C#N)C(=O)NCCCOC(C)C)ccc1OC,C49218514_decoy,CASP3,Decoy,0,-6.34655,-5.77,-1.71,-5.5081614790293045
COc1ccc(C(=O)CCCC(=O)/C(C#N)=C(\[O-])NCCCOC(C)C)cc1,C49223454_decoy,CASP3,Decoy,0,-7.93981,-6.66,-1.35,-7.0257226363846295
CCCCCCN/C([O-])=C(\C#N)C(=O)CN(C)S(=O)(=O)c1cccs1,C49228217_decoy,CASP3,Decoy,0,-8.01874,-5.67,-1.36,-6.383626044443535
CCCCC/C([O-])=C(\C#N)C(=O)Nc1ccc(C(=O)OCC)cc1,C50976415_decoy,CASP3,Decoy,0,-5.879,-6.36,-0.79,-6.699534955785918
C=CCOc1ccc(C(=O)/C(C#N)=C(\[O-])NCCCC)cc1OC,C51008601_decoy,CASP3,Decoy,0,-7.09664,-6.75,-1.45,-6.364467664183375
CCCCN/C([O-])=C(\C#N)C(=O)c1ccc(OCC(F)(F)F)nc1,C51008849_decoy,CASP3,Decoy,0,-6.35683,-4.83,-0.59,-5.04801954583828
CCCCN/C([O-])=C(\C#N)C(=O)CO/N=C(\C)c1ccc2c(c1)OCO2,C51010451_decoy,CASP3,Decoy,0,-7.332,-6.8,-0.12,-6.526415983672303
COc1ccccc1-c1n[nH]c(/N=C(\[O-])COCCOc2ccccc2)n1,C48366945_decoy,CASP3,Decoy,0,-8.67372,-6.77,-1.39,-7.461549909708463
COc1cc(/C=N/NC(=O)OCC(C)(C)C)ccc1OCC(=O)[O-],C06950177_decoy,CASP3,Decoy,0,-6.7646,-6.46,-2.74,-5.737552089792373
CCOC(=O)N/N=C/c1ccc(OCc2ccc(C(=O)[O-])cc2)c(OC)c1,C59153139_decoy,CASP3,Decoy,0,-7.1971,-5.7,-0.75,-5.573827141579928
CCCCS(=O)(=O)NCCCc1ccc([N-]S(C)(=O)=O)cc1,C62107707_decoy,CASP3,Decoy,0,-8.30338,-6.49,-1.32,-6.108175334337124
CC[C@H](C)c1ccc(N/C([O-])=C(\C#N)C(=O)[C@@H](C)OC[C@@H]2CCCCO2)cc1,C64101431_decoy,CASP3,Decoy,0,-7.80138,-6.74,-1.91,-5.626328525632218
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H]1CC([O-])=NC1=O,C64219683_decoy,CASP3,Decoy,0,-8.14627,-5.33,-1.48,-7.622883027632279
CCS(=O)(=O)[N-]c1ccccc1C(=O)NCCCOCC1CC1,C58283006_decoy,CASP3,Decoy,0,-7.65138,-6.07,-1.37,-6.650262062897903
CCCCN(CC)c1[nH+]cc([N-]S(=O)(=O)CC)cc1C(=O)[O-],C35397485_decoy,CASP3,Decoy,0,-5.92541,-4.88,-1.12,-5.470061786997571
CCC(CC)CN(CC(=O)OC)CN1N=C(c2ccc(F)c(C)c2)N[N-]1,C65941425_decoy,CASP3,Decoy,0,-7.89219,-7.2,-1.04,-7.887225560917438
CCNc1ccc(C(=O)OCC)cc1[N-]S(=O)(=O)CC(C)C,C66579211_decoy,CASP3,Decoy,0,-5.75017,-5.92,-2.26,-5.152703848398546
CCOC(=O)C1=C(C)N(CCCCC(=O)[O-])C(=O)N[C@@H]1c1cscn1,C67029768_decoy,CASP3,Decoy,0,-6.29304,-6.38,-1.84,-6.032192975162696
C=CCn1c(CNC(=O)c2ccccc2C)nnc1SCC(=O)Nc1cccc(C(=O)[O-])c1,C02851160_decoy,CASP3,Decoy,0,-7.93933,-7.87,-2.85,-8.99702288355605
C[C@H](NC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)[O-],C02891940_decoy,CASP3,Decoy,0,-7.80348,-7.27,-2.78,-8.833203425334418
CC[C@@H](C)[C@@H](NC(=O)CNC(=O)CCc1c(C)c2cc3c(C)c(C)oc3cc2oc1=O)C(=O)[O-],C11865456_decoy,CASP3,Decoy,0,-6.39053,-8.42,-1.56,-8.783373305991313
CSC[C@H](NC(=O)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC1)C(=O)[O-],C12863626_decoy,CASP3,Decoy,0,-7.79809,-6.42,-2.8,-7.181011612869455
Cc1ccc(-c2nnc(S[C@H](C)C(=O)NC(=O)NC(C)C)n2CCC(=O)[O-])cc1,C13018816_decoy,CASP3,Decoy,0,-7.48801,-5.49,-2.24,-6.04258773802017
Cc1cccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NC(C)(C)C)n2CCC(=O)[O-])c1,C13019020_decoy,CASP3,Decoy,0,-6.8368,-6.82,-2.07,-5.548263407075588
CCCCNC(=O)NC(=O)CSc1nc2cc(Cl)ccc2c(=O)n1CCC(=O)[O-],C13020838_decoy,CASP3,Decoy,0,-8.61872,-6.44,-0.82,-10.99361234554821
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)NCCC1=CCCCC1,C13045518_decoy,CASP3,Decoy,0,-7.8782,-6.52,-3.31,-6.242707725301189
N#CCSc1ccccc1NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13046050_decoy,CASP3,Decoy,0,-8.84005,-7.31,-1.38,-8.273265496943283
Cc1cccc(C(C)C)c1NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13051294_decoy,CASP3,Decoy,0,-8.27318,-8.29,-3.22,-7.763959213385032
C[C@@H](O)Cn1c(SCC(=O)NCC(F)(F)F)nc2cc(C(=O)[O-])ccc2c1=O,C13051630_decoy,CASP3,Decoy,0,-8.46349,-7.27,-1.23,-6.561954328721591
Cc1ccccc1CCNC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@H](C)O,C13052300_decoy,CASP3,Decoy,0,-7.77172,-6.48,-1.64,-6.641454643740749
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Oc2ccc(Cl)cc2C(N)=O)c1OC,C13074745_decoy,CASP3,Decoy,0,-9.08256,-7.46,-4.02,-9.662734095499305
C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CSc1nnc(-c2cccs2)n1CCC(=O)[O-],C13193102_decoy,CASP3,Decoy,0,-9.60619,-5.99,-2.47,-7.042191408799997
Cc1ccc(-c2nnc(SCC(=O)NC(=O)NCC(C)C)n2CCC(=O)[O-])cc1,C13196929_decoy,CASP3,Decoy,0,-7.29168,-8.05,-1.19,-7.661390938898453
CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13198274_decoy,CASP3,Decoy,0,-8.05366,-6.77,-3.97,-6.923063710443824
CC(C)CCNC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1CC(=O)[O-],C13204127_decoy,CASP3,Decoy,0,-8.00937,-6.78,-2.38,-6.192355851083386
CCNC(=O)NC(=O)[C@H](Sc1nnc(-c2cccc(C)c2)n1CC(=O)[O-])c1ccccc1,C13205989_decoy,CASP3,Decoy,0,-7.84321,-7.96,-2.89,-9.268081970118988
CC(C)c1ccc(OCc2nnc(SCC(=O)N3CCC(C(=O)[O-])CC3)n2N)cc1,C13220572_decoy,CASP3,Decoy,0,-7.89321,-7.21,-4.27,-6.716531489462226
CCOc1ccc(-c2nnc(SCc3ccc(C(N)=O)cc3)n2CCC(=O)[O-])cc1,C13244628_decoy,CASP3,Decoy,0,-8.33974,-7.59,-2.46,-7.277352481818632
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NCCCc2nc3ccccc3[nH]2)c1OC,C13249122_decoy,CASP3,Decoy,0,-7.52311,-7.17,-2.81,-6.661970483985463
C/C(=N\NC(=S)NC(C)C)c1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1,C13264222_decoy,CASP3,Decoy,0,-6.27386,-6.06,-1.7,-6.713456109411542
Cc1cccc(-c2nnc(SCC(=O)N(CCC(N)=O)Cc3ccccc3)n2CC(=O)[O-])c1,C13443284_decoy,CASP3,Decoy,0,-8.45601,-6.74,-1.36,-7.567343784947673
Cc1ccc(CNC(=O)c2c(NC(=O)COCC(=O)[O-])sc3c2CCCC3)cc1,C17090666_decoy,CASP3,Decoy,0,-9.61688,-7.45,-3.99,-8.646063427202584
CS(=O)(=O)/N=C(\[O-])CCC/C=C\C[C@@H]1C(=O)C[C@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1,C27640275_decoy,CASP3,Decoy,0,-9.12826,-6.95,-2.53,-6.804876979791913
O=C([O-])/C=C\C(=O)Nc1ccccc1SC[C@@H](O)Cn1ccc(C(F)(F)F)n1,C33382239_decoy,CASP3,Decoy,0,-8.89458,-7.65,-0.87,-8.792788035731853
CC(C)NC(=O)NCCc1nc2cc(C(=O)[O-])ccc2n1CCN1CCOCC1,C35946046_decoy,CASP3,Decoy,0,-8.48473,-6.99,-0.83,-7.347309276856114
CCOC(=O)[C@](NC(C)=O)(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)C(F)(F)F,C04083097_decoy,CASP3,Decoy,0,-9.02297,-7.14,-1.04,-8.275908759189923
CCCOc1ccc(C(=O)NNC(=O)Cn2c([S-])nnc2-c2cccs2)cc1OC,C12697100_decoy,CASP3,Decoy,0,-10.173,-5.62,-1.4,-7.587690512733843
CCCc1nnc([S-])n1CC(=O)NCCNc1ncc(C(F)(F)F)cc1Cl,C18216047_decoy,CASP3,Decoy,0,-8.57215,-7.51,-0.54,-6.268654892712185
C[C@H](NC(=S)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1cccc(Cl)c1,C39968863_decoy,CASP3,Decoy,0,-7.76954,-7.98,-2.12,-6.229505789991113
CCOc1cc([C@@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2CCCO)ccc1O,C40053098_decoy,CASP3,Decoy,0,-7.45944,-7.85,-0.68,-7.976711188945064
CCOc1cc([C@@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCO)ccc1O,C40079892_decoy,CASP3,Decoy,0,-8.31513,-5.57,-2.75,-7.344456108999849
CCOc1cc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)ccc1O,C40080725_decoy,CASP3,Decoy,0,-8.25731,-6.39,-1.82,-6.932036185433593
COc1cc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCO)ccc1O,C40084798_decoy,CASP3,Decoy,0,-8.83088,-6.46,-0.88,-6.946444736632612
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(O)cc2)ccc1OCC(C)C,C40093761_decoy,CASP3,Decoy,0,-9.51082,-5.72,-1.32,-7.216326988486725
COc1cccc2cc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@H]3c3ccc(O)cc3)oc12,C40097752_decoy,CASP3,Decoy,0,-9.35758,-5.93,-1.37,-8.176105065294427
CC[C@H](C)[C@H](NC(=O)CNC(=O)Cc1c(C)c2c(cc(C)c3c(C)coc32)oc1=O)C(=O)[O-],C43746712_decoy,CASP3,Decoy,0,-5.62289,-7.28,-0.29,-5.371467006327365
O=C([O-])CCn1c(SCC(=O)NCCc2c[nH]c3ccccc23)nnc1-c1cccs1,C13219387_decoy,CASP3,Decoy,0,-8.79552,-5.15,-1.78,-7.902666609442835
O=C([O-])CCCCCNC(=O)CCN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S,C15038528_decoy,CASP3,Decoy,0,-10.1278,-6.5,-1.69,-6.278134394819135
C[C@H](C(=O)NCCCCCC(=O)[O-])N1C(=O)/C(=C/c2cccc(O)c2)SC1=S,C15048173_decoy,CASP3,Decoy,0,-9.05076,-6.9,-1.91,-8.045648752188509
CCO/C([O-])=C1\C(COCCNC(=O)NC)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C27651346_decoy,CASP3,Decoy,0,-8.73883,-6.86,-3.74,-7.788225919113124
CCOC(=O)C1=C([O-])/C(=C\c2ccc(CNC(=O)C(=O)Nc3ccccc3)o2)N=C1C,C08994051_decoy,CASP3,Decoy,0,-7.29804,-6.79,-1.3,-6.493019474443847
Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CC2)cc1,C28796188_decoy,CASP3,Decoy,0,-7.68394,-7.63,-2.28,-7.353307877791777
COc1cc(/C=N/NC(=O)[C@@H]2CCCNC2=O)ccc1OCc1ccc(C(=O)[O-])cc1,C59152977_decoy,CASP3,Decoy,0,-8.16755,-7.03,-1.1,-6.103098605414703
CSCC[C@H](NS(=O)(=O)c1ccccc1F)/C([O-])=N/c1nc(-c2cccc(C)n2)n[nH]1,C59403394_decoy,CASP3,Decoy,0,-12.234,-8.18,-0.59,-8.619775171091291
COc1ccc(C(=O)NC(=S)Nc2cc(C(=O)[O-])cc(Cl)c2OC)cc1OC,C20153441_decoy,CASP3,Decoy,0,-7.93636,-7.52,-1.54,-8.11743306806696
CS(=O)(=O)[N-]c1cccc(C(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1,C60241172_decoy,CASP3,Decoy,0,-9.25216,-7.07,-2.29,-7.424604432929971
CCCCNC(=O)CN1CCN(c2ccc(NS(C)(=O)=O)c(C(=O)[O-])c2)CC1,C33259932_decoy,CASP3,Decoy,0,-8.13062,-6.07,-2.19,-6.178013676840108
CCCNC(=O)CN1CCN(/C(=N\c2cccc(C(=O)[O-])c2)NC[C@@H]2CCCO2)CC1,C46022163_decoy,CASP3,Decoy,0,-8.28273,-7.03,-1.28,-7.867595847696325
CCCc1nnc(SCC(=O)NC2CCC(C(C)(C)CC)CC2)n1CC(=O)[O-],C12895484_decoy,CASP3,Decoy,0,-5.79641,-4.79,-4.45,-5.971716100924788
CCOC(=O)c1c(NC(=O)CSc2nc(C)cc(C)c2C(=O)[O-])sc(C(=O)OC)c1C,C13023173_decoy,CASP3,Decoy,0,-9.56994,-6.8,-0.98,-6.679858260628782
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1S(=O)(=O)N(CC)CC,C13030352_decoy,CASP3,Decoy,0,-8.19596,-7.12,-1.9,-7.071570366530202
O=C([O-])CCCCCn1c(SCC(=O)N[C@H]2CCCc3ccccc32)nc2ccccc2c1=O,C13055614_decoy,CASP3,Decoy,0,-8.00773,-6.51,-2.43,-7.666224951075003
CCOCCCn1c(SCC(=O)Nc2c(C)cccc2C(=O)[O-])nc2sc(C)c(C)c2c1=O,C13244044_decoy,CASP3,Decoy,0,-7.58143,-6.26,-1.84,-6.532814375293369
O=C([O-])Cc1nnc(SCC(=O)c2ccc(NC(=O)c3ccco3)cc2)n1Cc1ccccc1,C13248178_decoy,CASP3,Decoy,0,-7.53014,-8.59,-1.97,-6.565115944375459
COC(=O)c1ccc2c(=O)n(CC(C)C)c(SCC(=O)NCc3ccc(C(=O)[O-])cc3)nc2c1,C13266547_decoy,CASP3,Decoy,0,-6.90658,-7.92,-3.8,-7.029296763908785
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cs2)cc1S(=O)(=O)N(CC)CC,C13301209_decoy,CASP3,Decoy,0,-8.71097,-6.48,-4.88,-7.683748658984179
Cc1nc(SCC(=O)c2cc(C)n(CCC(C)C)c2C)[nH]c(=O)c1CCC(=O)[O-],C13448945_decoy,CASP3,Decoy,0,-7.84341,-6.96,-3.38,-6.939793818354295
O=C([O-])[C@@H]1[C@@H](C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)C(F)F)c2)[C@H]2CC[C@@H]1O2,C20428822_decoy,CASP3,Decoy,0,-6.8473,-7.91,-1.33,-6.32271802530698
CCOc1cc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCOC)ccc1O,C09361092_decoy,CASP3,Decoy,0,-8.46141,-7.2,-1.92,-7.936354193052036
COc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)CCc2c(C)nc(SC(F)F)nc2[O-])cc1,C25577294_decoy,CASP3,Decoy,0,-9.4319,-6.46,-0.96,-9.337455426405878
COc1ccc([C@H](CC(=O)OC(C)C)NC(=O)CCc2c(C)nc(SC(F)F)nc2[O-])cc1,C25577300_decoy,CASP3,Decoy,0,-7.98966,-7.12,-1.96,-7.557266023233865
CCc1ccc(C(=O)/C=C\Nc2ccc(S(=O)(=O)[N-]c3cc(OC)nc(OC)n3)cc2)cc1,C27528241_decoy,CASP3,Decoy,0,-7.46338,-7.21,-1.68,-6.2197391448478045
COCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3cccc(C)c3)cc2)[C@H]1c1ccc(O)c(OC)c1,C09507269_decoy,CASP3,Decoy,0,-8.81102,-6.9,-3.34,-6.807798970587567
O=C([O-])[C@@H]1[C@H](C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)C(F)F)c2)[C@H]2CC[C@@H]1O2,C35898172_decoy,CASP3,Decoy,0,-7.10295,-8.37,-0.75,-6.608645447612267
COc1cc(-c2nnc(CCC(=O)NC[C@@H]3CCCO3)c([O-])n2)ccc1OCc1cccc(F)c1,C35922668_decoy,CASP3,Decoy,0,-10.204,-7.31,-2.34,-7.286767997897368
CCOC(=O)[C@H]1C([O-])=NC(SCC(=O)Nc2ccccc2C)=C(C#N)[C@@H]1c1ccccc1OCC,C08994977_decoy,CASP3,Decoy,0,-7.50225,-6.86,-1.71,-7.222767553245598
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC)[C@@H](c3ccc(OC)cc3OC)N12,C36053409_decoy,CASP3,Decoy,0,-7.74802,-4.43,-2.87,-6.005938543504692
CCOC(=O)C1=C(C)[C@H](C(=O)OCC)S[C@H]1NC(=O)CSc1nc(C)c(C)c([O-])n1,C39724740_decoy,CASP3,Decoy,0,-7.00734,-5.81,-2.02,-5.402288505945671
CC(C)COc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1,C40048463_decoy,CASP3,Decoy,0,-8.48099,-7.26,-1.07,-7.613692154683438
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2cccc([N+](=O)[O-])c2)cc1C,C40048944_decoy,CASP3,Decoy,0,-7.50029,-6.55,-1.55,-6.850824899079372
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1C,C40048948_decoy,CASP3,Decoy,0,-8.02682,-6.56,-1.1,-6.830904862773652
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccccc2[N+](=O)[O-])cc1C,C40052082_decoy,CASP3,Decoy,0,-5.81044,-6.56,-0.27,-7.473092784655866
CCOc1ccccc1[C@@H]1C(C(=O)c2cccs2)=C([O-])C(=O)N1CCOCCO,C40067177_decoy,CASP3,Decoy,0,-9.16007,-4.86,-1.87,-7.293315930299183
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40077686_decoy,CASP3,Decoy,0,-8.77243,-6.85,-2.87,-7.413465706670139
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2c(F)cccc2Cl)cc1,C40079194_decoy,CASP3,Decoy,0,-7.9155,-6.6,-3.01,-7.746456051852873
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc(OCCC(C)C)c2)c(C)c1,C40079705_decoy,CASP3,Decoy,0,-9.03173,-7.1,-2.22,-7.792137737020901
CCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40080507_decoy,CASP3,Decoy,0,-8.62394,-5.58,-2.57,-7.209934455521362
COc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40080522_decoy,CASP3,Decoy,0,-7.42107,-8.1,-1.05,-8.655934671805747
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40080815_decoy,CASP3,Decoy,0,-8.50404,-6.85,-2.42,-11.838733911694002
CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40080817_decoy,CASP3,Decoy,0,-8.51158,-5.62,-1.35,-7.792882800768735
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2cccc([N+](=O)[O-])c2)c(C)c1,C40083706_decoy,CASP3,Decoy,0,-7.02947,-7.5,-1.71,-7.501196808592481
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1,C40083711_decoy,CASP3,Decoy,0,-7.50513,-5.77,-1.93,-6.531692149178724
COc1cc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCO)cc(OC)c1OC,C40084381_decoy,CASP3,Decoy,0,-8.33911,-5.33,-2.25,-6.620344459178212
C=CCOc1cccc([C@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCOCCO)c1,C40085136_decoy,CASP3,Decoy,0,-7.66791,-6.89,-2.64,-6.5280788123521205
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2c(F)cccc2Cl)cc1C,C40085654_decoy,CASP3,Decoy,0,-9.05007,-5.96,-1.0,-7.328573309427295
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OCC)cc2)cc1C,C40086009_decoy,CASP3,Decoy,0,-8.54201,-5.96,-1.85,-7.786851404757615
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2OCC)cc1C,C40091510_decoy,CASP3,Decoy,0,-8.33954,-6.12,-0.49,-6.779200434550287
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OCCC)cc2)cc1C,C40091967_decoy,CASP3,Decoy,0,-7.93149,-6.01,-2.06,-6.662622956890541
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2OC)cc1C,C40092017_decoy,CASP3,Decoy,0,-9.04196,-7.73,-1.05,-8.147305610160616
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccccc2[N+](=O)[O-])cc1C,C40092843_decoy,CASP3,Decoy,0,-6.15879,-6.14,-2.22,-5.499368783981622
CSc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093887_decoy,CASP3,Decoy,0,-7.64558,-5.96,-2.54,-4.836051185202561
C=CCOc1cccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCOCCO)c1,C40095049_decoy,CASP3,Decoy,0,-8.4478,-7.85,-3.82,-9.390310698987529
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccncc1)c1cccc(OCc2ccccc2Cl)c1,C40102845_decoy,CASP3,Decoy,0,-9.05416,-8.04,-2.86,-8.009485506555952
Cc1ccc(COc2ccc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@@H]3c3ccncc3)cc2)cc1,C40109910_decoy,CASP3,Decoy,0,-8.11824,-7.1,-1.07,-6.376795696968427
CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])c1C,C13205132_decoy,CASP3,Decoy,0,-7.13997,-7.11,-1.47,-5.091218275937431
CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])c1C,C13205576_decoy,CASP3,Decoy,0,-8.4653,-6.0,-0.8,-6.334684786430736
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)n2CCC(=O)[O-])c1C,C13206663_decoy,CASP3,Decoy,0,-9.09586,-6.45,-1.46,-6.779451785147184
[H]/N=C(C)\C(C(=O)COC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1ccc(OC)cc1)=C(\C)[O-],C58450512_decoy,CASP3,Decoy,0,-8.62763,-7.73,-3.26,-9.352092875321958
CCOc1ccc([C@@H]2c3cc(OCC)c(OCC)cc3CC(=O)N2c2ccc(C(=O)[O-])cc2)cc1OCC,C08590027_decoy,CASP3,Decoy,0,-8.71132,-5.38,-3.15,-6.648458977812987
C[C@@H](O)Cn1c(SCC(=O)N(CCC(N)=O)Cc2ccccc2)nc2cc(C(=O)[O-])ccc2c1=O,C13052607_decoy,CASP3,Decoy,0,-8.9434,-7.63,-1.27,-9.267454726327468
CN(CCCC(=O)[O-])S(=O)(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1,C13066783_decoy,CASP3,Decoy,0,-7.62743,-7.23,-2.5,-5.352128442748697
CCCCCCSc1nnc2c(n1)O[C@H](c1ccc(OCC(=O)[O-])c(OC)c1)Nc1ccccc1-2,C09601819_decoy,CASP3,Decoy,0,-10.1925,-7.34,-3.28,-7.61814335001926
CCCN1C(=O)/C(=C\c2ccc(O[C@@H](CC)C(=O)[O-])c(OCC)c2)S/C1=N\c1nnc(CC)s1,C16919459_decoy,CASP3,Decoy,0,-7.52779,-6.55,-1.0,-7.859755310299122
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccc(C(C)(C)C)cc2)c1C,C08836592_decoy1,CASP3,Decoy,0,-8.38873,-5.89,,-6.908291760387148
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C09328949_decoy,CASP3,Decoy,0,-7.79667,-7.21,-3.6,-7.723407538580547
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCCn2ccnc2)cc1,C09373859_decoy,CASP3,Decoy,0,-8.61373,-6.41,-1.6,-7.486876357910835
CCOc1cc(C(=O)NCc2nnc([S-])n2-c2c(CC)cccc2CC)cc(OCC)c1OCC,C22863987_decoy,CASP3,Decoy,0,-7.74902,-6.92,-1.88,-9.015709135872134
CCCCCOc1ccc([C@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2Cc2ccncc2)cc1OC,C33380821_decoy,CASP3,Decoy,0,-6.63582,-6.5,-1.96,-5.127912082324825
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C33546695_decoy,CASP3,Decoy,0,-8.31731,-5.81,-2.52,-6.629943268861765
CCCCOc1ccc([C@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2CCCn2ccnc2)cc1OC,C33699912_decoy,CASP3,Decoy,0,-7.85196,-7.64,-3.28,-8.40286933657834
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccccc3)[C@@H]2c2cccc(OCC=C)c2)nc1C,C35263435_decoy,CASP3,Decoy,0,-9.27696,-6.43,-3.31,-7.198113867077455
CCCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2Cc2ccco2)cc1,C35420246_decoy,CASP3,Decoy,0,-8.393,-6.32,-2.05,-8.036897000233743
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@H]1c1ccc([N+](=O)[O-])cc1,C35445293_decoy,CASP3,Decoy,0,-8.22091,-6.49,-2.53,-5.929209081138331
CCCCCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCOC)cc1,C35484197_decoy,CASP3,Decoy,0,-9.23237,-5.15,-3.56,-6.763365483702341
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@H]1c1ccc(OC)cc1,C35697002_decoy,CASP3,Decoy,0,-9.93129,-6.54,-4.43,-7.570293469922755
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N(C)Cc3ccccc3)N2[C@H]1c1ccccc1OC,C35701069_decoy,CASP3,Decoy,0,-7.07139,-6.45,-3.81,-7.290862902856415
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@@H]1c1cccc(OC)c1,C35705116_decoy,CASP3,Decoy,0,-9.52087,-6.33,-3.01,-7.721396110168332
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@@H]1c1ccccc1OC,C35705138_decoy,CASP3,Decoy,0,-7.46534,-5.03,-2.3,-6.51677631929975
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N(C)Cc3ccccc3)N2[C@@H]1c1ccc(OC)cc1,C36050102_decoy,CASP3,Decoy,0,-8.76858,-4.91,-3.61,-6.598632582970422
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@@H]1c1cc(OC)cc(OC)c1,C36053184_decoy,CASP3,Decoy,0,-8.57556,-6.57,-4.89,-7.537713450220512
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1cc(OC)cc(OC)c1,C36053201_decoy,CASP3,Decoy,0,-8.96107,-5.12,-1.9,-7.329261375804975
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@H]1c1ccc(OC)cc1OC,C36058695_decoy,CASP3,Decoy,0,-8.80385,-5.64,-1.27,-7.072846512223971
CO[C@H](/C=C/CC/C=C/C(=O)[O-])[C@@H](O)[C@H](C)[C@@H](O)/C(C)=C/[C@@H](C)C(=O)CCCC1CC(=O)NC(=O)C1,C35457110_decoy,CASP3,Decoy,0,-9.57304,-6.82,-2.36,-6.970429575172405
CCOc1ccc([C@H]2c3cc(OCC)c(OCC)cc3CC(=O)N2c2ccc(C(=O)[O-])cc2)cc1OCC,C08606304_decoy,CASP3,Decoy,0,-8.4896,-8.11,-3.13,-7.623382217403889
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2Cc2ccco2)cc1OC,C38256194_decoy,CASP3,Decoy,0,-8.42789,-6.26,-2.78,-6.618546159458445
C=C(C(=O)[O-])[C@@H]1[C@@H]2C=C(C)[C@@H](OC(=O)[C@H](O)C(C)C)C[C@H]2[C@@](C)(O)C[C@@H]1OC(=O)/C(=C/CO)CO,C39560046_decoy,CASP3,Decoy,0,-9.86446,-5.67,-1.77,-7.511218579934456
CCOC(=O)[C@H]1[C@H](C)[C@H](C(=O)OCC)S[C@@H]1NC(=O)CSc1nnc2nc([O-])cc(C(C)C)n12,C39732286_decoy,CASP3,Decoy,0,-7.83525,-7.76,-1.16,-6.904346379766924
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OCCC)cc3)[C@H]2c2ccccc2)nc1C,C39828134_decoy,CASP3,Decoy,0,-10.6964,-5.57,-1.42,-8.63368276557791
CCCCCCOc1ccc(-c2nn(-c3ccccc3)cc2/C=C(C#N)/C([O-])=N/c2nnc(C)s2)cc1,C39997814_decoy,CASP3,Decoy,0,-8.2585,-6.34,-1.5,-7.248195359212679
CCCCOc1ccc(-c2nn(-c3ccccc3)cc2/C=C(C#N)/C([O-])=N/c2nnc(CCC)s2)cc1,C39997861_decoy,CASP3,Decoy,0,-6.70596,-6.06,-4.69,-6.044415945130991
CCCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCOC)cc1,C40003586_decoy,CASP3,Decoy,0,-7.39975,-6.17,-2.53,-7.537197942204035
C=CCN1C(=O)C([O-])=C(C(=O)c2cc3cccc(OC)c3o2)[C@H]1c1ccc(OCCCC)c(OCC)c1,C40028474_decoy,CASP3,Decoy,0,-9.10733,-5.55,-2.34,-6.402271207313017
C=CCN1C(=O)C([O-])=C(C(=O)c2cc3cccc(OC)c3o2)[C@@H]1c1ccc(OCCCC)c(OCC)c1,C40028475_decoy,CASP3,Decoy,0,-8.18395,-7.11,-2.55,-6.820007744745717
CCOc1cc([C@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40075963_decoy,CASP3,Decoy,0,-8.85702,-5.88,-4.21,-7.466155761216796
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40080826_decoy,CASP3,Decoy,0,-7.86178,-6.88,-2.32,-6.723929428952651
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093858_decoy,CASP3,Decoy,0,-8.8253,-7.06,-1.42,-12.976136942425194
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40094025_decoy,CASP3,Decoy,0,-8.34754,-5.78,-1.33,-6.680632397711784
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOCCO)cc1OC,C40095223_decoy,CASP3,Decoy,0,-8.4402,-6.03,-2.34,-7.792002397025407
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40096393_decoy,CASP3,Decoy,0,-8.85062,-7.16,-1.58,-7.382953513250821
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc3c(c2)OCCO3)[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40096854_decoy,CASP3,Decoy,0,-9.33698,-7.14,-2.12,-7.824628498424031
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccco1)c1ccc(OCc2ccccc2Cl)cc1,C40109543_decoy,CASP3,Decoy,0,-8.5822,-7.24,-2.27,-7.255226260573742
CN(C)S(=O)(=O)c1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)cc1,C40110424_decoy,CASP3,Decoy,0,-8.21208,-6.44,-1.99,-7.00811289579331
CCc1ccc([C@@H]2C(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40110449_decoy,CASP3,Decoy,0,-8.09561,-7.4,-1.34,-8.35445192097275
CCCCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCO)cc1OC,C39898017_decoy,CASP3,Decoy,0,-8.10364,-5.68,-5.36,-6.578797534875728
CCOc1cc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC)ccc1OCCC(C)C,C39898303_decoy,CASP3,Decoy,0,-8.86514,-6.73,-2.74,-8.173657313939152
CCOc1ccc(OCC)c(N2C(=O)N=C([O-])/C(=C\c3cc(Cl)c(O[C@@H](C)CC)c(OCC)c3)C2=O)c1,C59104119_decoy,CASP3,Decoy,0,-8.94318,-7.17,-1.98,-6.4294994910471095
CCOC(=O)C1=C(C)[C@@H](C(C)=O)S[C@H]1NC(=O)CSc1nnc(-c2cc(OC)cc(OC)c2)[n-]1,C39975258_decoy,CASP3,Decoy,0,-8.52231,-5.36,-1.46,-6.6732725118803495
CCCCc1ccc(S(=O)(=O)c2cnc(SCC(=O)NCc3ccc(OC)cc3)nc2[O-])cc1,C46016384_decoy,CASP3,Decoy,0,-9.19446,-7.57,-2.57,-6.750308955168863
Cc1cc(N(CCC#N)CCC#N)ccc1C(/N=N/c1ccc(C(=O)[O-])cc1)=N\NC(=O)c1ccccc1,C05580239_decoy,CASP3,Decoy,0,-8.52181,-5.59,-3.08,-6.4991756354201335
CCOC(=O)c1c(NC(=O)CSc2nnc(-c3cccs3)n2CC(=O)[O-])sc(C)c1CC,C13203309_decoy,CASP3,Decoy,0,-8.89811,-6.94,-4.09,-6.660269622505475
COCCOc1cc(NC(=O)/C=C/c2cc(Cl)c(OC(C)C)c(OC)c2)c(C(=O)[O-])cc1OC,C13451205_decoy,CASP3,Decoy,0,-8.77,-6.12,-1.7,-6.663609393067491
CCCOc1c(Cl)cc(/C=C/C(=O)Nc2cc(OCCOC)c(OC)cc2C(=O)[O-])cc1OC,C13451309_decoy,CASP3,Decoy,0,-8.93925,-5.78,-2.11,-6.738908753529606
O=C(CCSc1n[nH]c(N/N=C/c2cc([N+](=O)[O-])ccc2[O-])n1)NC(c1ccccc1)c1ccccc1,C21075598_decoy,CASP3,Decoy,0,-8.5739,-7.41,-2.4,-6.044768265243977
CCCN(C(=O)[C@H](CC(=O)OC)C(=O)[O-])C1=C(C)C[C@H](c2ccccc2)N(Cc2ccc(N)cc2)C1=O,C28869606_decoy,CASP3,Decoy,0,-6.59086,-6.41,-2.12,-5.624611643928304
C=CCn1c([S-])nnc1-c1sc(NC(=O)c2cc(OCC)c(OCC)c(OCC)c2)nc1C,C30671211_decoy,CASP3,Decoy,0,-10.9622,-6.38,-1.34,-10.967046527632792
CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2)N2C(/C=C(\[O-])NCCCN3CCOCC3)=CSC2=N1,C34923209_decoy,CASP3,Decoy,0,-10.5894,-5.78,-2.04,-7.532162219633423
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1cccc(OC)c1,C35696523_decoy,CASP3,Decoy,0,-8.48197,-6.38,-2.36,-7.286212475171019
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@H]1c1cc(OC)cc(OC)c1,C35700941_decoy,CASP3,Decoy,0,-7.32452,-5.77,-2.98,-6.944546599078532
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@@H]1c1cc(OC)cc(OC)c1,C35700943_decoy,CASP3,Decoy,0,-8.15653,-5.16,-1.88,-7.7805384004650895
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@H]1c1cc(OC)cc(OC)c1,C35700969_decoy,CASP3,Decoy,0,-8.73942,-5.77,-2.24,-7.233316335559021
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@@H]1c1cc(OC)cc(OC)c1,C35700971_decoy,CASP3,Decoy,0,-9.65833,-7.38,-1.65,-8.520715970294814
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCN3CCOCC3)N2[C@@H]1c1cccc(OC)c1,C35701805_decoy,CASP3,Decoy,0,-10.1897,-6.66,-1.16,-9.919474096635769
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@H]1c1cccc(OC)c1OC,C35703597_decoy,CASP3,Decoy,0,-9.01178,-4.3,-3.43,-6.451637776749615
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@@H]1c1cccc(OC)c1OC,C35703599_decoy,CASP3,Decoy,0,-8.03332,-6.04,-1.94,-7.590104900857375
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@H]1c1ccc(OC)c(OC)c1,C36058311_decoy,CASP3,Decoy,0,-8.06851,-5.0,-3.28,-6.1439413513862045
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@@H]1c1ccc(OC)c(OC)c1,C36058313_decoy,CASP3,Decoy,0,-9.80218,-5.5,-1.46,-7.997775079512426
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@H]1c1ccc(OC)c(OC)c1,C36058324_decoy,CASP3,Decoy,0,-8.67684,-7.0,-1.31,-6.624033194646421
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@H]1c1ccc(OC)c(OC)c1,C36058613_decoy,CASP3,Decoy,0,-8.29347,-6.63,-2.14,-7.126230301085949
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@@H]1c1ccc(OC)c(OC)c1,C36058630_decoy,CASP3,Decoy,0,-8.86789,-5.49,-2.74,-6.406112387140712
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1cccc(OC)c1OC,C36058727_decoy,CASP3,Decoy,0,-9.62275,-5.53,-2.34,-8.812617116591806
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@H]1c1cccc(OC)c1OC,C36058729_decoy,CASP3,Decoy,0,-10.0989,-6.13,-3.36,-8.035736520374417
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1ccc(OC)cc1OC,C36061116_decoy,CASP3,Decoy,0,-8.98481,-4.93,-3.8,-6.8352303009745965
CCC1=C(C(=O)OC)[C@H](c2ccc(OC)cc2OC)N2C(/C=C(\[O-])NCCN3CCOCC3)=CSC2=N1,C36064530_decoy,CASP3,Decoy,0,-9.91888,-5.43,-2.9,-8.060165736468669
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@@H](c3ccc(OC)c(OC)c3)N12,C36064919_decoy,CASP3,Decoy,0,-7.73729,-4.78,-2.8,-5.907968690124435
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@H](c3cccc(OC)c3OC)N12,C36071698_decoy,CASP3,Decoy,0,-8.87961,-6.56,-2.0,-7.381056476875941
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)C)[C@@H](c3cccc(OC)c3OC)N12,C36071699_decoy,CASP3,Decoy,0,-8.04899,-5.59,-3.35,-6.311724956192268
CCCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596751_decoy,CASP3,Decoy,0,-6.79474,-5.39,-4.92,-5.744314176776437
CCOC(=O)[C@H]1[C@@H](C)[C@H](C(=O)OCC)S[C@@H]1NC(=O)CSc1nc([O-])cc(-c2ccccc2)n1,C39724682_decoy,CASP3,Decoy,0,-9.789,-8.16,-0.97,-7.744657324862979
CCOc1cc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40079312_decoy,CASP3,Decoy,0,-8.91119,-5.34,-2.52,-6.933639769046502
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C(=O)OC)cc2)c(C)c1,C40083581_decoy,CASP3,Decoy,0,-8.52421,-6.58,-2.86,-7.667285376418155
Cc1cc(OCC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccc([N+](=O)[O-])cc1,C40084663_decoy,CASP3,Decoy,0,-8.95895,-6.97,-2.06,-8.931841519382623
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OC)cc2OC)cc1C,C40091522_decoy,CASP3,Decoy,0,-8.58163,-6.21,-1.35,-11.50803670399156
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40091610_decoy,CASP3,Decoy,0,-8.46938,-6.56,-1.59,-9.792587767293984
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OCC)c(OC)c2)cc1C,C40091937_decoy,CASP3,Decoy,0,-8.23591,-6.41,-1.77,-8.808373831966977
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc(Oc3ccccc3)c2)cc1C,C40091946_decoy,CASP3,Decoy,0,-8.04918,-8.56,-3.46,-8.047465808315412
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2OCC=C)cc1C,C40092069_decoy,CASP3,Decoy,0,-8.57649,-7.87,-2.0,-7.788861120007409
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(OCCC(C)C)c(OC)c2)cc1C,C40092159_decoy,CASP3,Decoy,0,-7.55269,-6.66,-3.9,-6.656178193966867
CCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40093154_decoy,CASP3,Decoy,0,-7.82186,-5.36,-4.54,-6.603299361791849
CCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40094019_decoy,CASP3,Decoy,0,-8.06293,-5.91,-3.57,-6.856926362867751
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCO)cc1OC,C40095730_decoy,CASP3,Decoy,0,-8.93584,-7.62,-2.15,-8.74544523391314
CCCCCOc1ccc([C@@H]2C(C(=O)c3cc4cccc(OC)c4o3)=C([O-])C(=O)N2CCOCCO)cc1,C40097803_decoy,CASP3,Decoy,0,-8.23479,-6.5,-3.19,-7.349668661427933
C=CCOc1cccc([C@H]2C(C(=O)c3cc4cccc(OC)c4o3)=C([O-])C(=O)N2CCOCCO)c1,C40097831_decoy,CASP3,Decoy,0,-9.07856,-7.24,-3.11,-9.352635602171707
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40099790_decoy,CASP3,Decoy,0,-6.95082,-6.1,-2.04,-5.499642044654209
CCCCOc1ccccc1[C@@H]1C(C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)=C([O-])C(=O)N1CCO,C40110761_decoy,CASP3,Decoy,0,-7.90727,-6.81,-1.61,-7.426097725709378
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-])c1C,C13405297_decoy,CASP3,Decoy,0,-6.89546,-7.26,-1.62,-6.957305513272347
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(-c3cccs3)n2[C@H](C(=O)[O-])C(C)C)c1C,C13405757_decoy,CASP3,Decoy,0,-9.15674,-6.66,-2.58,-9.772618319180486
COc1cc(/C=C/C(=O)/N=C(\[N-]CCc2c[nH]c3ccccc23)Nc2nc(C)cc(C)n2)cc(OC)c1OC,C14671509_decoy,CASP3,Decoy,0,-8.11349,-6.48,-3.13,-7.579207261267758
CCOC(=O)c1sc(NC(=O)CSc2nc([O-])cc(C(F)(F)F)n2)c(C(=O)OCC)c1C,C12464306_decoy,CASP3,Decoy,0,-9.39911,-7.61,-1.77,-6.933976112685791
O=C([O-])CCCCCNC(=O)/C(=C/c1ccc(Br)cc1)NC(=O)c1ccc(Br)o1,C01768212_decoy,CASP3,Decoy,0,-8.16373,-6.78,-1.66,-7.679604667611031
CCOc1ccc(C(=O)N/N=C/c2cc(I)c(OCC(=O)[O-])c(OCC)c2)cc1,C20764938_decoy,CASP3,Decoy,0,-9.86836,-5.35,-1.66,-8.904760609134003
COc1cc(/C=N/Nc2ccc(S(=O)(=O)[N-]c3cccc(Cl)c3)cc2[N+](=O)[O-])cc(OC)c1OC,C12529147_decoy,CASP3,Decoy,0,-8.22349,-8.25,-4.44,-7.428179244021967
O=C([O-])CC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1,C29563064_decoy,CASP3,Decoy,0,-8.2462,-7.68,-2.56,-6.407949586627464
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@H]1c1ccc(C)cc1C,C34922859_decoy,CASP3,Decoy,0,-9.79298,-5.43,-3.51,-6.774809292691559
CCC1=C(C(=O)OC)[C@@H](c2cccc(F)c2)N2C(/C=C(\[O-])NCCCN3CCOCC3)=CSC2=N1,C34923161_decoy,CASP3,Decoy,0,-11.1329,-6.21,-3.75,-7.799166753373536
CC1=C(C(=O)OC(C)C)[C@H](c2cccc(C)c2)N2C(/C=C(\[O-])NCCCN3CCOCC3)=CSC2=N1,C34923323_decoy,CASP3,Decoy,0,-10.4279,-6.85,-1.41,-10.565781330055792
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCOc3ccccc3)N2[C@@H]1c1ccc(OC)cc1,C34923495_decoy,CASP3,Decoy,0,-7.99997,-5.3,-2.81,-6.189358811017423
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCN3CCOCC3)N2[C@@H]1c1ccc(Cl)cc1,C35697356_decoy,CASP3,Decoy,0,-9.45678,-6.97,-3.34,-8.1706279533427
CCN/C([O-])=C/C1=CSC2=NC(c3ccccc3)=C(C(=O)OCC)[C@@H](c3cc(OC)cc(OC)c3)N12,C35705041_decoy,CASP3,Decoy,0,-8.90174,-6.24,-4.77,-7.492125250627928
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1ccccc1OC,C35705141_decoy,CASP3,Decoy,0,-7.72096,-5.04,-0.86,-6.598712305655028
COc1ccc([C@@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCc4cccnc4)N32)cc1OC,C35705359_decoy,CASP3,Decoy,0,-8.62505,-7.01,-2.93,-7.926309412145799
CCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3cccc(Oc4ccccc4)c3)N12,C36050122_decoy,CASP3,Decoy,0,-8.45322,-5.77,-2.87,-6.574955165355212
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1cc(OC)ccc1OC,C36051063_decoy,CASP3,Decoy,0,-10.288,-6.16,-2.12,-8.232612032017098
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@H]1c1cc(OC)ccc1OC,C36051065_decoy,CASP3,Decoy,0,-10.0394,-6.06,-1.28,-8.024341786300434
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1cc(C)ccc1C,C36061157_decoy,CASP3,Decoy,0,-8.62841,-6.68,-3.57,-7.466659991459532
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@@H]1c1ccc(C)cc1C,C36061164_decoy,CASP3,Decoy,0,-7.2119,-6.11,-1.85,-6.4026245751036805
CC[C@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OC(C)(C)C)[C@H](c3ccc(OC)c(OC)c3)N12,C36061389_decoy,CASP3,Decoy,0,-8.71154,-5.42,-2.17,-6.282110982989119
CCC1=C(C(=O)OC)[C@@H](c2ccccc2OC)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C36063169_decoy,CASP3,Decoy,0,-10.2463,-6.97,-3.78,-8.379997593987936
CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C36063363_decoy,CASP3,Decoy,0,-9.69679,-7.39,-1.74,-8.1617379030709
CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)cc2OC)N2C(/C=C(\[O-])NCc3ccncc3)=CSC2=N1,C36064529_decoy,CASP3,Decoy,0,-9.42482,-7.56,-1.91,-7.709330076850176
CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)cc2OC)N2C(/C=C(\[O-])NCc3ccccn3)=CSC2=N1,C36064555_decoy,CASP3,Decoy,0,-7.7007,-5.2,-2.51,-6.917990585030479
CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2OC)N2C(/C=C(\[O-])NCc3cccnc3)=CSC2=N1,C36064599_decoy,CASP3,Decoy,0,-9.71145,-6.93,-1.9,-8.30713933726362
COc1ccc([C@@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCc4ccncc4)N32)c(OC)c1,C36071665_decoy,CASP3,Decoy,0,-8.09374,-5.7,-1.73,-6.585589005602674
COc1ccc([C@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCc4ccco4)N32)c(OC)c1,C36071668_decoy,CASP3,Decoy,0,-8.48291,-5.38,-2.91,-6.223937440678185
COc1cccc([C@@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NC[C@H]4CCCO4)N32)c1OC,C36071719_decoy,CASP3,Decoy,0,-9.501,-6.2,-2.13,-7.970779686800484
CCOC(=O)[C@@H]1C([O-])=NC(SCC(=O)Nc2c(C)cc(C)cc2C)=C(C#N)[C@@H]1c1ccccc1OCC,C02309831_decoy,CASP3,Decoy,0,-8.42182,-5.55,-2.8,-5.934018444445471
COC(=O)CC[C@@H](C)[C@H]1CC[C@@H]2[C@H]3CC[C@H]4C[C@H](OC(=O)CCC(=O)[O-])CC[C@]4(C)[C@@H]3C[C@H](O)[C@@]21C,C36372109_decoy,CASP3,Decoy,0,-9.06308,-8.34,-1.92,-7.8740911914334015
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1ccccc1O)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499689_decoy,CASP3,Decoy,0,-6.28413,-7.76,-4.27,-7.389351164962481
CCCCNC(=O)[C@H]([C@@H](C)c1ccccc1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596645_decoy,CASP3,Decoy,0,-7.27936,-6.44,-2.63,-6.601043895496478
O=C(NCCCOCc1ccco1)c1cccc([N-]S(=O)(=O)c2ccc(Br)cc2)c1,C40017840_decoy,CASP3,Decoy,0,-8.78395,-7.15,-3.13,-6.406937954501751
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2cccc(OCCC(C)C)c2)cc1C,C40052037_decoy,CASP3,Decoy,0,-9.555,-7.12,-2.51,-8.123636833937852
O=C(C1=C([O-])C(=O)N(CCCO)[C@@H]1c1cccc([N+](=O)[O-])c1)c1ccc(OCc2ccc(Cl)cc2)cc1,C40055136_decoy,CASP3,Decoy,0,-8.22217,-6.78,-1.97,-6.71918969708303
CC(C)(C)c1cc([C@@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCOCCO)cc(C(C)(C)C)c1O,C40075978_decoy,CASP3,Decoy,0,-9.00357,-5.87,-2.57,-6.9278437717381385
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(C)C)cc2)c(C)c1,C40083612_decoy,CASP3,Decoy,0,-9.52477,-6.75,-4.41,-7.918810357065732
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccc(Cl)cc1Cl,C40084303_decoy,CASP3,Decoy,0,-8.97108,-6.48,-2.47,-6.866167112459494
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccccc1Br,C40084323_decoy,CASP3,Decoy,0,-8.52994,-5.93,-1.49,-6.1930073949443605
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cc(Br)ccc2OC)cc1C,C40092875_decoy,CASP3,Decoy,0,-8.09803,-7.25,-0.64,-7.859885916801685
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(C)(C)C)cc2)ccc1OC(C)C,C40093155_decoy,CASP3,Decoy,0,-8.75941,-7.27,-1.98,-8.894986216652487
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(Cl)cc2Cl)ccc1OC(C)C,C40093241_decoy,CASP3,Decoy,0,-8.18695,-5.67,-1.07,-7.032866242560847
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40093430_decoy,CASP3,Decoy,0,-8.1427,-6.34,-1.31,-6.664618287112907
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40093431_decoy,CASP3,Decoy,0,-8.01248,-5.22,-2.83,-6.3079799306579964
CC(C)(C)c1cc([C@@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2CCOCCO)cc(C(C)(C)C)c1O,C40097132_decoy,CASP3,Decoy,0,-9.13095,-6.91,-3.65,-5.833730716664105
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N[C@H]2c2ccc(OCCC(C)C)c(OCC)c2)cc1C,C40124099_decoy,CASP3,Decoy,0,-10.7464,-6.69,-2.33,-10.862442651458297
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@@H]1c1ccccc1Cl,C40400428_decoy,CASP3,Decoy,0,-9.5807,-5.62,-2.6,-7.564288842835667
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@@H]1c1ccc(OC)cc1OC,C40400633_decoy,CASP3,Decoy,0,-9.11087,-5.32,-4.33,-6.293750633553005
CCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2Cc2ccco2)cc1OCC,C39898797_decoy,CASP3,Decoy,0,-7.38445,-6.99,-3.34,-5.91880960839521
COCc1cc(C)nc(N/N=C/c2cc(Cl)c(OCc3ccc(C(=O)[O-])cc3)c(OC)c2)c1C#N,C59641240_decoy,CASP3,Decoy,0,-9.85227,-6.5,-2.2,-6.459080892721401
Cc1ccc(CN/C(=N/c2ccc(C(=O)[O-])cc2)N2CCN(CCOc3ccc(Cl)cc3)CC2)cc1,C21046364_decoy,CASP3,Decoy,0,-8.91137,-6.27,-2.93,-6.371905977294862
CC(C)Cc1ccc([C@@H](C)C(=O)NC(=S)Nc2ccc(S(=O)(=O)[N-]c3nccs3)cc2)cc1,C66199593_decoy,CASP3,Decoy,0,-9.28114,-6.96,-1.37,-8.356910520019397
C=CCn1c(COc2cc(C)ccc2C(C)C)nnc1SCC(=O)Nc1cc(C(=O)[O-])ccc1C,C13347208_decoy,CASP3,Decoy,0,-7.78111,-7.32,-2.69,-6.2720560795898965
C=CCn1c(SCC(=O)NCc2ccc(C(=O)[O-])cc2)nnc1-c1cc2c(s1)CC[C@@H](CC)C2,C13364148_decoy,CASP3,Decoy,0,-9.31573,-7.09,-2.35,-6.62707612753179
COc1ccc(Cc2c(C)nc(NNc3ccc(C(=O)[O-])cc3)n(Cc3cc(C)ccc3C)c2=O)cc1OC,C16885687_decoy,CASP3,Decoy,0,-7.8177,-5.31,-2.11,-6.060613735122244
COc1cc(-c2nnc(CCC(=O)NCc3cccc(C(F)(F)F)c3)c([O-])n2)cc(OC)c1OC,C34767970_decoy,CASP3,Decoy,0,-7.39549,-8.37,-1.94,-6.419660152855273
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@@H]1c1ccc(C)cc1C,C34922858_decoy,CASP3,Decoy,0,-9.05393,-4.87,-2.83,-6.145484852096243
CCC1=C(C(=O)OC)[C@H](c2cccc(F)c2)N2C(/C=C(\[O-])NCCCN3CCOCC3)=CSC2=N1,C34923160_decoy,CASP3,Decoy,0,-10.178,-6.33,-1.4,-8.58408738884736
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCCN3CCOCC3)N2[C@H]1c1ccccc1F,C34924006_decoy,CASP3,Decoy,0,-8.97042,-6.17,-2.65,-8.52000174218692
CC(C)[C@H]1CC[C@@](O)(COC(=O)/C(=C/[C@@H]2C=C(CO)CC[C@@H]2C(C)C)CO)[C@H]2C(=O)OCC(C(=O)[O-])=C[C@H]12,C35458629_decoy,CASP3,Decoy,0,-10.237,-8.16,-2.84,-8.70166914642908
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@@H]1c1ccc(F)cc1,C35693192_decoy,CASP3,Decoy,0,-10.0303,-6.24,-3.59,-7.7116483355473955
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N[C@H](C)c3ccccc3)N2[C@@H]1c1cccs1,C35695873_decoy,CASP3,Decoy,0,-9.64771,-7.26,-3.4,-7.962188110527569
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@@H]1c1ccc(C)cc1,C35696198_decoy,CASP3,Decoy,0,-9.91424,-5.42,-3.03,-7.226560780580339
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc(F)cc3)N2[C@H]1c1ccc(C)cc1,C35696244_decoy,CASP3,Decoy,0,-9.42079,-6.46,-4.26,-7.371204944672858
CCC1=C(C(=O)OC)[C@H](c2ccc([N+](=O)[O-])cc2)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C35704529_decoy,CASP3,Decoy,0,-8.927,-5.82,-1.72,-6.856632321414696
CCN/C([O-])=C/C1=CSC2=NC(c3ccccc3)=C(C(=O)OCC)[C@H](c3cccc(OC)c3OC)N12,C35705064_decoy,CASP3,Decoy,0,-9.04716,-5.33,-3.62,-6.645999868002235
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@@H]1c1ccccc1OC,C35705140_decoy,CASP3,Decoy,0,-7.55665,-6.57,-1.71,-6.941183969071098
CCC1=C(C(=O)OC)[C@H](c2ccc(OC)c(OC)c2)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C35705212_decoy,CASP3,Decoy,0,-8.47424,-7.01,-2.5,-8.0353625840525
COc1ccc([C@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NC[C@@H]4CCCO4)N32)cc1OC,C35705362_decoy,CASP3,Decoy,0,-9.36088,-5.38,-1.85,-8.270138653468761
COc1cccc([C@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCCc4ccccn4)N32)c1,C35709628_decoy,CASP3,Decoy,0,-9.09681,-5.97,-2.89,-8.990782623498204
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1ccccc1Cl,C36050081_decoy,CASP3,Decoy,0,-9.68026,-6.38,-1.18,-10.3304273707505
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1cccc(OC)c1,C36050364_decoy,CASP3,Decoy,0,-9.76321,-6.13,-2.92,-7.663390753652826
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@@H]1c1cc(OC)ccc1OC,C36051068_decoy,CASP3,Decoy,0,-8.60654,-5.66,-3.14,-6.856839892883467
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1ccc(Cl)cc1,C36052673_decoy,CASP3,Decoy,0,-9.08158,-5.19,-4.06,-6.429650855978143
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@@H]1c1ccccc1OC,C36064406_decoy,CASP3,Decoy,0,-9.57223,-5.05,-1.66,-7.457490508343715
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@H]1c1cc(C)ccc1C,C36064415_decoy,CASP3,Decoy,0,-8.05874,-5.49,-2.8,-6.0435071990825655
CCC1=C(C(=O)OC)[C@H](c2cccc(OC)c2OC)N2C(/C=C(\[O-])NCc3ccco3)=CSC2=N1,C36064586_decoy,CASP3,Decoy,0,-8.29794,-6.39,-2.51,-7.1545570334985245
CCC1=C(C(=O)OC)[C@H](c2cccc(OC)c2OC)N2C(/C=C(\[O-])NCc3ccccn3)=CSC2=N1,C36064596_decoy,CASP3,Decoy,0,-9.74373,-6.94,-1.52,-8.287748034058323
CCC1=C(C(=O)OC)[C@H](c2cc(OC)ccc2OC)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C36064645_decoy,CASP3,Decoy,0,-8.77801,-5.76,-2.92,-7.014011144805899
COc1cccc([C@H]2C(C(=O)OC(C)(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NC[C@H]4CCCO4)N32)c1OC,C36064787_decoy,CASP3,Decoy,0,-8.59639,-5.8,-3.8,-5.601331124786096
COc1ccc([C@H]2C(C(=O)OC(C)C)=C(C)N=C3SC=C(/C=C(\[O-])NCc4ccncc4)N32)c(OC)c1,C36071664_decoy,CASP3,Decoy,0,-8.36287,-5.13,-2.12,-5.948457086818605
COC(=O)CC[C@@H](C)[C@@H]1CC[C@@H]2[C@H]3CC[C@H]4C[C@H](OC(=O)CCC(=O)[O-])CC[C@]4(C)[C@@H]3C[C@H](O)[C@@]21C,C36372108_decoy,CASP3,Decoy,0,-9.19575,-8.0,-1.78,-10.562543356013908
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1ccccc1O)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499688_decoy,CASP3,Decoy,0,-7.31911,-7.99,-3.78,-10.130075382607505
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1ccccc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499736_decoy,CASP3,Decoy,0,-7.40473,-7.18,-3.81,-7.551997732218236
CCCCC[C@H]1NN=C(/N=C(\[O-])[C@H](C)SCC2=NC(=O)C3=C(c4ccccc4)CSC3=N2)S1,C38785170_decoy,CASP3,Decoy,0,-11.5913,-7.96,-1.55,-7.186289891702989
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccc(Cl)cc3)cc2)[C@@H]1c1ccc(O)c(OCC)c1,C40030708_decoy,CASP3,Decoy,0,-8.51213,-7.3,-1.7,-6.656110336336979
O=C(C1=C([O-])C(=O)N(CCCO)[C@H]1c1cccc([N+](=O)[O-])c1)c1cccc(OCc2ccc(Cl)cc2)c1,C40054833_decoy,CASP3,Decoy,0,-9.72146,-7.52,-1.88,-7.659758775448322
O=C(C1=C([O-])C(=O)N(CCCO)[C@H]1c1cccc([N+](=O)[O-])c1)c1ccc(OCc2ccc(Cl)cc2)cc1,C40055137_decoy,CASP3,Decoy,0,-7.41964,-7.46,-1.17,-6.402412468358486
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(Cl)c(Cl)c2)cc1,C40079023_decoy,CASP3,Decoy,0,-8.56307,-6.32,-0.83,-7.36472627606269
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccc(Br)c1,C40084194_decoy,CASP3,Decoy,0,-8.80482,-6.4,-2.43,-7.084026532002061
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(Cl)c(Cl)c1,C40084204_decoy,CASP3,Decoy,0,-8.57044,-7.0,-2.87,-7.22924532483942
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(Br)cc1,C40084206_decoy,CASP3,Decoy,0,-7.53719,-7.01,-1.07,-7.18799482097931
Cc1cc(OC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(Cl)cc1Cl,C40084304_decoy,CASP3,Decoy,0,-9.26594,-8.01,-4.05,-10.116149979384485
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(Cl)cc2Cl)cc1C,C40085630_decoy,CASP3,Decoy,0,-8.38213,-7.81,-2.43,-9.774271563784222
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C(C)C)cc2)cc1C,C40092628_decoy,CASP3,Decoy,0,-7.92308,-7.48,-1.4,-7.447168627059325
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(Cl)cc2Cl)ccc1OC(C)C,C40093243_decoy,CASP3,Decoy,0,-8.68077,-5.48,-0.86,-6.98806983618861
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)s1,C40098718_decoy,CASP3,Decoy,0,-9.8356,-5.97,-4.01,-8.127660308834104
CCOc1cc([C@@H]2NC(=O)C([O-])=C2C(=O)c2cc(C)c(OCC(C)C)c(C)c2)ccc1OCCC(C)C,C40124261_decoy,CASP3,Decoy,0,-10.0949,-8.3,-2.58,-9.866539525553971
COc1cc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCO)ccc1OCCC(C)C,C39898067_decoy,CASP3,Decoy,0,-8.07578,-7.02,-1.85,-7.066894188499767
CCCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2Cc2ccco2)cc1OC,C39898734_decoy,CASP3,Decoy,0,-7.72033,-7.88,-1.75,-8.47416669849081
CCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2Cc2ccco2)cc1OCC,C39898798_decoy,CASP3,Decoy,0,-8.13274,-6.1,-2.09,-7.494138808207543
CCOc1ccc([C@H](C)NC(=O)c2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc2Cl)cc1OCC,C44850548_decoy,CASP3,Decoy,0,-9.94939,-7.71,-3.63,-7.944092176850427
CC(=O)OCCCCC1=C(C)[C@@H]2[C@@H](C[C@@H]3[C@@H]4CC[C@H]5C[C@@H](OC(=O)CCC(=O)[O-])CC[C@]5(C)[C@@H]4CC[C@@]32C)O1,C12660561_decoy,CASP3,Decoy,0,-10.405,-9.07,-3.19,-8.915963238878913
CCCCCCOc1ccc([C@H]2C(C(=O)c3cc4cccc(OC)c4o3)=C([O-])C(=O)N2Cc2ccco2)cc1,C33522390_decoy,CASP3,Decoy,0,-7.81513,-7.77,-3.87,-7.181255566424409
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C33546504_decoy,CASP3,Decoy,0,-8.73909,-6.3,-3.41,-8.04294300025347
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCc2ccccc2)cc1OCC,C33546697_decoy,CASP3,Decoy,0,-8.05863,-6.26,-2.31,-5.220878050359484
CCCCCOc1ccc([C@@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2CCc2ccccc2)cc1OC,C33670355_decoy,CASP3,Decoy,0,-8.67537,-5.97,-4.14,-7.127879015259012
CCCCOc1ccc([C@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2CCc2ccccc2)cc1OC,C33671803_decoy,CASP3,Decoy,0,-7.8675,-7.75,-3.46,-7.991219472195241
CCCCCOc1ccc([C@@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2Cc2ccccc2)cc1OC,C33675056_decoy,CASP3,Decoy,0,-8.40017,-6.6,-1.43,-8.109396626502564
CCCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCc2ccccc2)cc1OCC,C35445023_decoy,CASP3,Decoy,0,-8.09033,-6.32,-2.15,-6.170440109169361
CCCOc1ccc([C@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCc2ccccc2)cc1OCC,C35445025_decoy,CASP3,Decoy,0,-6.85905,-5.94,-1.56,-7.076924948809039
CCCCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCc2ccccc2)cc1OCC,C35445031_decoy,CASP3,Decoy,0,-8.1836,-5.8,-1.83,-6.400892544081577
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@H]1c1ccc(C(C)C)cc1,C35445519_decoy,CASP3,Decoy,0,-7.96857,-6.06,-3.22,-6.340615671518149
CCCCCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2Cc2ccco2)cc1,C35484697_decoy,CASP3,Decoy,0,-8.21441,-5.77,-2.63,-6.102594234786658
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N(CC)CC)N2[C@H]1c1cccc(OCc2ccccc2)c1,C35693545_decoy,CASP3,Decoy,0,-8.62392,-7.1,-3.87,-8.237675879984089
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N(CC)CC)N2[C@@H]1c1cccc(OCc2ccccc2)c1,C35693547_decoy,CASP3,Decoy,0,-8.20525,-5.74,-1.98,-6.975684895922979
C[C@H](c1ccccc1)[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499708_decoy,CASP3,Decoy,0,-7.7018,-6.49,-2.92,-6.868511096034732
CCCCNC(=O)[C@@H](C(c1ccccc1)c1ccccc1)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])C(C)(C)C,C36585818_decoy,CASP3,Decoy,0,-7.02311,-6.03,-4.7,-6.975224304572556
CCC/C=C/[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596656_decoy,CASP3,Decoy,0,-7.18364,-5.82,-2.92,-6.71817141223008
CCC(CC)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596676_decoy,CASP3,Decoy,0,-7.33437,-6.32,-4.83,-6.504907497260509
COC(=O)c1ccc2c(c1)c(C[N-]S(=O)(=O)Oc1ccccc1)cn2C[C@H](CC(C)C)c1ccccc1,C39491610_decoy,CASP3,Decoy,0,-8.62733,-8.48,-2.36,-8.038182874983736
COC(=O)c1ccc2c(c1)c(C[N-]S(=O)(=O)Oc1ccccc1)cn2C[C@@H](CC(C)C)c1ccccc1,C39491611_decoy,CASP3,Decoy,0,-9.03663,-7.7,-4.23,-7.704690449787226
CCCCOc1ccc(/C=C(C#N)/C([O-])=N/c2nnc(SCc3ccc(Cl)cc3)s2)cc1OC,C39997427_decoy,CASP3,Decoy,0,-8.64477,-6.63,-1.8,-6.873661588737101
CCCOc1ccc(/C=C(C#N)/C([O-])=N/c2nnc(SCc3ccc(Cl)cc3)s2)cc1OCC,C39997472_decoy,CASP3,Decoy,0,-10.0498,-6.58,-1.76,-6.685788740434104
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1,C39999800_decoy,CASP3,Decoy,0,-8.99118,-7.05,-2.04,-9.84126883065796
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1,C39999801_decoy,CASP3,Decoy,0,-8.48592,-6.02,-4.9,-6.120436888706244
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCCCC)s3)[C@H]2c2ccccc2)cc1,C40003212_decoy,CASP3,Decoy,0,-9.48842,-6.15,-2.64,-6.334507094801625
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(Br)cc2)[C@@H]1c1ccc(OCCCCCC)c(OC)c1,C40026097_decoy,CASP3,Decoy,0,-8.40147,-5.61,-1.68,-7.608657062826833
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCC)c(C)c2)[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40027332_decoy,CASP3,Decoy,0,-8.04249,-5.85,-4.0,-7.53854625661272
C=CCOc1ccccc1[C@@H]1C(C(=O)c2cccc(OCc3ccc(Cl)cc3)c2)=C([O-])C(=O)N1CC=C,C40030270_decoy,CASP3,Decoy,0,-7.88774,-6.48,-3.75,-6.389578496637215
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccc(Cl)cc3)cc2)[C@H]1c1ccc(N(CC)CC)cc1,C40030806_decoy,CASP3,Decoy,0,-9.18744,-6.49,-1.85,-6.591840624688591
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccc(Cl)cc3)cc2)[C@@H]1c1ccccc1OCCC,C40030822_decoy,CASP3,Decoy,0,-8.66966,-6.12,-1.32,-5.8516618124733775
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCCO)cc1,C40052678_decoy,CASP3,Decoy,0,-9.35124,-7.32,-3.33,-10.144599948318254
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCCC)cc1OC,C40079536_decoy,CASP3,Decoy,0,-7.20174,-5.41,-2.5,-6.337689706616144
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OC,C40085050_decoy,CASP3,Decoy,0,-8.67305,-5.78,-2.27,-6.955079589556505
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OCC)c(OCC)c2)cc1C,C40092010_decoy,CASP3,Decoy,0,-8.27749,-5.58,-2.31,-6.5843783838725
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCCCC)c(C)c3)=C([O-])C(=O)N2CCO)cc1,C40092827_decoy,CASP3,Decoy,0,-8.58654,-5.04,-1.55,-6.124375966799925
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc1C,C40092872_decoy,CASP3,Decoy,0,-8.16723,-6.34,-3.71,-5.973958242509259
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc1C,C40092874_decoy,CASP3,Decoy,0,-8.27451,-5.72,-1.83,-6.12960124898323
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCCC)cc1OCC,C40094243_decoy,CASP3,Decoy,0,-9.29394,-5.61,-4.94,-7.525405018533538
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCCC)cc1OC,C40095837_decoy,CASP3,Decoy,0,-8.74512,-7.3,-1.77,-8.65760612017908
CCOc1cc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40098657_decoy,CASP3,Decoy,0,-8.26681,-6.13,-2.26,-8.55212315635592
CCCCN1C(=O)c2n[nH]c(-c3cc(Cl)ccc3[O-])c2[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C39898506_decoy,CASP3,Decoy,0,-8.32517,-6.09,-3.48,-8.478989900954506
CCCCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCC)cc1OC,C39898513_decoy,CASP3,Decoy,0,-8.00286,-6.11,-3.9,-7.9630676352883105
CCCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCCC)cc1OC,C39898534_decoy,CASP3,Decoy,0,-8.78817,-6.21,-1.63,-7.3308846200611315
CCCCCOc1cccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC(C)C)c1,C39899331_decoy,CASP3,Decoy,0,-9.74068,-6.38,-2.17,-9.608019955918136
CCCCCCOc1ccc(/C=C(C#N)/C([O-])=N/c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1OC,C40866783_decoy,CASP3,Decoy,0,-7.43871,-6.95,-2.35,-5.597361922112382
CCOC(=O)C1=C([O-])/C(=C/c2ccc(OCC(=O)OC)c(Cl)c2)S/C1=N\c1ccc(OCC)cc1,C59105522_decoy,CASP3,Decoy,0,-9.58602,-6.02,-1.74,-6.589356605650631
CCOC(=O)C1=C([O-])/C(=C/c2cc(OCC)c(OCC)cc2Cl)S/C1=N\c1ccc(OCC)cc1,C59247260_decoy,CASP3,Decoy,0,-8.38921,-7.11,-1.94,-6.927923688051727
CCOC(=O)C1=C([O-])/C(=C/c2cc(Cl)c(OCC)c(OCC)c2)S/C1=N\c1ccc(OCC)cc1,C59364636_decoy,CASP3,Decoy,0,-8.4257,-5.76,-2.55,-6.620817230117249
CCCCc1nc(Cl)c(C(=O)[O-])n1Cc1ccc(-c2ccccc2-c2nnn([C@@H](C)OCC)n2)cc1,C65740882_decoy,CASP3,Decoy,0,-8.76395,-7.84,-3.72,-8.45865525850081
CCCCc1nc(Cl)c(C(=O)[O-])n1Cc1ccc(-c2ccccc2-c2nnn([C@H](C)OCC)n2)cc1,C65740888_decoy,CASP3,Decoy,0,-9.21305,-7.12,-4.76,-8.532775474871181
Cc1nnc(SCC(=O)Nc2cc(NC(=O)CSc3nnc(C)s3)cc(C(=O)[O-])c2)s1,C02746817_decoy,CASP3,Decoy,0,-9.44731,-6.56,-1.56,-8.496374455795515
CCOC(=O)CNC(=O)CC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)[O-],C01675887_decoy,CASP3,Decoy,0,-7.67779,-6.34,-0.27,-6.953560045188191
CN(C)c1cccc2c(S(=O)(=O)N[C@H](CCCNC(N)=O)C(=O)[O-])cccc12,C04517192_decoy,CASP3,Decoy,0,-8.4149,-7.72,-1.52,-8.943110658681254
CCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)N[C@H](Cc3c[nH]c4ccc(O)cc34)C(=O)[O-])ccc12,C02133641_decoy,CASP3,Decoy,0,-6.58903,-7.91,-2.23,-6.0942100151652765
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CCC(C(=O)N[C@@H](C)C(=O)[O-])CC2)cc1,C08918249_decoy,CASP3,Decoy,0,-7.01583,-7.65,-2.9,-7.854882637287522
COc1cc(C2=NO[C@@](CC(=O)[O-])(C(=O)NC3CCCCC3)C2)ccc1OCC(N)=O,C09348662_decoy,CASP3,Decoy,0,-7.99225,-7.91,-0.15,-7.676112387659383
CCCc1nnc(S[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)n1CC(=O)[O-],C12778953_decoy,CASP3,Decoy,0,-7.07106,-7.24,-0.39,-6.90061956578547
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NCCNC(C)=O)c1OC,C13071393_decoy,CASP3,Decoy,0,-7.19932,-6.55,-0.69,-6.7157956223606
CNS(=O)(=O)c1cc(NS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)ccc1C,C13196383_decoy,CASP3,Decoy,0,-7.82128,-6.23,-1.47,-5.448833344586251
CCCc1nnc(SCC(=O)Nc2sccc2C(N)=O)n1CC(=O)[O-],C13202338_decoy,CASP3,Decoy,0,-8.03902,-6.69,-1.38,-6.232970185891591
NC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1CCC(=O)[O-],C13206537_decoy,CASP3,Decoy,0,-9.0503,-6.89,-1.81,-8.158065550189129
O=C([O-])CCn1c(SCC(=O)NNC(=O)c2ccco2)nnc1-c1ccc(F)cc1,C13233196_decoy,CASP3,Decoy,0,-7.6512,-6.75,-3.2,-6.648845919294602
O=C(CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-])NCCC1=CCCCC1,C13235004_decoy,CASP3,Decoy,0,-7.83901,-7.36,-1.67,-7.599395954610643
Cc1ccc(C)c(NC(=O)CN(C)C(=O)CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1,C13235249_decoy,CASP3,Decoy,0,-7.07381,-8.47,-2.57,-7.563737872964662
Cc1ccccc1CCNC(=O)CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13236604_decoy,CASP3,Decoy,0,-8.67381,-8.05,-1.19,-7.719192780754967
CCOCCCNC(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13237320_decoy,CASP3,Decoy,0,-7.54632,-6.41,-1.04,-6.511209814154218
C=C(C)CN(CC)C(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13237366_decoy,CASP3,Decoy,0,-7.41912,-6.15,-1.34,-6.460843282108289
CCCCCNC(=O)CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13237656_decoy,CASP3,Decoy,0,-7.88699,-5.68,-1.18,-5.879741308658078
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(NCCCO)c([N+](=O)[O-])c2)cc1,C13276963_decoy,CASP3,Decoy,0,-7.35979,-7.12,-1.09,-6.807074314417831
CCCCn1c(N)c(N(C)C(=O)/C=C/c2ccc(CCC(=O)[O-])o2)c(=O)[nH]c1=O,C13407445_decoy,CASP3,Decoy,0,-6.91799,-5.64,-1.41,-5.175975114107675
CCCCCCN1C(=O)NC(=O)/C(=C/N[C@@H](Cc2cnc[nH]2)C(=O)[O-])C1=O,C20567545_decoy,CASP3,Decoy,0,-6.77152,-5.45,-1.55,-6.411161451786965
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,C22059906_decoy,CASP3,Decoy,0,-5.74049,-7.54,-3.15,-6.556892505670596
Cc1nc(S[C@H](C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)sc1CC(N)=O,C24901934_decoy,CASP3,Decoy,0,-9.31499,-7.21,-3.92,-7.980670439163612
CC[C@@H](C)[C@@H](NC(=O)CNC(=O)CCc1c(C)c2ccc(O)c(C)c2oc1=O)C(=O)[O-],C15954467_decoy,CASP3,Decoy,0,-6.2853,-8.48,-2.04,-8.089243338085877
C[C@@H](O)CCC[C@@H](O)/C=C/[C@@H]1[C@@H](CCCCCCC(=O)[O-])[C@@H](O)C[C@H]1O,C27642329_decoy,CASP3,Decoy,0,-7.29023,-5.93,-1.86,-5.949916959402568
O=C([O-])C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31156079_decoy,CASP3,Decoy,0,-7.41334,-6.05,-1.9,-5.499872336100088
O=C([O-])C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,C31156088_decoy,CASP3,Decoy,0,-5.92625,-6.3,-0.98,-5.160236800679218
O=C([O-])Cn1cc([C@@H](C(=O)[O-])[NH+]2CCN(CC(=O)NC[C@@H]3CCCO3)CC2)c2ccccc21,C36353600_decoy,CASP3,Decoy,0,-7.07846,-8.31,-0.69,-7.446306511024676
CC(=O)c1cn(CC(=O)N[C@H](CCCNC(N)=O)C(=O)[O-])c2ccccc12,C36369878_decoy,CASP3,Decoy,0,-8.00458,-6.98,-1.77,-7.082141185974532
CCCCCCn1c(=O)[nH]c([O-])c(/C=N/[C@H](C[C@H]2C=[NH+]C=N2)C(=O)[O-])c1=O,C39024699_decoy,CASP3,Decoy,0,-7.02244,-5.32,-0.86,-5.6226482589391225
N#CC1=C(N)N=N[C@H]1CCCNS(=O)(=O)c1ccc(CCC(=O)[O-])cc1,C39679877_decoy,CASP3,Decoy,0,-7.35489,-5.88,-1.57,-6.179122294419267
O=C(CS[C@@H]1N=N[C@H](c2ccccc2F)N1C1CC1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39680330_decoy,CASP3,Decoy,0,-8.86895,-7.32,-1.16,-8.329684643551621
O=C(CS[C@H]1NN[C@@H](c2ccco2)N1c1ccccc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39691639_decoy,CASP3,Decoy,0,-8.2231,-7.51,-2.34,-8.471979407429808
O=C(CS[C@@H]1NN[C@H](C2CC2)N1C1CC1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39692852_decoy,CASP3,Decoy,0,-8.76546,-6.36,-1.35,-6.559243261830751
Cc1ccc([C@H]2NN=C(SCC(=O)NCCc3c[nH]c4ccccc34)N2CC(=O)[O-])cc1,C39715658_decoy,CASP3,Decoy,0,-6.74319,-7.59,-1.9,-9.107682666827984
NC(=O)COc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCCO)cc1,C40046418_decoy,CASP3,Decoy,0,-9.16876,-5.66,-1.97,-7.453122067585571
NC(=O)COc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCCO)cc1,C40047707_decoy,CASP3,Decoy,0,-9.37155,-5.7,-5.02,-7.116439003605226
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(O)c(OCC)c2)c1,C40102075_decoy,CASP3,Decoy,0,-9.34521,-6.54,-1.8,-8.016254513889438
NC(=O)NCCC[C@@H](NC(=O)CCn1ccc2c(Br)cccc21)C(=O)[O-],C40308956_decoy,CASP3,Decoy,0,-7.37999,-7.05,-1.64,-7.23229964914858
O=C([O-])C[C@]1(C(=O)[O-])[NH2+][C@H](c2cccc(OC(F)(F)F)c2)[C@@H]2C(=O)N(CCCCO)C(=O)[C@H]21,C33928473_decoy,CASP3,Decoy,0,-7.10024,-6.04,-0.26,-6.36473060471417
CCCOCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CC(=O)[O-])(C(=O)[O-])[NH2+][C@H]2c1ccccc1C,C43218418_decoy,CASP3,Decoy,0,-5.42844,-5.18,-1.19,-4.783749234282493
CN(Cc1cnn(-c2ccccc2)c1)C(=O)CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C13237125_decoy,CASP3,Decoy,0,-6.91715,-7.0,-3.27,-6.113976883288332
CC(=O)Nc1ccc(N/C([O-])=C(\C#N)C(=O)CCCNc2ncccn2)cc1,C51450538_decoy,CASP3,Decoy,0,-8.36464,-6.06,-2.89,-6.96403277250792
COC(=O)/C(F)=C(/N[C@@H](CC(C)C)C(=O)OC)c1c([O-])[nH]c(=S)[nH]c1=O,C54500770_decoy,CASP3,Decoy,0,-8.81695,-5.6,-0.18,-6.765700691237995
NC(=O)CC[C@H](NC(=O)Cc1csc(-c2cccc(CN3CCOCC3)c2)n1)C(=O)[O-],C62048422_decoy,CASP3,Decoy,0,-8.64893,-6.55,-0.23,-5.637854406156801
O=C([O-])CNC(=O)CNC(=O)Cc1csc(-c2cccc(CN3CCOCC3)c2)n1,C62048457_decoy,CASP3,Decoy,0,-7.30911,-6.9,-1.46,-7.095256573200151
CCOc1ccc(-c2c(C)sc3nc(C)nc(N[C@@H](CCC(N)=O)C(=O)[O-])c23)cc1,C62049089_decoy,CASP3,Decoy,0,-7.37527,-4.97,-1.8,-5.826063082541999
CCCS(=O)(=O)[N-]c1ccc(N[C@H](C)C(=O)NC(=O)NCCOC)cc1,C63632722_decoy,CASP3,Decoy,0,-5.85997,-6.41,-1.37,-6.7314928496999125
CCCCNC(=O)NNS(=O)(=O)c1cc(OC)c(OC)c(C(=O)[O-])c1,C64375374_decoy,CASP3,Decoy,0,-7.3039,-7.51,-4.41,-6.998333553336389
CCOCCCNC(=O)NNS(=O)(=O)c1cc(C(=O)[O-])cc(C)c1C,C67124599_decoy,CASP3,Decoy,0,-7.51745,-7.23,-3.31,-7.214224728443894
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](OP(=O)([O-])[O-])[C@@H](O)[C@H]2O)[C@@H](C)Cl)[NH+](C)C1,C04536296_decoy,CASP3,Decoy,0,-7.26127,-5.18,-1.3,-6.369133073330066
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@@H](SC)[C@@H](OP(=O)([O-])[O-])[C@@H](O)[C@@H]2O)[C@@H](C)Cl)[NH+](C)C1,C11615964_decoy,CASP3,Decoy,0,-8.01774,-5.28,-3.16,-5.933899751224371
CCc1ccccc1NC(=S)N/N=C(\C)c1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1,C13026041_decoy,CASP3,Decoy,0,-8.9667,-7.38,-3.38,-6.939877079246801
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)NCCc1ccc(Cl)cc1Cl,C13045521_decoy,CASP3,Decoy,0,-8.20742,-7.2,-2.15,-6.552514198120019
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)Nc1cccc(C(=O)NC2CC2)c1,C13047096_decoy,CASP3,Decoy,0,-7.51677,-6.62,-1.84,-7.597153636788899
CCc1ccc(Cl)c(CC)c1NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO,C13047145_decoy,CASP3,Decoy,0,-8.79969,-7.11,-1.92,-8.141481378721233
C[C@H](Sc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O)C(=O)NCCC1=CCCCC1,C13051809_decoy,CASP3,Decoy,0,-8.17402,-4.8,-3.59,-6.1222668053430604
C[C@H](O)Cn1c(S[C@H](C)C(=O)NCCC2=CCCCC2)nc2cc(C(=O)[O-])ccc2c1=O,C13051814_decoy,CASP3,Decoy,0,-8.78484,-5.82,-3.01,-6.663711336359047
C/C(=N\NC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1,C13061106_decoy,CASP3,Decoy,0,-9.11941,-7.35,-5.4,-6.659296621494522
CCOc1ccc(-c2nnc(SCC(=O)NC(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)n2CC(=O)[O-])cc1,C13195820_decoy,CASP3,Decoy,0,-8.02358,-6.95,-3.3,-6.309319428665204
Cc1ccc(-c2nnc(SCC(=O)Nc3ccccc3C(=O)NC3CCCC3)n2CC(=O)[O-])cc1,C13205868_decoy,CASP3,Decoy,0,-6.9526,-6.78,-0.65,-8.189607347650393
Cc1cc(C)c(NC(=O)CNC(=O)CSc2nc3nc(C)c(CCC(=O)[O-])c(C)n3n2)c(C)c1,C13210538_decoy,CASP3,Decoy,0,-8.32941,-7.63,-1.56,-7.189190052463584
CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C(=O)NCC(=O)[O-])cc1[N+](=O)[O-],C13211388_decoy,CASP3,Decoy,0,-7.46213,-7.21,-3.41,-6.7726812161163545
CC(C)NC(=O)CNC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1Cc1ccco1,C13231936_decoy,CASP3,Decoy,0,-8.20313,-6.92,-1.21,-7.879644371324602
CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)n2)s1,C13239825_decoy,CASP3,Decoy,0,-9.59425,-7.28,-3.38,-7.572078930044814
C[C@H](C(=O)[O-])n1c(SCC(=O)N(CCC(N)=O)c2ccccc2Cl)nc2ccccc2c1=O,C13245255_decoy,CASP3,Decoy,0,-8.3732,-8.03,-2.41,-8.446536735491541
C[C@H](CCCOC(=O)CCC(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4CC(=O)CC[C@]4(C)[C@@H]3C[C@H](O)[C@]12C,C22061736_decoy,CASP3,Decoy,0,-9.31523,-7.12,-2.63,-6.666180002115097
CC(=O)c1ccc(NC(=O)CSc2nc([O-])cc(CC(=O)NCc3cccs3)n2)cc1,C22629388_decoy,CASP3,Decoy,0,-10.4766,-6.63,-1.46,-6.256316871624822
O=C(CCn1c([S-])nnc1-c1cccs1)NCCNc1ncc(C(F)(F)F)cc1Cl,C24600897_decoy,CASP3,Decoy,0,-9.6994,-6.99,-2.81,-8.930990889767038
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=S)NC(=O)CCC3CCCCC3)cc2)n1,C14028869_decoy,CASP3,Decoy,0,-8.4462,-7.26,-1.01,-6.919237892371633
C[C@H](CCCOC(=O)CCC(=O)[O-])[C@@H]1CC[C@H]2[C@H]3[C@H](O)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@@]21C,C35644788_decoy,CASP3,Decoy,0,-10.1462,-7.72,-2.61,-8.721453406970756
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NC(C)(C)C)c1ccc(O)c(OC)c1,C36570320_decoy,CASP3,Decoy,0,-6.64871,-5.96,-3.47,-6.368627707452388
O=C(CCn1c([S-])nnc1-c1cccs1)NNC(=O)c1ccc(COc2ccccc2)o1,C36625164_decoy,CASP3,Decoy,0,-9.83017,-8.28,-1.77,-9.580492828405026
COc1ccc(CCN2C(=O)[C@@](NS(=O)(=O)c3ccc(N)cc3)(C(F)(F)F)N=C2[O-])cc1OC,C02871752_decoy,CASP3,Decoy,0,-7.4235,-7.07,-3.89,-6.409651312093283
CSCC[C@@H](NC(=O)/C(=C/c1ccco1)NC(=O)c1ccc(Br)o1)C(=O)[O-],C08721648_decoy,CASP3,Decoy,0,-9.35651,-7.31,-1.75,-7.530569247163572
CSCC[C@H](NC(=O)/C(=C/c1ccco1)NC(=O)c1ccc(Br)o1)C(=O)[O-],C08721647_decoy,CASP3,Decoy,0,-9.35793,-6.07,-1.88,-8.073922525973707
CCOC(=O)[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)CSc1nnc(-c2ccccc2NC(C)=O)c([O-])n1,C39252636_decoy,CASP3,Decoy,0,-10.7106,-7.74,-0.33,-8.581062112481009
C=CCN1C(=O)C2=CCSC2=N[C@H]1SCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39691833_decoy,CASP3,Decoy,0,-10.0502,-7.89,-2.88,-8.378070207447811
CC(C)CCNC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13051735_decoy,CASP3,Decoy,0,-8.76718,-7.29,-1.3,-7.504009859080091
C[C@H](O)CN1C(=O)c2ccc(C(=O)[O-])cc2N[C@H]1SCC(=O)NCCc1c[nH]c2ccccc12,C39698619_decoy,CASP3,Decoy,0,-8.08334,-7.01,-4.45,-7.589171686582931
CC(C)[C@H](NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O)c1cccs1,C13052589_decoy,CASP3,Decoy,0,-9.68735,-7.3,-2.66,-7.583755377009891
NC(=O)CC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)SC1=S,C39862128_decoy,CASP3,Decoy,0,-10.7977,-6.0,-3.09,-9.622946194030032
O=C(CCN1C(=O)/C(=C\C=C/c2ccccc2)SC1=S)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-],C39910095_decoy,CASP3,Decoy,0,-7.07056,-7.73,-1.45,-8.256978321867564
CCSc1nnc(N2C(=O)C([O-])=C(C(=O)c3cccs3)[C@H]2c2ccc(OCC(N)=O)cc2)s1,C39999468_decoy,CASP3,Decoy,0,-9.31099,-6.07,-0.65,-6.160133946105223
CCSc1nnc(N2C(=O)C([O-])=C(C(=O)c3ccco3)[C@H]2c2ccc(OCC(N)=O)cc2)s1,C39999564_decoy,CASP3,Decoy,0,-9.14445,-5.47,-2.71,-6.724409370715447
COc1cc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)cc(Br)c1O,C40080772_decoy,CASP3,Decoy,0,-8.78506,-5.77,-1.93,-7.993984469261704
COc1cc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3)=C([O-])C(=O)N2CCO)cc(Br)c1O,C40080774_decoy,CASP3,Decoy,0,-8.69406,-8.22,-1.53,-11.477336915220356
COc1cc([C@H]2C(C(=O)c3cccc(OCc4ccccc4Cl)c3)=C([O-])C(=O)N2CCO)ccc1O,C40102867_decoy,CASP3,Decoy,0,-9.85656,-7.38,-4.49,-8.099775332351864
CCOc1cc([C@H]2C(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)=C([O-])C(=O)N2CCO)ccc1O,C40110592_decoy,CASP3,Decoy,0,-8.51055,-5.91,-3.17,-6.649812540279536
CCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCO)cc1OCC,C39898099_decoy,CASP3,Decoy,0,-8.23647,-6.68,-2.36,-8.468688797325482
C[C@H](CCCOC(=O)CCC(=O)[O-])[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@@H]4CC(=O)CC[C@@]4(C)[C@@H]3C[C@H](O)[C@]21C,C44021208_decoy,CASP3,Decoy,0,-8.76655,-7.46,-2.85,-6.562205681961748
Cc1cccc(Nc2nnc(SCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)[O-])s2)c1C,C13411758_decoy,CASP3,Decoy,0,-9.77064,-7.73,-1.82,-7.990479662054519
Cc1cccc(Nc2nnc(SCC(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)[O-])s2)c1C,C13411761_decoy,CASP3,Decoy,0,-8.77449,-8.3,-1.09,-6.536812745100431
Cc1cccc(-c2nnc(SCC(=O)NCCc3c[nH]c4ccccc34)n2CC(=O)[O-])c1,C13220444_decoy,CASP3,Decoy,0,-7.64808,-6.37,-1.19,-6.684316408594569
C[C@@H](NC(=O)CCCCCN1C(=O)/C(=C/c2cc(Br)ccc2O)SC1=S)C(=O)[O-],C15045076_decoy,CASP3,Decoy,0,-8.80825,-6.99,-1.72,-6.708343480512446
C[C@@H](C(=O)NCCCCCC(=O)[O-])N1C(=O)/C(=C/c2cc(Br)ccc2O)SC1=S,C15048151_decoy,CASP3,Decoy,0,-8.76735,-5.4,-1.49,-6.219801062798639
CCC[C@H](C)/N=c1\c(O)c(O)\c1=N/[C@@H](Cc1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1)C(=O)[O-],C25998503_decoy,CASP3,Decoy,0,-10.1207,-6.63,-2.33,-8.171895824878279
CCCCN1C(=O)N=C([O-])[C@@H](N(CCC(C)C)CC2=NC(=O)C3=C4CCC[C@@H]4SC3=N2)[C@@H]1N,C64012143_decoy,CASP3,Decoy,0,-8.96719,-6.23,-2.11,-8.459060984851991
CCCNC(=O)CN1CCN(c2ccc(NS(=O)(=O)c3ccc(F)cc3)c(C(=O)[O-])c2)CC1,C33259864_decoy,CASP3,Decoy,0,-9.48702,-7.23,-3.03,-9.43119873749136
CCCNC(=O)CN1CCN(c2ccc(C(=O)[O-])cc2NS(=O)(=O)c2ccccc2C)CC1,C33253277_decoy,CASP3,Decoy,0,-9.08683,-6.66,-4.07,-7.451225011526215
CCCCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])cc1,C13205150_decoy,CASP3,Decoy,0,-7.54218,-7.52,-1.45,-7.701142804692598
CCNc1ccc(C(=O)OCC)cc1NS(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC,C13250734_decoy,CASP3,Decoy,0,-8.38734,-6.97,-2.67,-7.675915548665811
C=CCn1c(COc2cc(C)ccc2C(C)C)nnc1SCC(=O)NCc1ccc(C(=O)[O-])cc1,C13348540_decoy,CASP3,Decoy,0,-6.90078,-6.75,-4.34,-6.262447836062258
CCOC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccc(OCC)cc2)n1CC(=O)[O-],C13443940_decoy,CASP3,Decoy,0,-8.61119,-7.02,-2.46,-7.047275342015143
Cc1cccc(-c2nnc(SCC(=O)N(CCC(N)=O)Cc3ccccc3)n2CCC(=O)[O-])c1,C13444431_decoy,CASP3,Decoy,0,-9.66672,-6.87,-3.53,-8.199006421540274
CCCCOC(=O)NC(Nc1ccc(S(=O)(=O)[N-]c2cc(C)on2)cc1)(C(F)(F)F)C(F)(F)F,C03832823_decoy,CASP3,Decoy,0,-7.45945,-6.1,-4.43,-6.059868645041143
CCCCOc1ccc(C(=O)N(CCCNC(=O)c2nc([O-])c3ccccc3n2)Cc2ccccc2)cc1,C22471783_decoy,CASP3,Decoy,0,-7.90668,-7.68,-2.35,-7.219668813168007
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@@H]1c1cc(OC)cc(OC)c1,C35700924_decoy,CASP3,Decoy,0,-8.3805,-5.37,-1.4,-6.138189983665657
CC[C@@H](C)N/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3ccc(OC)c(OC)c3)N12,C36058334_decoy,CASP3,Decoy,0,-8.24901,-5.65,-1.82,-6.812565193098037
CCCCNC(=O)[C@@H](c1ccc(OC)c(OC)c1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596696_decoy,CASP3,Decoy,0,-6.84125,-6.89,-3.29,-7.278291962578622
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(OCCCCC)c(OC)c2)cc1C,C40051968_decoy,CASP3,Decoy,0,-9.16832,-5.61,-1.44,-8.263782048458667
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(OCCCC)c(OCC)c2)cc1C,C40052052_decoy,CASP3,Decoy,0,-9.677,-5.59,-3.6,-7.665964568843301
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2ccccc2OCCCC)cc1C,C40052154_decoy,CASP3,Decoy,0,-8.87484,-7.05,-1.58,-8.468172605804243
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccccc2OCCCC)cc1C,C40052156_decoy,CASP3,Decoy,0,-9.13808,-5.19,-2.07,-6.107619423762564
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCCC)c(C)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40052342_decoy,CASP3,Decoy,0,-8.82804,-7.04,-2.52,-9.537183103947797
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCCCC)c(C)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40052345_decoy,CASP3,Decoy,0,-9.55683,-5.61,-2.07,-7.546002366993802
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40052672_decoy,CASP3,Decoy,0,-8.96717,-5.95,-3.92,-7.09364356218525
C=CCOc1ccccc1[C@H]1C(C(=O)c2ccc(OCC(C)C)c(C)c2)=C([O-])C(=O)N1CCCO,C40052733_decoy,CASP3,Decoy,0,-8.59939,-6.74,-1.7,-7.772023380341359
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40053781_decoy,CASP3,Decoy,0,-7.57978,-7.03,-1.16,-8.023653806529305
CCCCCOc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40067065_decoy,CASP3,Decoy,0,-9.3015,-6.36,-2.5,-8.22928930362445
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40076305_decoy,CASP3,Decoy,0,-7.73574,-6.66,-3.55,-7.145627528728379
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40076584_decoy,CASP3,Decoy,0,-9.46923,-7.01,-2.3,-8.048856626537255
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40076609_decoy,CASP3,Decoy,0,-8.66886,-7.01,-2.7,-8.133573571786817
CCOc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40076628_decoy,CASP3,Decoy,0,-8.48489,-5.7,-2.62,-7.0582583131734085
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OCCCC)cc2)cc1,C40078395_decoy,CASP3,Decoy,0,-7.55298,-7.13,-1.53,-6.695732332233404
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40079119_decoy,CASP3,Decoy,0,-7.79107,-7.1,-2.78,-8.082520089739443
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40079362_decoy,CASP3,Decoy,0,-7.85539,-6.09,-1.96,-8.308550593595665
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(=O)OC)cc2)c(C)c1,C40081345_decoy,CASP3,Decoy,0,-9.09109,-6.64,-2.81,-8.886418716561263
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCCC(C)C)c(OCC)c2)c(C)c1,C40083259_decoy,CASP3,Decoy,0,-8.77397,-5.98,-1.79,-6.756215281471453
CCOc1cc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40084440_decoy,CASP3,Decoy,0,-9.70325,-6.2,-1.45,-7.93674352045073
Cc1cc(OCC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccc(C(C)C)cc1,C40084720_decoy,CASP3,Decoy,0,-8.7526,-5.65,-1.48,-7.466206302497241
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40085155_decoy,CASP3,Decoy,0,-8.34985,-7.11,-2.41,-8.276241589265872
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C(C)(C)C)cc2)cc1C,C40086014_decoy,CASP3,Decoy,0,-7.91278,-7.55,-2.68,-7.233069128992371
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(C(C)(C)C)cc2)cc1C,C40091940_decoy,CASP3,Decoy,0,-8.49848,-6.95,-1.57,-8.961028484212907
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C(C)(C)C)cc2)cc1C,C40091941_decoy,CASP3,Decoy,0,-8.66037,-5.23,-4.29,-6.702275371530527
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc(OCCCCC)c2)cc1C,C40092004_decoy,CASP3,Decoy,0,-9.00435,-6.51,-2.64,-7.544946630650608
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(OCCCCC)c2)cc1C,C40092005_decoy,CASP3,Decoy,0,-8.82799,-6.9,-1.98,-8.604949192778886
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(OCCCCC)c(OC)c2)cc1C,C40092113_decoy,CASP3,Decoy,0,-8.76916,-7.08,-3.11,-8.620807584024366
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2Cl)cc1C,C40092635_decoy,CASP3,Decoy,0,-8.92338,-7.58,-0.95,-8.253941196217127
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2c(F)cccc2Cl)cc1C,C40092671_decoy,CASP3,Decoy,0,-8.80387,-6.87,-1.27,-7.470777508695236
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(N(CC)CC)cc2)cc1C,C40092861_decoy,CASP3,Decoy,0,-8.16637,-5.5,-2.36,-7.034836976317059
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40094332_decoy,CASP3,Decoy,0,-6.90646,-6.86,-2.79,-6.953601096140824
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40094417_decoy,CASP3,Decoy,0,-8.20361,-6.97,-2.02,-7.687327591809302
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40094426_decoy,CASP3,Decoy,0,-8.25861,-6.3,-1.67,-6.969951600245224
CCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40095086_decoy,CASP3,Decoy,0,-7.45504,-5.78,-1.77,-6.594660828008952
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40099830_decoy,CASP3,Decoy,0,-7.86405,-7.53,-2.05,-7.034818267094706
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40099879_decoy,CASP3,Decoy,0,-7.81249,-5.52,-3.06,-7.165723962423534
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40099987_decoy,CASP3,Decoy,0,-8.56844,-5.89,-2.51,-7.762153541595294
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCO)cc1OC,C40100039_decoy,CASP3,Decoy,0,-8.81801,-6.64,-2.84,-8.33595688733162
COCCCN/C(=N\c1cccc(C(=O)[O-])c1)N1CCN(CCOc2ccc(Cl)cc2)CC1,C15786597_decoy,CASP3,Decoy,0,-9.0809,-6.47,-2.19,-7.190593593136189
CC(C)(C)c1ccc(-c2nnc(SCC(=O)N(CCC#N)CCC#N)n2Cc2ccccc2)cc1,C08658018_decoy,CASP3,Decoy,0,-8.61983,-5.76,-1.83,-5.468198286659831
CCCN(CCC)c1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(CCCOCC)C1=O,C09281258_decoy,CASP3,Decoy,0,-8.31577,-5.96,-2.88,-6.658918748028987
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2cc(C)n(Cc3ccc(F)cc3)c2C)c1C,C09604172_decoy,CASP3,Decoy,0,-8.44467,-7.41,-1.35,-6.060794121336451
Cc1noc(C)c1COc1ccc(CC(=O)OCC(=O)c2cc(C)n(CC(F)(F)F)c2C)cc1,C09839289_decoy,CASP3,Decoy,0,-8.10255,-6.89,-3.15,-6.2436393555936816
COc1ccc(OC)c2sc(N(CCCn3ccnc3)C(=O)CCSc3ccc(C)cc3)nc12,C10584750_decoy,CASP3,Decoy,0,-9.60435,-6.73,-1.99,-8.506085491585434
Cc1nnc(SCC(=O)OCC(=O)N(Cc2ccccc2)Cc2ccccc2)n1-c1ccccc1,C12645304_decoy,CASP3,Decoy,0,-8.44104,-7.15,-2.22,-6.65545272408254
CCOCCCn1c(SCC(=O)c2cc(C)n(C[C@H]3CCCO3)c2C)nc2ccccc2c1=O,C13145357_decoy,CASP3,Decoy,0,-7.19713,-6.7,-3.03,-6.824037313465282
CCOCCCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nnc1-c1ccncc1,C03345694_decoy,CASP3,Decoy,0,-7.48351,-6.84,-1.38,-5.90585223410097
CCOc1cc(CN(CC)S(=O)(=O)c2cc(C(=O)[O-])cs2)ccc1OCc1cccs1,C13311340_decoy,CASP3,Decoy,0,-9.61762,-6.42,-4.23,-7.7444975900784385
COC(=O)c1ccc(COc2ccc(/C=C3\SC(=S)N(CCCCC(=O)[O-])C3=O)cc2)cc1,C13343273_decoy,CASP3,Decoy,0,-8.17534,-5.91,-1.11,-7.543358742100168
CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)OCC(=O)N(C)Cc2ccc(Cl)s2)cc1,C18761849_decoy,CASP3,Decoy,0,-9.05878,-6.49,-1.97,-6.585826696812131
CCN(CC)c1ccc(CN2CCc3c(sc(S(=O)(=O)N(CC)CC)c3C(=O)OC)C2)cc1,C14989223_decoy,CASP3,Decoy,0,-8.19715,-5.31,-4.52,-6.353458459726865
C=CCn1c(COc2ccccc2F)nnc1SCC(=O)c1cc(C)n(C[C@H]2CCCO2)c1C,C21121703_decoy,CASP3,Decoy,0,-8.91303,-7.49,-1.82,-11.7836796095602
COc1ccccc1N(C(C)=O)c1nc(COC(=O)CCC(=O)c2ccc(SC)cc2)cs1,C22531950_decoy,CASP3,Decoy,0,-8.63879,-7.64,-1.5,-7.143272005703881
Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)OCC(=O)N(CCc1ccccc1)Cc1ccccc1,C23594267_decoy,CASP3,Decoy,0,-7.90066,-7.0,-2.57,-8.393437308000882
COc1ccc(CN(C(=O)CSc2nncn2Cc2ccco2)[C@@H](C)Cc2cccs2)cc1,C24895735_decoy,CASP3,Decoy,0,-9.92001,-6.57,-4.41,-8.398026301137737
COc1ccc(CCN(Cc2ccco2)C(=O)CN(C(=O)c2ccc(F)cc2)C(C)(C)C)cc1OC,C33390290_decoy,CASP3,Decoy,0,-7.78973,-6.58,-1.61,-7.374191070726645
CCS(=O)(=O)N(CCN1CCOCC1)CC(=O)N(Cc1ccccc1)Cc1ccc(C)s1,C33402181_decoy,CASP3,Decoy,0,-9.35927,-5.68,-4.5,-7.273667613191579
COCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C(=O)Cc1cccs1,C33510905_decoy,CASP3,Decoy,0,-10.7104,-5.69,-3.01,-7.796089110129782
COc1ccc(C(=O)N(CC(=O)N(CCc2ccccc2)Cc2ccc(C)o2)C[C@H]2CCCO2)cc1,C33744715_decoy,CASP3,Decoy,0,-8.32226,-6.4,-1.98,-6.881808938704915
COCCN(CC(=O)N(Cc1ccco1)Cc1cccn1C)C(=O)c1ccc(-c2ccccc2)cc1,C33773199_decoy,CASP3,Decoy,0,-8.70315,-7.39,-1.46,-7.276117893275434
CCCS(=O)(=O)N(CCC(C)C)CC(=O)N(Cc1ccccc1C)C1CCN(C(C)=O)CC1,C34909689_decoy,CASP3,Decoy,0,-8.12487,-6.32,-5.27,-7.8680050832486
CCCC(=O)N1CCC(N(Cc2ccc(C)cc2)C(=O)CN(CC(C)C)S(=O)(=O)CC)CC1,C34909875_decoy,CASP3,Decoy,0,-8.85752,-7.26,-3.28,-7.143551555092387
CCCN(CC(=O)N(Cc1ccccc1C)C1CCN(C(=O)CC(C)C)CC1)S(=O)(=O)CC,C34910283_decoy,CASP3,Decoy,0,-8.62588,-5.79,-2.39,-6.922229048621874
O=C(CN(CCCN1CCOCC1)C(=O)c1cccs1)N(Cc1ccc(F)cc1)Cc1ccco1,C16652641_decoy,CASP3,Decoy,0,-9.52694,-7.07,-2.16,-8.678560463251346
O=C(CN(C[C@@H]1CCCO1)S(=O)(=O)/C=C/c1ccccc1)N(Cc1ccccc1)Cc1ccco1,C35305799_decoy,CASP3,Decoy,0,-7.02299,-5.48,-3.55,-5.853622982924719
C=CCN(CC(=O)N(Cc1ccccc1)Cc1ccco1)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C,C35356251_decoy,CASP3,Decoy,0,-8.60481,-6.65,-3.27,-7.595480450252533
C=CCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35444369_decoy,CASP3,Decoy,0,-6.6979,-5.06,-3.18,-6.051400851030083
CCCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCOC)cc1OCC,C35487415_decoy,CASP3,Decoy,0,-7.55817,-5.37,-3.63,-7.024879487847146
CCCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC)cc1OC,C35488108_decoy,CASP3,Decoy,0,-8.25498,-5.93,-1.61,-8.023627382981438
CCCCOc1ccc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC)cc1OCC,C35488212_decoy,CASP3,Decoy,0,-8.30035,-5.27,-2.07,-6.650931132184487
CCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC)cc1OCC,C35488214_decoy,CASP3,Decoy,0,-7.58838,-5.39,-3.28,-6.808702119843859
CCOc1cc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC)ccc1OCCC(C)C,C35488220_decoy,CASP3,Decoy,0,-8.33909,-5.76,-3.26,-6.3783021953636085
C=CCn1c(CN(Cc2ccco2)C(=O)Cc2ccccc2)cnc1S(=O)(=O)Cc1ccccc1,C35665947_decoy,CASP3,Decoy,0,-8.07751,-6.33,-4.02,-7.1156360372697645
COc1ccc(CCN(Cc2ccco2)C(=O)CN(C(=O)c2cccc(Cl)c2)C2CC2)cc1OC,C35764926_decoy,CASP3,Decoy,0,-9.27036,-6.67,-3.72,-7.427528697983153
COCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C(=O)c1ccc(F)cc1,C33897067_decoy,CASP3,Decoy,0,-8.09193,-5.81,-2.79,-6.636924229086305
COCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C(=O)c1ccccc1F,C35771078_decoy,CASP3,Decoy,0,-8.91147,-5.87,-2.84,-7.022456509339371
COc1ccc(CCN(Cc2ccc(C)s2)C(=O)CN(C(=O)c2ccco2)C(C)C)cc1OC,C35797433_decoy,CASP3,Decoy,0,-8.63184,-6.61,-2.43,-7.245095456487723
COCCN(C[C@@H]1CN(Cc2cc(OC)cc(OC)c2)CCO1)C(=O)c1cccc(C(F)(F)F)c1,C35864910_decoy,CASP3,Decoy,0,-7.51921,-6.62,-4.78,-7.379922457885442
CCn1cc([C@H](CC(=O)N(CCC#N)Cc2cccnc2)c2cc(OC)cc(OC)c2)c2ccccc21,C35872334_decoy,CASP3,Decoy,0,-8.62615,-6.81,-1.9,-8.065286548119083
C=CCN(Cc1cnc(S(=O)(=O)Cc2ccccc2)n1CC(C)C)C(=O)c1ccc(OC)cc1,C36030165_decoy,CASP3,Decoy,0,-7.57424,-7.36,-4.06,-8.837898367142824
COCCn1c(CN(CC2CC2)C(=O)c2ccccc2C)cnc1S(=O)(=O)Cc1ccccc1,C36030354_decoy,CASP3,Decoy,0,-8.04104,-6.88,-2.16,-7.851151931783089
COCCN(Cc1cnc(S(=O)(=O)Cc2cccc(C(F)(F)F)c2)n1C1CC1)C(=O)C1CC1,C36040439_decoy,CASP3,Decoy,0,-7.39334,-6.02,-2.15,-5.764313738591388
COCCCN(CC(=O)N1CCc2sccc2[C@H]1COc1ccc(Cl)c(C)c1)C(=O)COC,C36116178_decoy,CASP3,Decoy,0,-9.02816,-5.7,-3.17,-8.12319963021974
COc1ccc(CCn2c(C)cc(C(=O)CSc3nnc(C4CC4)n3Cc3ccco3)c2C)cc1,C36802547_decoy,CASP3,Decoy,0,-9.00935,-5.87,-2.68,-7.6477223767929985
COCCCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(F)cc3)n2C[C@@H]2CCCO2)c1C,C36821599_decoy,CASP3,Decoy,0,-9.01509,-6.49,-3.18,-8.478115316767997
Cc1noc(C)c1CSc1ccccc1C(=O)OCC(=O)N(C)Cc1ccc(OC(F)F)cc1,C39606670_decoy,CASP3,Decoy,0,-7.22162,-7.02,-3.21,-6.730408511283136
CCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC(C)C)cc1OC,C39840484_decoy,CASP3,Decoy,0,-7.47025,-5.34,-5.07,-6.154388897272605
CCCOc1ccc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2CCCOC(C)C)cc1OCC,C39840503_decoy,CASP3,Decoy,0,-8.26557,-5.89,-3.82,-7.216147749737534
CCN(Cc1ccc(OC)c(OC)c1)C(=O)CSc1nc2cc(Cl)ccc2n1CCOC,C45446579_decoy,CASP3,Decoy,0,-8.13055,-5.94,-3.14,-6.3277437338406495
CO[C@@]1(NC(=O)CSC[C@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]21,C03871930_decoy,CASP3,Decoy,0,-7.36476,-6.51,-1.1,-6.3185058524281255
CO[C@]1(NC(=O)CSC[C@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]21,C03871931_decoy,CASP3,Decoy,0,-7.16975,-6.03,-1.92,-6.576325704680439
CO[C@@]1(NC(=O)CSC[C@@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]21,C03938624_decoy,CASP3,Decoy,0,-9.39679,-5.44,-1.05,-7.181940224349847
CSCC(=O)N[C@H]1C[C@@H](C(=O)[O-])N(C(=O)CCCC(=O)N2C[C@@H](NC(=O)C3CC3)C[C@H]2C(=O)[O-])C1,C04221457_decoy,CASP3,Decoy,0,-7.11624,-6.24,-2.13,-6.109704611679612
COCC(=O)N[C@H]1C[C@@H](C(=O)[O-])N(C(=O)CCCC(=O)N2C[C@@H](NC(=O)CSC)C[C@H]2C(=O)[O-])C1,C04221478_decoy,CASP3,Decoy,0,-8.54138,-6.15,-1.51,-10.77202854413878
CO[C@]1(NC(=O)CCC[C@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@H]21,C05201543_decoy,CASP3,Decoy,0,-7.99001,-6.81,-3.02,-7.615471574242469
CO[C@]1(NC(=O)CSC[C@@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]21,C11616627_decoy,CASP3,Decoy,0,-6.03492,-6.56,-0.81,-6.38274271285454
CO[C@@]1(NC(=O)CSC[C@@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@H]21,C11616628_decoy,CASP3,Decoy,0,-6.68997,-6.07,-1.68,-5.7475013903173
CCCSc1ccc([N+](=O)[O-])c(/N=C(\NCCS(=O)(=O)[O-])NC(=O)OC)c1,C12370131_decoy,CASP3,Decoy,0,-7.88424,-6.56,-2.32,-7.712898575832675
CCCSc1ccc([N+](=O)[O-])c(/N=C(/NCCS(=O)(=O)[O-])NC(=O)OC)c1,C11681562_decoy,CASP3,Decoy,0,-7.76704,-6.56,-1.72,-7.413641784770579
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)[O-])c1OC,C13359097_decoy,CASP3,Decoy,0,-7.54601,-6.65,-0.7,-6.415997878996866
CO[C@]1(NC(=O)CCC[C@@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@H]21,C14922270_decoy,CASP3,Decoy,0,-9.28463,-6.35,-2.02,-8.137952836433122
CO[C@@]1(NC(=O)CCC[C@@H]([NH3+])C(=O)[O-])C(=O)N2C(C(=O)[O-])=C(COC(N)=O)CS[C@H]21,C14922274_decoy,CASP3,Decoy,0,-8.07426,-7.06,-1.32,-7.586724675634444
O=C(CCCC[C@H]1SC[C@@H]2NC(=O)N[C@@H]21)NCCCC[C@H](NC(=O)CCN1C(=O)C=CC1=O)C(=O)[O-],C22061965_decoy,CASP3,Decoy,0,-7.58712,-6.62,-3.59,-5.999920469765735
CC(=O)N[C@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)O[C@@H]1SCCC(=O)[O-],C22066042_decoy,CASP3,Decoy,0,-6.68737,-5.91,-3.14,-7.000617043813268
O=S(=O)([O-])C[C@H](O)COc1cccc(OC[C@H](O)COS(=O)(=O)[O-])c1,C25665016_decoy,CASP3,Decoy,0,-8.32675,-7.84,-1.08,-8.194999948521874
O=S(=O)([O-])C[C@@H](O)COc1cccc(OC[C@H](O)COS(=O)(=O)[O-])c1,C25665026_decoy,CASP3,Decoy,0,-8.4309,-7.54,-0.9,-7.998322644630101
O=S(=O)([O-])C[C@@H](O)COc1cccc(OC[C@@H](O)COS(=O)(=O)[O-])c1,C25665031_decoy,CASP3,Decoy,0,-7.48187,-5.67,-0.22,-6.694050848661582
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]21)NCCCC[C@H](NC(=O)CCN1C(=O)C=CC1=O)C(=O)[O-],C25726371_decoy,CASP3,Decoy,0,-8.29068,-7.56,-2.79,-6.778758734437917
CON(C)C(=O)[C@H](CO[P@](=O)([O-])OC[C@H](O)CO)NC(=O)OC(C)(C)C,C26522598_decoy,CASP3,Decoy,0,-6.55879,-5.52,-0.78,-5.510160350881486
CON(C)C(=O)[C@H](CO[P@@](=O)([O-])OC[C@H](O)CO)NC(=O)OC(C)(C)C,C26522605_decoy,CASP3,Decoy,0,-5.51167,-5.52,-2.27,-6.038346986668852
COc1cc([C@H](C[NH+](CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-])c([N+](=O)[O-])cc1OC,C31261526_decoy,CASP3,Decoy,0,-4.29988,-5.84,-4.17,-5.292342450512235
[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,CASP3,Decoy,0,-5.30362,-5.93,-1.74,-7.134226305976137
[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,CASP3,Decoy,0,-5.03117,-6.89,-1.61,-6.4374422384557946
CC(=O)N[C@H]1[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1SCCC(=O)[O-],C35653051_decoy,CASP3,Decoy,0,-6.36627,-6.24,-3.55,-6.884776805255662
O=C([O-])CN(CCO)CC[NH+](CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-],C34109930_decoy,CASP3,Decoy,0,-4.92144,-5.47,-5.19,-5.064068191435878
CC(=O)N(O)CCCCCNC(=O)CC(O)(CC(=O)NCCCCCN(O)C(C)=O)C(=O)[O-],C13373116_decoy,CASP3,Decoy,0,-8.86903,-5.95,-1.39,-9.5930954973359
O=C([O-])CN(CC(=O)[O-])C[C@H]1CO[C@H](C[NH+](CC(=O)[O-])CC(=O)[O-])CO1,C38652234_decoy,CASP3,Decoy,0,-6.91956,-6.53,-0.52,-11.692565206084671
O=C([O-])CN(CC(=O)[O-])C[C@@H]1CO[C@H](C[NH+](CC(=O)[O-])CC(=O)[O-])CO1,C38652237_decoy,CASP3,Decoy,0,-5.73768,-5.13,-0.98,-5.762227838878434
O=c1[nH]c([O-])nc2c1n(CCCCOP(=O)([O-])[O-])c(=O)n2C[C@H](O)[C@H](O)[C@H](O)CO,C12501631_decoy,CASP3,Decoy,0,-7.10952,-6.08,-0.83,-6.190726836562707
C[C@@](O)(CO)[C@H](O)CO[P@@](=O)([O-])O[P@@](=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](O)[C@H]1O,C38665284_decoy,CASP3,Decoy,0,-6.76447,-5.11,-1.41,-5.053264898809217
C[C@](O)(CO)[C@H](O)CO[P@@](=O)([O-])O[P@@](=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](O)[C@H]1O,C38665287_decoy,CASP3,Decoy,0,-5.22728,-7.18,-1.92,-5.350641182153529
C[C@@](O)(CO)[C@@H](O)CO[P@@](=O)([O-])O[P@@](=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](O)[C@H]1O,C38665289_decoy,CASP3,Decoy,0,-5.91246,-6.48,-3.41,-5.460931990998141
C[C@](O)(CO)[C@@H](O)CO[P@@](=O)([O-])O[P@@](=O)([O-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](O)[C@H]1O,C38665291_decoy,CASP3,Decoy,0,-6.21955,-5.41,-1.09,-5.154307618146559
CC(=O)OC[C@@H]1CS[C@@H]2[C@H](NC(=O)CCCC[C@H](NC(=O)C[NH3+])C(=O)[O-])C(=O)N2[C@@H]1C(=O)[O-],C38665561_decoy,CASP3,Decoy,0,-7.4547,-6.63,-1.39,-9.249348103950274
CC(=O)OC[C@H]1CS[C@@H]2[C@H](NC(=O)CCCC[C@H](NC(=O)C[NH3+])C(=O)[O-])C(=O)N2[C@@H]1C(=O)[O-],C38665563_decoy,CASP3,Decoy,0,-7.63283,-6.42,-1.52,-5.607387957720758
CC(=O)N[C@@H](CCCCN1CC=CC2=NC(=[NH+]CCC[C@H](NC(C)=O)C(=O)[O-])N=C21)C(=O)[O-],C39326132_decoy,CASP3,Decoy,0,-7.10632,-7.47,-2.52,-8.275291769545941
COCCOC(=O)[C@H]1[C@H](C)[C@@H](C(N)=O)S[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39704198_decoy,CASP3,Decoy,0,-9.50005,-7.24,-2.29,-8.792519335765261
O=C([O-])CN(CC[NH+](CC(=O)[O-])CC(=O)N[C@@H](CC(=O)O)C(=O)[O-])CC(=O)N[C@H](CC(=O)O)C(=O)[O-],C22942281_decoy,CASP3,Decoy,0,-5.35808,-7.38,-1.91,-8.113388082232865
CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1SCCC(=O)[O-],C44170768_decoy,CASP3,Decoy,0,-6.20624,-5.62,-2.18,-5.741253285118365
CC(=O)OC[C@H]1CS[C@H]2[C@H](NC(=O)CCCC[C@H](NC(=O)C[NH3+])C(=O)[O-])C(=O)N2[C@@H]1C(=O)[O-],C38665816_decoy,CASP3,Decoy,0,-6.97661,-6.05,-1.09,-5.730984762689803
O=C(NCCCCCCNC(=O)N[C@H](CO)C(=O)[O-])N[C@@H](CO)C(=O)[O-],C17720898_decoy,CASP3,Decoy,0,-8.18738,-7.44,-1.65,-11.252284744828325
O=P([O-])([O-])CN(CCN(C[P@@](=O)([O-])O)C[P@@](=O)([O-])O)C[P@@](=O)([O-])O,C19855121_decoy,CASP3,Decoy,0,-5.06642,-6.29,-1.75,-6.371259429841317
O=c1[nH]c([O-])nc2c1n(CCCCOP(=O)([O-])[O-])c(=O)n2C[C@@H](O)[C@H](O)[C@H](O)CO,C32304142_decoy,CASP3,Decoy,0,-7.40839,-7.55,-1.86,-7.499642083535116
Cc1[nH+]cc(COP(=O)([O-])[O-])c(CN[C@@H](/C=C/OCC[NH3+])C(=O)[O-])c1[O-],C12503405_decoy,CASP3,Decoy,0,-5.9729,-6.08,-2.08,-5.925421593282151
CCCSc1ccc([N+](=O)[O-])c(N/C(=N/C(=O)OC)[N-]CCS(=O)(=O)[O-])c1,C20230700_decoy1,CASP3,Decoy,0,-7.85207,-6.51,,-7.493527873771168
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1N[C@@H](C(=O)[O-])C(C)(C)S1,C63603657_decoy,CASP3,Decoy,0,-8.1377,-6.46,-2.88,-7.83206172081161
CCCSc1ccc([N+](=O)[O-])c(N/C(=N\C(=O)OC)[N-]CCS(=O)(=O)[O-])c1,C20230700_decoy2,CASP3,Decoy,0,-7.15399,-7.13,,-7.6405175143677955
[NH3+][C@H](CCOc1ccc(/C(=N/O)C(=O)N[C@H]2CN([C@@H](C(=O)[O-])c3ccc(O)cc3)C2=O)cc1)C(=O)[O-],C13508104_decoy,CASP3,Decoy,0,-8.2782,-7.43,-2.16,-6.555385170350295
O=P([O-])([O-])C[NH+](CCN(CCO)C[P@@](=O)([O-])O)C[P@@](=O)([O-])O,C34022839_decoy,CASP3,Decoy,0,-5.56367,-5.21,-1.34,-5.5271570207940455
O=C([O-])CCCCCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(Br)o1,C09067147_decoy,CASP3,Decoy,0,-7.13201,-6.83,-2.31,-8.056599649588895
CCCN(C(=O)CSc1nnc(-c2ccc(OCC)cc2)n1CC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13033669_decoy,CASP3,Decoy,0,-7.61818,-5.99,-0.53,-5.7914502905400616
CCOc1ccc(CN(C)C(=O)CSc2nnc(-c3cccc(C)c3)n2CCC(=O)[O-])cc1,C13198674_decoy,CASP3,Decoy,0,-7.83877,-6.71,-1.51,-6.6399130804791096
COC[C@H](C)n1c(C)cc(C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-])c1C,C13223679_decoy,CASP3,Decoy,0,-7.1328,-6.17,-3.77,-6.138211248256601
COC(=O)c1c(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])c(C)n(C2CC2)c1C,C13237234_decoy,CASP3,Decoy,0,-7.08995,-7.04,-4.22,-6.807618745378402
COc1ccc(-c2nnc(SCC(=O)N(Cc3ccco3)c3ccccc3)n2CCC(=O)[O-])cc1,C13237601_decoy,CASP3,Decoy,0,-6.88292,-7.2,-3.85,-6.641125790642916
COC[C@@H](C)n1c(C)cc(C(=O)CSc2nnc(-c3cccs3)n2[C@H](C(=O)[O-])C(C)C)c1C,C13271622_decoy,CASP3,Decoy,0,-8.8047,-5.67,-2.14,-7.538131712412129
CCOc1cc(-c2nnc(SCC(=O)N3CCCC[C@@H]3C(=O)[O-])o2)cc(OCC)c1OCC,C13417015_decoy,CASP3,Decoy,0,-7.97171,-5.99,-0.87,-6.060907178593866
CCOc1ccc(-c2nnc(SCC(=O)N(C)c3ccccc3C(=O)OC)n2CC(=O)[O-])cc1,C13444013_decoy,CASP3,Decoy,0,-7.05275,-7.12,-1.51,-10.132097572556528
CCOc1ccc(-c2nnc(SCC(=O)N(CCC(N)=O)Cc3ccccc3)n2CC(=O)[O-])cc1,C13444018_decoy,CASP3,Decoy,0,-8.6711,-7.18,-1.12,-7.822962420759794
CCOc1cc(/C=C2/SC(=O)N(c3ccc(N(CC)CC)cc3)C2=O)ccc1O[C@@H](CC)C(=O)[O-],C16918911_decoy,CASP3,Decoy,0,-7.91087,-5.99,-4.09,-5.91575725135017
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@@H]1c1ccc(OC)c(OC)c1,C27988012_decoy,CASP3,Decoy,0,-8.29205,-7.55,-1.9,-9.972665371032312
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCN2CCOCC2)cc1,C33371169_decoy,CASP3,Decoy,0,-8.52393,-6.77,-1.48,-9.185904233492831
CCCCCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCn2ccnc2)cc1OCC,C33532936_decoy,CASP3,Decoy,0,-8.23513,-6.79,-3.85,-6.680371746707364
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C33533272_decoy,CASP3,Decoy,0,-8.21684,-6.77,-2.8,-8.279600043788781
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCN2CCOCC2)cc1OCC,C33555014_decoy,CASP3,Decoy,0,-7.67397,-6.2,-1.79,-6.110358335582065
CCOC(=O)[C@@H]1CCCN(C(=O)CCc2nnc(-c3ccc(O[C@H](C)CC)c(OC)c3)nc2[O-])C1,C34767087_decoy,CASP3,Decoy,0,-9.81671,-7.37,-1.78,-6.727459671355824
CCOc1cc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCOC)ccc1OCCC(C)C,C34917592_decoy,CASP3,Decoy,0,-8.26753,-6.19,-3.31,-5.552319303633717
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCN(CCOC)CC3)N2[C@H]1c1ccccc1,C34922760_decoy,CASP3,Decoy,0,-8.30375,-5.81,-2.35,-6.955707358679214
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCN2CCOCC2)cc1OCC,C35275315_decoy,CASP3,Decoy,0,-9.60377,-6.08,-4.39,-7.493341746103898
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCN2CCOCC2)cc1OCC,C35275322_decoy,CASP3,Decoy,0,-9.24063,-6.42,-1.97,-8.80714787915692
CCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCCOC)cc1OCC,C35484279_decoy,CASP3,Decoy,0,-8.1248,-6.01,-4.34,-7.606136581932056
CCCCCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCCOC)cc1,C35566865_decoy,CASP3,Decoy,0,-8.04856,-5.66,-2.62,-6.43154688624677
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35567687_decoy,CASP3,Decoy,0,-7.10147,-6.92,-5.44,-7.139624604264943
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccc(OC)c(OC)c1,C36058343_decoy,CASP3,Decoy,0,-9.77888,-6.67,-1.35,-10.005839515965365
CCOC(=O)[C@@]([N-]S(=O)(=O)c1ccccc1)(C(F)(F)F)P(=O)(OCC(C)C)OCC(C)C,C06004740_decoy,CASP3,Decoy,0,-6.15819,-6.18,-2.69,-7.031134949648989
CCCCn1c(N2CCCC2)c(/C=C2/SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33813472_decoy,CASP3,Decoy,0,-7.73199,-5.55,-3.29,-6.6163797792037125
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OCCC)cc3)[C@H]2c2cccnc2)nc1C,C39834456_decoy,CASP3,Decoy,0,-10.118,-6.03,-2.4,-9.3568993218157
C=CCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1OCC,C39999552_decoy,CASP3,Decoy,0,-8.97152,-6.99,-5.46,-8.10729182911806
C=CCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1OCC,C39999553_decoy,CASP3,Decoy,0,-8.33357,-5.79,-3.56,-7.029187917470531
C=CCN1C(=O)C([O-])=C(C(=O)c2sc(C)nc2C)[C@H]1c1ccc(OCCCCC)c(OC)c1,C40028566_decoy,CASP3,Decoy,0,-8.13387,-6.66,-1.78,-7.704474925320236
C=CCN1C(=O)C([O-])=C(C(=O)c2sc(C)nc2C)[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40028645_decoy,CASP3,Decoy,0,-8.45501,-6.0,-3.38,-6.500174905798916
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(O)c(OCC)c2)cc1C,C40051982_decoy,CASP3,Decoy,0,-8.84453,-6.77,-2.26,-7.857369784626933
CCCCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCCO)cc1OCC,C40053468_decoy,CASP3,Decoy,0,-8.47443,-6.08,-1.68,-8.523839495349304
CCCCCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40068028_decoy,CASP3,Decoy,0,-8.77817,-6.29,-2.57,-7.179696901066065
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(N(C)C)cc2)cc1,C40078440_decoy,CASP3,Decoy,0,-8.09667,-7.19,-1.2,-8.015424979991419
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1,C40079015_decoy,CASP3,Decoy,0,-7.41756,-6.73,-1.8,-6.5475604483239165
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084209_decoy,CASP3,Decoy,0,-9.27474,-6.6,-2.58,-9.05753972789624
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40085127_decoy,CASP3,Decoy,0,-8.23763,-6.88,-2.17,-7.644309500699115
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cc(OC)ccc2OC)cc1C,C40092869_decoy,CASP3,Decoy,0,-7.8623,-7.12,-1.25,-9.813776305861031
Cc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093747_decoy,CASP3,Decoy,0,-7.28408,-6.24,-2.18,-6.262212624225027
CCOc1ccc([C@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40097074_decoy,CASP3,Decoy,0,-8.10195,-6.99,-5.57,-7.270315344930989
CCCCOc1ccc([C@@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2CCO)cc1OCC,C40097312_decoy,CASP3,Decoy,0,-8.7316,-7.13,-1.67,-7.907758237661381
CCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1OC,C40098532_decoy,CASP3,Decoy,0,-8.76234,-6.01,-3.55,-7.800965473404381
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(OCc3ccccc3)c2)s1,C40098628_decoy,CASP3,Decoy,0,-8.47893,-7.5,-2.28,-7.877244878033995
CCN(CC)c1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40098701_decoy,CASP3,Decoy,0,-8.34923,-5.58,-4.57,-6.973786235049568
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccccc2[N+](=O)[O-])c1,C40102137_decoy,CASP3,Decoy,0,-7.32806,-6.56,-3.73,-7.411168451051735
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1ccco1)c1cccc(OCc2ccc(Cl)cc2)c1,C40103009_decoy,CASP3,Decoy,0,-8.42293,-6.73,-1.72,-7.146888581276627
CCCC/C=C/CCN1C(=O)[C@H]2[C@@H](c3ccc(C(=O)OC)cc3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C43218429_decoy,CASP3,Decoy,0,-7.58205,-7.52,-1.5,-7.840513304880147
CCOC(=O)CC1=C(C(=O)OCC)[C@@H](c2ccccc2C(F)(F)F)/C(=C(\[O-])OCC)C(C)=N1,C29399547_decoy,CASP3,Decoy,0,-8.43268,-6.26,-2.73,-7.15424046446374
CCN(C(=O)COC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1,C03358549_decoy,CASP3,Decoy,0,-6.23402,-6.66,-2.19,-6.389160020489898
COc1ccc(Cn2nnnc2SCCCn2c(=O)c3c(ncn3C)n(C)c2=O)cc1,C09512692_decoy,CASP3,Decoy,0,-7.29124,-5.86,-0.86,-5.909220047869982
COC(=O)[C@]1(C)O[C@](C)(OC(C)=O)[C@](C)(OC(C)=O)[C@](C)(OC(C)=O)[C@]1(C)OC(C)=O,C09915635_decoy,CASP3,Decoy,0,-4.70047,-4.39,-3.1,-4.243879801675472
CCOC(=O)CC(=O)Cn1c(=O)c2c(nc3n2CCN3c2ccc(OC)cc2)n(C)c1=O,C10249714_decoy,CASP3,Decoy,0,-6.66412,-5.43,-1.51,-4.874503090018109
CCOC(=O)c1ccc(N2CCn3c2nc2c3c(=O)n(CC(=O)OCc3ccccc3)c(=O)n2C)cc1,C10249784_decoy,CASP3,Decoy,0,-8.99197,-7.37,-1.49,-8.93973352829859
COc1cc(OC)c(C(=O)OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC,C11342947_decoy,CASP3,Decoy,0,-7.06579,-5.89,-1.46,-5.522136567855935
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C11342994_decoy,CASP3,Decoy,0,-6.57633,-7.1,-2.15,-5.397530730555996
CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@H](OC(C)=O)CO[C@@H]1n1ccc2cc(Br)c([N+](=O)[O-])cc21,C05733148_decoy,CASP3,Decoy,0,-5.81856,-5.57,-2.07,-5.691749313098984
CN(C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)c1ccc([N+](=O)[O-])cc1,C13047117_decoy,CASP3,Decoy,0,-7.24597,-6.28,-1.47,-5.921922285101536
COC(=O)c1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)cc([N+](=O)[O-])c1,C02635181_decoy,CASP3,Decoy,0,-6.90639,-7.35,-1.87,-6.215631379526438
CCOc1ccc(-c2nnc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)n2CC(=O)[O-])cc1,C13195352_decoy,CASP3,Decoy,0,-7.19532,-7.54,-2.38,-6.334451177623882
CC[C@H](C)N(C(=O)COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1,C09121307_decoy,CASP3,Decoy,0,-7.39737,-8.62,-4.43,-6.811607399475
COc1ccc(-n2nnnc2Sc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])cc1,C13275401_decoy,CASP3,Decoy,0,-1.89796,-6.98,-3.18,-4.081380484887702
COc1cc(CN2CCN(C(=O)c3cc(OC)c(OC)c(OC)c3)CC2)c([N+](=O)[O-])cc1OC,C19608280_decoy,CASP3,Decoy,0,-7.25373,-6.48,-3.34,-6.173738772026648
CN(C(=O)CCc1nc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)no1)C1CCCCC1,C20562462_decoy,CASP3,Decoy,0,-8.02789,-6.73,-2.27,-6.184761709778088
CCn1c(Cn2nc(C(F)F)cc2C(F)F)nnc1SCc1nc2c3cnn(C)c3ncn2n1,C02802770_decoy,CASP3,Decoy,0,-6.90802,-7.03,-1.39,-5.812606943964559
CCOc1ccc(-c2noc(Cn3ncn4nc(-c5ccc(OC)cc5)cc4c3=O)n2)cc1OC,C21730539_decoy,CASP3,Decoy,0,-8.33186,-6.75,-2.65,-6.284049227124527
COc1ccc(-c2cc(-c3ccc(OC)c(OC)c3)n(Cn3cc([N+](=O)[O-])cn3)n2)cc1OC,C22575288_decoy,CASP3,Decoy,0,-7.82554,-6.3,-3.54,-5.900479089492725
CCOc1ccc(N2C[C@@H](C(=O)N3CCN(Cc4nnnn4-c4ccc(OC)cc4)CC3)CC2=O)cc1,C23233547_decoy,CASP3,Decoy,0,-7.58756,-6.73,-1.5,-6.53960945512033
CCOc1ccc(N2C[C@H](C(=O)N3CCN(Cc4nnnn4-c4ccc(OC)cc4)CC3)CC2=O)cc1,C23233549_decoy,CASP3,Decoy,0,-8.10992,-7.1,-3.12,-6.519018343535851
CCOc1ccc(-n2nnnc2CN2CCN(C(=O)[C@@H]3CC(=O)N(c4ccc(OC)cc4)C3)CC2)cc1,C23233872_decoy,CASP3,Decoy,0,-8.00631,-7.02,-2.19,-6.594154344063103
CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(CCOC)/c1=N\C(=O)c1ccc(OC)c(OC)c1,C11691106_decoy,CASP3,Decoy,0,-8.44579,-6.4,-4.39,-6.797698594477645
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccncc3)[C@@H]2c2ccc([N+](=O)[O-])cc2)nc1C,C33587883_decoy,CASP3,Decoy,0,-8.11009,-6.67,-1.93,-6.222157778953901
CC(=O)O[C@H]1[C@H](Oc2ccc3c(=O)c(-c4ccccn4)c(C)oc3c2)OC[C@@H](OC(C)=O)[C@H]1OC(C)=O,C34898318_decoy,CASP3,Decoy,0,-6.11756,-7.18,-1.69,-5.3885803080958015
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@@H](C)C2)c1C(=O)OCC,C35175995_decoy,CASP3,Decoy,0,-6.96296,-6.44,-1.62,-6.587568494862221
COc1cc(/C=N/[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)ccc1OCC(=O)N1[C@@H](C)CCC[C@@H]1C,C15980408_decoy,CASP3,Decoy,0,-8.81182,-7.25,-3.54,-6.387362426884948
CCc1nnc([N-]S(=O)(=O)c2ccc([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])cc2)s1,C02060545_decoy,CASP3,Decoy,0,-6.70105,-5.83,-3.13,-5.400309749770334
COCCn1nnnc1[C@@H](c1ccc(OC)c(OC)c1)N1CCN(C(=O)c2ccco2)CC1,C13504281_decoy,CASP3,Decoy,0,-7.36857,-7.18,-1.78,-5.946104454031692
COC(=O)c1nn(-c2nc(-c3ccc(OC)c(OC)c3)cc(C(F)(F)F)n2)cc1[N+](=O)[O-],C09597975_decoy,CASP3,Decoy,0,-7.03399,-7.11,-2.59,-6.450615276011457
COCCN(C)c1ccc(/N=N/C2=NN(C)[C@@H](/N=N/c3ccc(N(C)CCOC)cc3)N2C)cc1,C38642735_decoy,CASP3,Decoy,0,-8.54613,-5.82,-1.11,-6.10441724830098
Cc1noc(C)c1COc1ccc(C(=O)OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1,C39517754_decoy,CASP3,Decoy,0,-6.70046,-7.14,-1.52,-5.536713983111199
C=CCn1c(SCC2=NC(=O)C3=C(C)[C@H](C(=O)[O-])SC3=N2)nnc1-c1cccc([N+](=O)[O-])c1,C39667847_decoy,CASP3,Decoy,0,-8.81775,-8.81,-2.84,-7.124793565199961
CCOC(=O)c1cnc(N2CCOCC2)nc1CSc1nnc(-c2cc(C)n(C)n2)n1C(C)C,C41335907_decoy,CASP3,Decoy,0,-8.98466,-7.46,-2.62,-7.164090438005035
CCOC(=O)c1cnc(N2CCOCC2)nc1CSc1nnc(-c2cc(C)n(C)n2)o1,C41385455_decoy,CASP3,Decoy,0,-8.96915,-7.51,-2.35,-6.0581319520947945
CCOC(=O)c1cnc(N2CCOCC2)nc1CSc1nnc(Cn2nc(C)cc2C)o1,C41386435_decoy,CASP3,Decoy,0,-8.86899,-5.96,-2.88,-6.595630151331111
Cc1ccc(C(=O)OC[C@H]2O[C@@H](n3ccc(-n4cncn4)nc3=O)C[C@H]2OC(=O)c2ccc(C)cc2)cc1,C44028993_decoy,CASP3,Decoy,0,-5.28757,-5.63,-2.13,-4.512347567280788
COC(=O)C#C/C(OC)=C(/C(=O)OC)[C@]1(C(=O)OC)N(C(C)(C)C)C(=O)N(C)N1C(C)(C)C,C44544629_decoy,CASP3,Decoy,0,-6.2601,-4.64,-1.79,-5.120924182244507
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)OCc1cc(=O)n2cc(Cl)ccc2n1,C28142545_decoy,CASP3,Decoy,0,-6.23984,-7.29,-1.27,-5.3901489978701065
CCN(C(=O)[C@H](C)OC(=O)CCn1cnc2c(cnn2C)c1=O)[C@H]1CCS(=O)(=O)C1,C45702092_decoy,CASP3,Decoy,0,-7.86529,-7.0,-1.01,-6.431314333224957
Cc1cc(C(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)c(C)n1-c1cccc([N+](=O)[O-])c1,C13093069_decoy,CASP3,Decoy,0,-6.0867,-7.1,-1.04,-6.089509176313078
COc1ccc([C@H]2C3=C(CC(C)(C)CC3=O)Oc3ncn4nc(CO/N=C/c5ccc(OC)c(OC)c5)nc4c32)cc1,C01860294_decoy,CASP3,Decoy,0,-9.87466,-7.77,-0.59,-7.746751214692815
CC(C)C[C@@H](c1nnnn1Cc1ccc2c(c1)OCO2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C13505152_decoy,CASP3,Decoy,0,-8.44848,-7.35,-2.52,-6.188697958651995
Cc1nn(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1/C=N/N=C(\[O-])C(F)(F)C(F)(F)C(F)(F)F,C59161227_decoy,CASP3,Decoy,0,-6.22862,-6.38,-0.82,-6.268590551011167
O=[N+]([O-])c1ccc(S(=O)(=O)/C=C/CSc2nnc(-c3ccccc3[N+](=O)[O-])o2)cc1,C59175814_decoy,CASP3,Decoy,0,-6.54122,-6.06,-3.92,-4.946958404248585
CCOc1nc(N/C([O-])=N/S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)nc(N(C)C)n1,C59366834_decoy,CASP3,Decoy,0,-7.4897,-5.74,-1.71,-6.289135996998293
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-],C59461008_decoy,CASP3,Decoy,0,-5.58323,-7.58,-3.46,-6.84189312602108
COc1cc([N-]S(=O)(=O)c2ccc(/N=C/c3ccc(Cl)c([N+](=O)[O-])c3)cc2)nc(OC)n1,C59461077_decoy,CASP3,Decoy,0,-7.19406,-6.88,-2.87,-6.03703440436431
CCc1nnc([N-]S(=O)(=O)c2ccc(/N=C/c3cc(OC)c(OC)cc3[N+](=O)[O-])cc2)s1,C59461110_decoy,CASP3,Decoy,0,-5.97132,-5.9,-1.64,-4.771383096316281
CCOC(=O)C1=C(C)N=C(C)[C@@H]1S(=O)(=O)N(C)CC(=O)N1CCN(c2ncccn2)CC1,C63646632_decoy,CASP3,Decoy,0,-6.7976,-7.36,-3.15,-5.984875045641687
CCOc1ccc(N2C(=O)[C@H]3N=NN(Cc4nc(-c5ccccc5OCC)no4)[C@H]3C2=O)cc1,C38652552_decoy,CASP3,Decoy,0,-6.6095,-7.24,-3.33,-5.078851538028953
Cn1cnnc1SCc1c(C(=O)N/N=C/c2ccc(OCC(=O)[O-])cc2)nnn1-c1nonc1N,C09356893_decoy,CASP3,Decoy,0,-9.39331,-5.93,-2.74,-6.266263928122667
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)N(CC)[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13018600_decoy,CASP3,Decoy,0,-7.62407,-5.93,-1.61,-6.456041271689708
CCOC(=O)c1ccc(-c2ccc(/C=N/n3c(SCC(=O)[O-])nnc3-c3ccoc3C)o2)cc1,C13077961_decoy,CASP3,Decoy,0,-8.21482,-7.26,-2.16,-6.422825624423061
CCOC(=O)N1CCC(NC(=O)CSc2nnc(-c3cccc(C)c3)n2CCC(=O)[O-])CC1,C13219857_decoy,CASP3,Decoy,0,-6.55369,-6.27,-1.67,-5.492676189747457
CCOC(=O)c1cc(CC)sc1NC(=O)CSc1nc2nc(C)c(CC(=O)[O-])c(C)n2n1,C13221824_decoy,CASP3,Decoy,0,-8.96469,-7.15,-0.79,-7.408253001433782
CCCc1nnc(SCC(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)n1CC(=O)[O-],C13232202_decoy,CASP3,Decoy,0,-7.31778,-6.66,-0.88,-7.452500290188247
CCOc1ccc(-c2nnc(SCc3nc4cc(C(=O)[O-])ccc4n3CC)n2CC(=O)[O-])cc1,C13232246_decoy,CASP3,Decoy,0,-6.75699,-7.68,-1.36,-6.194645636599332
COc1cc([C@@H]2C(C)=C(c3ccc(OCC(=O)[O-])cc3)Nc3nnnn32)ccc1OCCC(C)C,C13268593_decoy,CASP3,Decoy,0,-8.53006,-7.17,-1.97,-7.466144115595595
COc1ccc(-c2nnc(Sc3ccc(/C=C/C(=O)[O-])cc3[N+](=O)[O-])n2CCC(=O)[O-])cc1,C13274191_decoy,CASP3,Decoy,0,-3.90057,-5.63,-0.82,-5.126224312948469
CCOc1ccc(-c2nnc(Sc3ccc(/C=C/C(=O)[O-])cc3[N+](=O)[O-])n2CC(=O)[O-])cc1,C13274342_decoy,CASP3,Decoy,0,-5.00491,-6.02,-0.49,-4.337611487119209
CCOc1ccc(-c2nnc(SCC(=O)O[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13403504_decoy,CASP3,Decoy,0,-8.36598,-6.91,-1.07,-7.290804717466988
COC(=O)c1ccccc1N(C)C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-],C13443062_decoy,CASP3,Decoy,0,-6.47863,-6.48,-1.46,-6.442011493026211
CCOc1ccc(-c2nnc(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)n2CC(=O)[O-])cc1,C13444003_decoy,CASP3,Decoy,0,-7.28288,-6.77,-0.99,-6.401377041434182
C=CCn1c(SCC(=O)NCc2ccc(C(=O)[O-])cc2)nnc1-c1cccc([N+](=O)[O-])c1,C13447090_decoy,CASP3,Decoy,0,-6.51906,-8.29,-2.14,-7.267802359374239
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(N(C)CCc3c(C)noc3C)c(C(=O)[O-])c2)c1,C21883422_decoy,CASP3,Decoy,0,-7.08368,-7.6,-1.94,-6.387119442186831
COCCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@@H]1c1ccccc1C(=O)OC,C24273758_decoy,CASP3,Decoy,0,-7.31628,-5.23,-3.16,-5.594727357958892
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCOCC3)N2[C@@H]1c1cc(OC)cc(OC)c1,C35700982_decoy,CASP3,Decoy,0,-9.06221,-5.14,-1.27,-7.007475149915615
CCC1=C(C(=O)OC)[C@H](c2cccc([N+](=O)[O-])c2)N2C(/C=C(\[O-])NCCOC)=CSC2=N1,C35704455_decoy,CASP3,Decoy,0,-7.55632,-6.81,-2.65,-6.811822329108164
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1cccc([N+](=O)[O-])c1,C36050894_decoy,CASP3,Decoy,0,-9.3692,-6.86,-3.52,-7.768013279088231
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1cccc([N+](=O)[O-])c1,C36058611_decoy,CASP3,Decoy,0,-8.79524,-6.97,-3.97,-7.500532364508065
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCOCC3)N2[C@H]1c1cccc(OC)c1OC,C36061150_decoy,CASP3,Decoy,0,-7.95444,-6.6,-1.42,-7.23112495840804
COc1ccccc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1N/N=C/c1cccc(OC)c1OC,C36287828_decoy,CASP3,Decoy,0,-6.80477,-7.42,-2.11,-6.266378158902127
CC(C)(C)CC(C)(C)NC(=O)[C@@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499627_decoy,CASP3,Decoy,0,-7.59823,-7.02,-1.76,-6.949008465682426
CC(C)(C)CC(C)(C)NC(=O)[C@H](c1ccc(O)cc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499628_decoy,CASP3,Decoy,0,-7.40088,-7.79,-3.96,-8.43078961049768
CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530176_decoy,CASP3,Decoy,0,-8.17218,-7.05,-2.13,-6.816061570054545
CCC(CC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36530204_decoy,CASP3,Decoy,0,-7.4497,-7.61,-4.65,-6.726357044208052
COc1ccc([C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(C)C(=O)c2cc([N+](=O)[O-])ccc2[O-])cc1OC,C36530235_decoy,CASP3,Decoy,0,-7.05701,-6.61,-1.64,-6.8167362883793325
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36570134_decoy,CASP3,Decoy,0,-7.21562,-8.57,-2.2,-9.02266475559652
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1c(O)cc(O)cc1O,C36570135_decoy,CASP3,Decoy,0,-8.24565,-7.73,-2.52,-8.403449884494218
CCCCNC(=O)[C@H](c1ccc([N+](=O)[O-])cc1)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])C(C)(C)C,C36585936_decoy,CASP3,Decoy,0,-5.48864,-6.56,-2.04,-5.947297878354342
Cc1ccc(CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccco2)o1,C36596689_decoy,CASP3,Decoy,0,-7.32548,-7.39,-3.38,-7.665972041530235
CCCCNC(=O)[C@H](c1ccco1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36596692_decoy,CASP3,Decoy,0,-7.18271,-5.76,-1.43,-6.483365544717815
CCCCOC(=O)c1ccc([N-]S(=O)(=O)c2cc(-c3nnnn3CC)ccc2OC)cc1,C02284389_decoy,CASP3,Decoy,0,-8.34698,-6.74,-1.27,-6.456896702800476
COC(=O)c1c(Br)c(OC)c(OC)c(OC)c1-c1c(C(=O)[O-])cc(OC)c(OC)c1OC,C38337979_decoy,CASP3,Decoy,0,-6.57963,-4.65,-3.76,-5.633399257385902
COc1ccc(/C=N/c2ccc(/N=C/c3ccc(OC)c(OC)c3C(=O)[O-])cc2)c(C(=O)[O-])c1OC,C18191679_decoy,CASP3,Decoy,0,-7.59577,-6.98,-1.68,-9.781078264844556
COc1cc([C@@H]2C=C(c3ccc(O[C@@H](C)C(=O)[O-])cc3)Nc3nnnn32)ccc1OCCC(C)C,C13077458_decoy,CASP3,Decoy,0,-9.06032,-8.05,-2.0,-7.396786713307396
COc1cc([C@@H]2C=C(c3ccc(O[C@H](C)C(=O)[O-])cc3)Nc3nnnn32)ccc1OCCC(C)C,C13077460_decoy,CASP3,Decoy,0,-8.5279,-7.87,-1.18,-7.8804313547419795
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703820_decoy,CASP3,Decoy,0,-9.15815,-6.26,-0.88,-8.519970284409297
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)c(C)c1,C40079571_decoy,CASP3,Decoy,0,-6.4725,-6.36,-3.39,-6.708997724628326
CCOC(=O)c1c([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])sc(C(=O)OC(C)C)c1C,C40945671_decoy,CASP3,Decoy,0,-5.92969,-6.58,-3.65,-5.497507021425879
CCOC(=O)c1c([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)sc(C(=O)OC(C)C)c1C,C40945863_decoy,CASP3,Decoy,0,-6.34039,-6.57,-3.17,-6.409210471533758
COC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])c1C,C13200907_decoy,CASP3,Decoy,0,-6.56236,-6.81,-1.57,-6.406512211128986
CCO/C([O-])=C1\C(COCCN2CC(=O)N(C)C2=O)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C29481509_decoy,CASP3,Decoy,0,-8.91817,-5.46,-2.56,-7.327606353669267
COc1ccc(Nc2nc(N/N=C/c3cccc([N+](=O)[O-])c3[O-])nc(Nc3ccc([N+](=O)[O-])cc3)n2)cc1,C14921186_decoy,CASP3,Decoy,0,-6.5159,-7.18,-1.26,-5.687622823805952
CCCCCCO[C@H]1Oc2ccc([N+](=O)[O-])cc2C(=O)/C1=C/Nc1ccc(C(=O)[O-])c(O)c1,C16638199_decoy,CASP3,Decoy,0,-9.52311,-7.22,-1.46,-7.354778294387368
[H]/N=C(C)\C(C(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)=C(\C)[O-],C58450091_decoy,CASP3,Decoy,0,-6.05766,-7.51,-1.16,-5.799942510721875
COc1cc(/C=N/Nc2nnn[n-]2)ccc1OCOc1ccc(/C=N/Nc2nnn[n-]2)cc1OC,C16196246_decoy,CASP3,Decoy,0,-8.12439,-8.77,-1.1,-9.05339484257552
CCN(CC)COc1nc(N/C([O-])=N/S(=O)(=O)c2ccccc2Cl)nc(N(C)C)n1,C59367187_decoy,CASP3,Decoy,0,-7.6929,-6.39,-2.05,-6.003031685034775
CCOC(=O)c1sc(NC(=O)[C@H](CC)Sc2nc([O-])c(C#N)c(-c3cccc(OC)c3)n2)nc1C,C59402701_decoy,CASP3,Decoy,0,-11.5858,-6.46,-1.91,-10.098089615830853
CCOC(=O)c1c(C)c2c([O-])nnc(SCCOc3ccc(S(=O)(=O)N(C)C)cc3)n2c1C,C62590137_decoy,CASP3,Decoy,0,-9.25051,-5.63,-1.06,-5.765101797856483
CC(=O)O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1,C03956808_decoy,CASP3,Decoy,0,-5.35506,-7.42,-4.17,-6.551295083542748
CCOC(=O)C1=C(C)N=C2C[C@@H](c3ccc(OC)c(OC)c3)CC(=O)C2[C@H]1c1ccc(OC(C)=O)c(OCC)c1,C06196088_decoy,CASP3,Decoy,0,-9.4675,-6.7,-2.78,-7.556276205524781
CCOc1ccc(-c2nc(COc3ccc(S(=O)(=O)N(CC)CC)cc3[N+](=O)[O-])cs2)cc1,C09283227_decoy,CASP3,Decoy,0,-7.07584,-6.46,-1.92,-5.7160524893812585
CCOC(=O)C1=C(C)N=C(C)C(C(=O)OCC)[C@H]1C(=O)OCC(=O)N(C)C1(C#N)CCCCC1,C09634576_decoy,CASP3,Decoy,0,-7.90453,-6.45,-1.81,-6.605541286699462
CCOC(=O)C1=C(C)N=C(C)C(C(=O)OCC)[C@H]1C(=O)OCC(=O)N(C)Cc1ccccc1C,C09156843_decoy,CASP3,Decoy,0,-7.13015,-6.17,-2.51,-7.526538921142719
CCOc1cc(C(=O)Oc2coc(CSc3nc(C)cc(C)n3)cc2=O)cc(OCC)c1OCC,C09829226_decoy,CASP3,Decoy,0,-8.60255,-7.23,-2.93,-7.638290583785694
CC(=O)OC[C@@]1(C)O[C@@](C)(SC(C)=O)[C@](C)(OC(C)=O)[C@](C)(OC(C)=O)[C@@]1(C)OC(C)=O,C09915857_decoy,CASP3,Decoy,0,-6.72369,-4.69,-1.56,-5.98889274820647
C=CC/N=c1\scc(-c2cc(OC)c(OC)c(OC)c2)n1/N=C/c1c(OC)cc(OC)cc1OC,C12311993_decoy,CASP3,Decoy,0,-8.43594,-5.6,-5.11,-7.012902332516699
CCOC(=O)Cn1/c(=N/C(=O)Cc2ccc(OC)c(OC)c2)sc2cc(C(=O)OCC)ccc21,C12353214_decoy,CASP3,Decoy,0,-8.19915,-6.36,-0.96,-7.048707961313483
CCOC(=O)C[C@@H](C(=O)OCC)[C@H](c1ccccc1)c1nc2ccccc2n1Cn1nnc2ccccc21,C15785037_decoy,CASP3,Decoy,0,-8.7677,-6.64,-2.15,-8.823511727538047
CCOCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)c1cccc(OC)c1,C16650675_decoy,CASP3,Decoy,0,-8.43811,-6.88,-2.29,-6.656060287183896
COC(=O)C1=C(C(=O)OC)N2C=CC=C[C@@]2(C/C=C/c2ccccc2)C(C(=O)OC)=C1C(=O)OC,C19908675_decoy,CASP3,Decoy,0,-6.58487,-5.2,-2.95,-5.828365387735291
CCCCn1nnc(N(C(=O)COc2ccc(C(C)C)cc2)C(=O)COc2ccc(C(C)C)cc2)n1,C20414427_decoy,CASP3,Decoy,0,-7.42782,-7.96,-1.34,-7.521222992415596
CCCCCN1C(=O)[C@@H](C(=O)OCC)[C@H](c2ccc(OC)c(OC)c2OC)n2c1nc1ccccc12,C20676049_decoy,CASP3,Decoy,0,-8.05577,-5.63,-2.83,-7.500166975222836
CCCCCN1C(=O)[C@H](C(=O)OCC)[C@@H](c2cc(OC)c(OC)cc2OC)n2c1nc1ccccc12,C20676072_decoy,CASP3,Decoy,0,-7.51776,-7.09,-2.56,-7.285970569055183
CCCCCN1C(=O)[C@@H](C(=O)OCC)[C@H](c2cc(OC)c(OC)cc2OC)n2c1nc1ccccc12,C20676076_decoy,CASP3,Decoy,0,-7.6864,-6.25,-3.26,-7.71511252359704
CCOC(=O)[C@H]1C(=O)N(CCOC)c2nc3ccccc3n2[C@H]1c1ccc(OCCC(C)C)c(OC)c1,C20802433_decoy,CASP3,Decoy,0,-5.33108,-5.77,-1.66,-4.305844732746509
C=CCn1c(C)nnc1SCC(=O)c1cc(C)n(-c2cc(C(=O)OC)cc(C(=O)OC)c2)c1C,C21177194_decoy,CASP3,Decoy,0,-8.51668,-7.36,-1.53,-7.27595522265728
CCCn1c(COC(=O)c2ccc(OC)c(OCC)c2)nc2cc(S(=O)(=O)N(C)C)ccc21,C22082259_decoy,CASP3,Decoy,0,-9.62792,-6.01,-3.86,-7.200431583173023
CCCCn1c(SCc2nnnn2-c2ccccc2)nc2cc(S(=O)(=O)N(CC)CC)ccc21,C24107876_decoy,CASP3,Decoy,0,-6.68945,-6.66,-2.56,-5.639176442341126
CCCCN(CC)c1ccc2nnc(CCc3nc(-c4ccc(OCc5ccccc5)cc4)no3)n2n1,C33130649_decoy,CASP3,Decoy,0,-9.27773,-7.85,-4.26,-6.207855876694143
CCCS(=O)(=O)N(CCOC)CC(=O)N(Cc1cccc(Cl)c1)C1CCN(C(=O)COC)CC1,C34910213_decoy,CASP3,Decoy,0,-8.38584,-5.32,-2.11,-6.719618799198709
CC(C)CN(Cc1cccn1C)C(=O)CN(CC(C)C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C35077958_decoy,CASP3,Decoy,0,-7.81998,-6.36,-2.71,-6.877485440728958
CCCCOc1nc(-c2cc(OC)c(OC)c(OC)c2)n(S(=O)(=O)c2cccc(C(F)(F)F)c2)n1,C35109430_decoy,CASP3,Decoy,0,-8.79117,-6.84,-3.69,-7.671415518603912
CCCN(CC(=O)N(Cc1ccccc1)Cc1cccn1C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C35337279_decoy,CASP3,Decoy,0,-7.09296,-7.87,-4.82,-8.978772118044803
C=CCN(CC(=O)N(Cc1ccccc1)Cc1ccc(C)o1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1,C35356253_decoy,CASP3,Decoy,0,-7.08279,-7.59,-4.56,-7.029651615791061
C=CCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)c1cc(OC)cc(OC)c1,C35765491_decoy,CASP3,Decoy,0,-8.08409,-6.25,-2.8,-7.144209193109899
CCCCCC(=O)N(CCN1CCOCC1)CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C16652406_decoy,CASP3,Decoy,0,-8.81052,-6.35,-3.62,-7.878412835749372
COCCn1c(CN(Cc2ccco2)C(=O)c2ccco2)cnc1S(=O)(=O)Cc1ccccc1,C36030282_decoy,CASP3,Decoy,0,-8.54156,-5.76,-4.31,-6.569421704488333
CCCCC[C@@H](C(=O)NC1CCCCC1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36499814_decoy,CASP3,Decoy,0,-8.78014,-5.32,-5.26,-6.998527156776399
CCCCCC(=O)Cc1cc(O)c(O)c2c1C(=O)Oc1cc(O)c(C(=O)[O-])c(CCCCC)c1O2,C14654306_decoy,CASP3,Decoy,0,-9.82369,-6.85,-1.81,-7.2630847342324465
CCCOc1ccc(-c2noc([C@@H]3CC(=O)N(Cc4ccc(OCC)c(OCC)c4)C3)n2)cc1OC,C38921957_decoy,CASP3,Decoy,0,-9.10114,-7.12,-1.74,-6.821459370751593
CCOC(=O)C1=C(C)C(C(=O)COC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)=N[C@@H]1C,C39617585_decoy,CASP3,Decoy,0,-7.90352,-7.33,-2.57,-6.020246360107068
COC(=O)c1ccc(CSc2nnc(COc3ccc(OC)cc3)n2-c2ccc(OC)cc2)o1,C39757282_decoy,CASP3,Decoy,0,-8.37845,-6.99,-3.34,-7.524763048980221
CCn1c(Cc2ccc(OC)c(OC)c2)nnc1SCC(=O)c1ccc(OC)c([N+](=O)[O-])c1,C39767726_decoy,CASP3,Decoy,0,-5.86825,-6.88,-1.92,-5.858532193719898
CC(=O)O[C@H]1O[C@H](COC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1,C40118294_decoy,CASP3,Decoy,0,-4.91749,-7.67,-2.65,-6.230558266601
C=CCn1c(SCc2nc(N3CCCCC3)ncc2C(=O)OCC)nnc1-c1ccnn1CC,C41389204_decoy,CASP3,Decoy,0,-8.50481,-6.0,-3.75,-7.216251120964695
CCCn1nccc1-c1nnc(SCc2nc(N3CCCCC3)ncc2C(=O)OCC)n1CC,C41389624_decoy,CASP3,Decoy,0,-7.61898,-6.95,-3.09,-7.768815973134365
CCOC(=O)c1cnc(N(C)C)nc1CSc1nnc(COc2ccc(Cl)cc2)n1CC,C41660686_decoy,CASP3,Decoy,0,-7.6979,-6.88,-1.83,-6.082513641302167
C=CCn1c(Cc2ccc(OC)cc2)nnc1SCc1nc(N(C)C)ncc1C(=O)OCC,C41660779_decoy,CASP3,Decoy,0,-8.10657,-6.79,-3.25,-6.839376413607761
C=CCn1c(COc2ccc(Cl)cc2)nnc1SCc1nc(N2CCCC2)ncc1C(=O)OC,C41663193_decoy,CASP3,Decoy,0,-9.21489,-6.17,-1.94,-7.050830126747746
C=CCn1c(SCc2nc(N3CCC(C)CC3)ncc2C(=O)OC)nnc1[C@H](C)Oc1ccccc1,C41663920_decoy,CASP3,Decoy,0,-9.60577,-6.92,-2.44,-8.451573571520552
C=CCn1c(COc2ccc(Cl)cc2)nnc1SCc1nc(N2CCC(C)CC2)ncc1C(=O)OC,C41663999_decoy,CASP3,Decoy,0,-10.162,-7.07,-2.47,-7.874110968155254
C=CCn1c(SCc2nc(N3CCC[C@@H](C)C3)ncc2C(=O)OC)nnc1[C@@H](C)Oc1ccccc1,C41664134_decoy,CASP3,Decoy,0,-10.1678,-7.89,-3.83,-8.803677032541357
CCOC(=O)c1ccc(/N=C2/C[C@@H](c3ccc(OC)cc3OC)N(c3ccc(C(=O)OCC)cc3)C2=O)cc1,C01439646_decoy,CASP3,Decoy,0,-7.79705,-5.1,-3.47,-5.690111651150756
CCCC[C@@H](c1nnnn1CCc1ccc(OC)c(OC)c1)N1CCN(c2ccccc2OC)CC1,C13505570_decoy,CASP3,Decoy,0,-7.69936,-6.36,-2.86,-6.42036743207118
CCCCN(CCCC)S(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1,C33733873_decoy,CASP3,Decoy,0,-6.65289,-6.51,-2.78,-6.654137403893158
CCCCn1c(SCC2=NC(=O)C3=C(C)[C@@H](C(=O)OCC)SC3=N2)nnc1-c1ccc(OC)cc1,C39945112_decoy,CASP3,Decoy,0,-8.67357,-7.39,-3.66,-7.306340411134793
CCOC(=O)C1=C(C)C(C(=O)COC(=O)c2ccccc2OS(=O)(=O)c2cc(C)ccc2C)=N[C@H]1C,C39946095_decoy,CASP3,Decoy,0,-8.13021,-7.66,-3.81,-6.742973771282545
CC(=O)O[C@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1,C40448718_decoy,CASP3,Decoy,0,-6.04929,-7.32,-2.8,-6.176296911772209
O=C([O-])CCCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1,C03827905_decoy,CASP3,Decoy,0,-7.84223,-6.97,-2.96,-5.9313646592795335
O=C([O-])CCC/C=C(\c1ccc(-c2nc(C(=O)NCCCCC3CCCCC3)co2)cc1)c1cccnc1,C29563061_decoy,CASP3,Decoy,0,-8.91211,-7.26,-2.83,-7.332548239910588
COc1cccc2c1O[C@H](C)C(/C=C1\SC(=S)N(CCCCCCCCCCC(=O)[O-])C1=O)=C2,C33514469_decoy,CASP3,Decoy,0,-8.90185,-7.45,-4.17,-8.15434937286411
COc1cccc2c1O[C@@H](C)C(/C=C1\SC(=S)N(CCCCCCCCCCC(=O)[O-])C1=O)=C2,C33514471_decoy,CASP3,Decoy,0,-9.17911,-7.24,-3.77,-10.22481868178347
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCCOC)cc1,C35022400_decoy,CASP3,Decoy,0,-8.16848,-6.05,-4.07,-7.699599931318899
CCCCCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NCCCC)c1ccc(C(F)(F)F)cc1,C36513808_decoy,CASP3,Decoy,0,-7.11952,-6.07,-2.5,-7.315375007981622
CCCCCCOc1c(Cl)cc(C(=O)c2c(C)c(C#N)c(=O)n(CCCOCC)c2[O-])cc1Cl,C38621305_decoy,CASP3,Decoy,0,-9.41846,-5.74,-3.69,-7.336401528715173
CCC[C@H](Cc1ccccc1)Cn1cc(C[N-]S(=O)(=O)Oc2ccccc2)c2cc(C(=O)OC)ccc21,C39491107_decoy,CASP3,Decoy,0,-9.02565,-7.95,-3.56,-7.696035998065607
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)cc2)[C@H]1c1ccc(OCCC(C)C)c(OC)c1,C40026646_decoy,CASP3,Decoy,0,-8.27604,-6.39,-2.06,-6.628597852156532
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)cc2)[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40026691_decoy,CASP3,Decoy,0,-8.66231,-6.4,-3.36,-6.90774163819051
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(OCCCCC)c(OC)c1,C40026778_decoy,CASP3,Decoy,0,-7.65136,-7.81,-1.8,-7.282503953471709
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(OCCCC)c(OCC)c1,C40026850_decoy,CASP3,Decoy,0,-8.94909,-6.66,-2.48,-7.910933846706587
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40026854_decoy,CASP3,Decoy,0,-7.93142,-7.93,-3.13,-7.80474181970416
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2)[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40026855_decoy,CASP3,Decoy,0,-8.5979,-6.48,-3.69,-8.55515265922123
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC)c(C)c2)[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40027172_decoy,CASP3,Decoy,0,-8.14445,-6.96,-3.15,-7.962142040262213
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC)c(C)c2)[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40027173_decoy,CASP3,Decoy,0,-8.861,-6.75,-2.31,-9.943529606861643
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCC)c(C)c2)[C@H]1c1ccc(OCCCCC)c(OC)c1,C40027256_decoy,CASP3,Decoy,0,-8.72208,-5.33,-2.12,-5.9286268642302895
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC=C)[C@@H]2c2ccc(OCCCCC)c(OC)c2)cc1C,C40027420_decoy,CASP3,Decoy,0,-8.95591,-6.11,-2.79,-6.916684612173802
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC=C)[C@H]2c2ccc(OCCCCC)c(OC)c2)cc1C,C40027421_decoy,CASP3,Decoy,0,-9.03039,-6.24,-2.57,-7.887568286687256
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CC=C)[C@@H]2c2ccc(OCCC(C)C)c(OCC)c2)cc1C,C40027496_decoy,CASP3,Decoy,0,-8.6357,-5.56,-2.82,-6.740656575244827
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@H]1c1ccc(OCCCC)c(OC)c1,C40027618_decoy,CASP3,Decoy,0,-8.32721,-5.13,-2.04,-6.825351594293961
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@H]1c1ccc(OCCCC)c(OCC)c1,C40027652_decoy,CASP3,Decoy,0,-9.3192,-5.48,-2.72,-7.006544272815725
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@H]1c1ccc(OCCCCC)c(OCC)c1,C40027654_decoy,CASP3,Decoy,0,-8.92158,-5.79,-6.14,-7.598668796631941
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@@H]1c1ccc(OCCCCC)c(OCC)c1,C40027655_decoy,CASP3,Decoy,0,-9.20605,-5.2,-2.12,-6.619717414299147
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCCCC)c(C)c2)[C@@H]1c1ccc(OCCCCCC)c(OC)c1,C40027711_decoy,CASP3,Decoy,0,-9.41644,-6.12,-1.64,-8.437510851037406
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@H]1c1ccc(OCCCC)c(OC)c1,C40027778_decoy,CASP3,Decoy,0,-8.11716,-6.57,-1.95,-7.527267824363794
C=CCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@H]1c1ccc(OCCCCCC)c(OC)c1,C40027870_decoy,CASP3,Decoy,0,-8.25668,-6.07,-4.36,-6.822097956832482
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCCCC)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40078425_decoy,CASP3,Decoy,0,-9.10022,-6.28,-4.28,-6.483069881289719
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCC)[C@H]2c2ccc(OCCC(C)C)c(OCC)c2)c(C)c1,C40083432_decoy,CASP3,Decoy,0,-8.52365,-5.99,-3.26,-6.45741394209147
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OC,C40084521_decoy,CASP3,Decoy,0,-8.49332,-5.53,-1.64,-6.637215238431437
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OCC,C40084587_decoy,CASP3,Decoy,0,-8.04239,-5.56,-2.65,-6.388047515760124
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OCC,C40084588_decoy,CASP3,Decoy,0,-7.47761,-5.6,-2.01,-6.527263078251165
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OCC,C40084590_decoy,CASP3,Decoy,0,-8.42146,-5.71,-4.61,-6.160230998354352
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OCC,C40084592_decoy,CASP3,Decoy,0,-7.41042,-5.75,-4.57,-6.139053533163238
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OC(C)C)cc2C)[C@@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40084594_decoy,CASP3,Decoy,0,-7.23221,-5.4,-2.42,-6.194428177449608
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OC,C40084940_decoy,CASP3,Decoy,0,-7.38176,-7.67,-2.23,-7.764336139801896
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2C)[C@H]1c1ccc(OCCC(C)C)c(OC)c1,C40084971_decoy,CASP3,Decoy,0,-8.76314,-7.46,-3.85,-10.998789009089888
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCCC)cc1OCC,C40085006_decoy,CASP3,Decoy,0,-8.6668,-5.31,-1.25,-7.350308559136903
CCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC)c(C)c2)[C@H]1c1ccc(OCCC(C)C)c(OCC)c1,C40085927_decoy,CASP3,Decoy,0,-8.6123,-6.73,-3.44,-7.536852550714154
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCC)[C@@H]2c2ccc(OCCC(C)C)c(OC)c2)cc1C,C40092391_decoy,CASP3,Decoy,0,-8.38356,-6.63,-4.44,-8.90451405690937
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCC)[C@@H]2c2ccc(OCCCC)c(OCC)c2)cc1C,C40092443_decoy,CASP3,Decoy,0,-7.96251,-4.99,-2.32,-5.8469745108068745
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCC)[C@H]2c2ccc(OCCCCC)c(OCC)c2)cc1C,C40092447_decoy,CASP3,Decoy,0,-8.64785,-5.0,-3.6,-6.849399339210454
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCCC)cc1OCC,C40093643_decoy,CASP3,Decoy,0,-7.14787,-5.67,-2.32,-5.254818964730933
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCCC)cc1OCC,C40093646_decoy,CASP3,Decoy,0,-8.30113,-6.34,-1.57,-7.348733124973831
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCCC)cc1OC,C40096237_decoy,CASP3,Decoy,0,-8.36343,-7.25,-3.12,-7.948777640718969
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1,C40096350_decoy,CASP3,Decoy,0,-9.45293,-6.79,-1.56,-7.197785920429743
CCOc1cc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40098658_decoy,CASP3,Decoy,0,-8.93929,-6.58,-2.24,-7.511038483323688
CCCCCCOc1ccc([C@@H]2NC(=O)C([O-])=C2C(=O)c2cc(C)c(OCC(C)C)c(C)c2)cc1OC,C40124313_decoy,CASP3,Decoy,0,-10.4729,-7.87,-2.85,-9.624924168421789
CCCCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC(C)C)cc1,C39899342_decoy,CASP3,Decoy,0,-8.62963,-5.28,-2.83,-6.9152711837601455
CCOC(=O)COc1ccc(/C=C2\S/C(=N\c3ccc(CC)cc3)C(C(=O)OCC)=C2[O-])cc1OCC,C59366115_decoy,CASP3,Decoy,0,-8.99204,-6.4,-2.98,-6.845941459566542
O=S(=O)([O-])c1ccc(OCCCCCCCCCCOc2ccc(S(=O)(=O)[O-])cc2)cc1,C05618623_decoy,CASP3,Decoy,0,-9.12517,-6.95,-1.57,-9.497661822864956
CCOCCC/N=C(\Nc1ccc(C(=O)[O-])cc1)N1CCN(CCOc2ccc(Cl)cc2)CC1,C21046322_decoy,CASP3,Decoy,0,-9.07089,-5.58,-2.01,-6.864042900024101
O=C([O-])COCC(=O)NCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc21,C22059627_decoy,CASP3,Decoy,0,-7.79112,-5.89,-2.02,-5.53767348425688
CCCCCC(=O)OC[C@H](CO[P@@](=O)([O-])OC1[C@@H](O)[C@@H](C)C(C)[C@@H](C)[C@H]1O)OC(=O)CCCCC,C27645569_decoy,CASP3,Decoy,0,-9.25404,-6.87,-3.08,-7.328352535425621
CCCCCC(=O)OC[C@H](CO[P@](=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@H](O)[C@H](C)[C@@H]1O)OC(=O)CCCCC,C27645707_decoy,CASP3,Decoy,0,-8.28819,-5.51,-5.13,-7.155146557053195
CCCCCOc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCCn2ccnc2)cc1OCC,C33508422_decoy,CASP3,Decoy,0,-10.1545,-5.38,-4.77,-7.559274558857314
CCOc1cc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCCn2ccnc2)ccc1OCCC(C)C,C33546958_decoy,CASP3,Decoy,0,-8.95929,-5.81,-3.22,-6.323067204648333
CCOc1cc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCCn2ccnc2)ccc1OCCC(C)C,C33546959_decoy,CASP3,Decoy,0,-8.41933,-6.67,-2.62,-7.865384506782722
CCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1OC,C33814258_decoy,CASP3,Decoy,0,-8.14408,-6.7,-2.39,-7.589525038514004
CCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1OCC,C33814326_decoy,CASP3,Decoy,0,-7.63186,-6.72,-2.39,-6.7591640597572535
CCCCCCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1,C33814329_decoy,CASP3,Decoy,0,-7.3851,-5.61,-3.71,-6.02312889615131
CO[C@H](/C=C/CC/C=C/C(=O)[O-])[C@@H](O)[C@@H](C)/C=C(\C)[C@H](O)[C@@H](C)C(=O)CCC[C@@H](CC(N)=O)CC(=O)[O-],C35464505_decoy,CASP3,Decoy,0,-6.60745,-6.84,-3.64,-6.133952391646131
CO[C@H](/C=C/CC/C=C/C(=O)[O-])[C@@H](O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](C)C(=O)CCC[C@@H](CC(N)=O)CC(=O)[O-],C35464512_decoy,CASP3,Decoy,0,-9.80823,-5.89,-2.96,-7.521008892282325
CCCCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCCOC)cc1OC,C35484219_decoy,CASP3,Decoy,0,-8.08373,-5.39,-4.15,-7.008594630365528
C=CCCOc1cccc(-c2nnc(CCC(=O)N(C)CCc3ccc(OC)c(OC)c3)c([O-])n2)c1,C35922545_decoy,CASP3,Decoy,0,-9.41252,-7.2,-1.1,-11.236598061407149
CCOC(=O)[C@]([N-]S(=O)(=O)c1ccc(C)cc1)(C(F)(F)F)P(=O)(OCC(C)C)OCC(C)C,C04277116_decoy,CASP3,Decoy,0,-6.03325,-5.57,-1.59,-4.799674365554436
CCCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C40003582_decoy,CASP3,Decoy,0,-8.40729,-5.78,-2.93,-7.602930550397828
CCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCCOC)cc1OCC,C40003676_decoy,CASP3,Decoy,0,-8.14926,-5.85,-3.33,-7.20525688742261
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2ccc(OCCCCC)c(OCC)c2)cc1C,C40052054_decoy,CASP3,Decoy,0,-9.1069,-7.18,-3.42,-9.743834998491025
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(OCCCCC)c(OCC)c2)cc1C,C40052056_decoy,CASP3,Decoy,0,-8.67168,-6.26,-1.84,-8.17153666406515
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c2ccc(OCCC(C)C)c(OCC)c2)cc1C,C40052058_decoy,CASP3,Decoy,0,-8.98748,-7.31,-2.51,-9.07752488032715
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCO)[C@H]2c2ccc(OCCCCCC)c(OC)c2)cc1C,C40052148_decoy,CASP3,Decoy,0,-9.52978,-5.2,-2.93,-5.801278182725247
CCCCCOc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40067167_decoy,CASP3,Decoy,0,-10.6656,-6.11,-3.36,-7.741685962413936
CCOc1cc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40076638_decoy,CASP3,Decoy,0,-8.27735,-7.25,-3.37,-8.662173698886832
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40079233_decoy,CASP3,Decoy,0,-8.40745,-7.16,-3.02,-9.27700149707908
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCO)cc1OCC,C40080009_decoy,CASP3,Decoy,0,-8.77994,-7.05,-3.33,-8.993825589020222
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCO)cc1OC,C40080109_decoy,CASP3,Decoy,0,-8.1504,-6.42,-4.1,-7.708234912237114
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1,C40083512_decoy,CASP3,Decoy,0,-8.41842,-7.09,-1.55,-8.657245848878514
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCCC)cc3C)=C([O-])C(=O)N2CCO)cc1OC,C40083725_decoy,CASP3,Decoy,0,-9.07399,-7.0,-4.56,-9.183346106993117
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCO)cc1OC,C40084490_decoy,CASP3,Decoy,0,-8.94601,-7.41,-1.77,-8.231980894528133
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084695_decoy,CASP3,Decoy,0,-9.72225,-6.88,-1.83,-8.688150668304361
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCO)cc1OCC,C40084855_decoy,CASP3,Decoy,0,-8.78866,-6.9,-2.61,-10.487449344352296
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40085309_decoy,CASP3,Decoy,0,-8.41066,-5.5,-3.67,-5.604697940701014
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40091702_decoy,CASP3,Decoy,0,-9.16722,-6.99,-1.84,-10.08412108300003
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCCCC)c(OCC)c2)cc1C,C40092817_decoy,CASP3,Decoy,0,-9.23884,-6.24,-2.15,-7.407877022931624
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCCC(C)C)c(OCC)c2)cc1C,C40092824_decoy,CASP3,Decoy,0,-8.27971,-6.06,-4.24,-7.105565093586667
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093193_decoy,CASP3,Decoy,0,-8.08937,-5.19,-3.09,-6.689389833492977
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093796_decoy,CASP3,Decoy,0,-7.95673,-6.53,-3.58,-6.859801529158276
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093803_decoy,CASP3,Decoy,0,-7.6445,-6.82,-2.33,-6.706441518403922
CCN(CC)c1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40093860_decoy,CASP3,Decoy,0,-7.78352,-6.47,-2.77,-6.794552311489232
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40094027_decoy,CASP3,Decoy,0,-8.43468,-6.01,-2.34,-6.747585758597972
CCOc1cc([C@@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40094028_decoy,CASP3,Decoy,0,-9.18806,-6.73,-2.54,-10.40406948749614
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40094370_decoy,CASP3,Decoy,0,-8.44148,-7.13,-2.61,-8.43395588311505
C=C1CC[C@@H]2[C@](C)(CC[C@@H](OC(=O)CCC(=O)[O-])[C@@]2(C)COC(=O)CCC(=O)[O-])[C@@H]1/C=C/C1=CCOC1=O,C43742898_decoy,CASP3,Decoy,0,-8.80844,-7.6,-2.61,-8.847317562462774
O=C([O-])CCOCCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12,C44122462_decoy,CASP3,Decoy,0,-7.18698,-5.17,-3.74,-5.348596191570334
CCOC(=O)COc1ccc(/C=C2\S/C(=N\c3ccc(OC)cc3)C(C(=O)OCC)=C2[O-])cc1OCC,C59437089_decoy,CASP3,Decoy,0,-8.84727,-6.38,-3.78,-6.996524849988157
CC(=O)OC[C@@H]1O[C@@H](SCc2cc(C(=O)[O-])oc2C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C59499381_decoy,CASP3,Decoy,0,-6.91727,-7.07,-1.82,-6.271772247936257
CC(C)=CCC[C@@H](C)CCC/C(C)=N/[N-]C1=NC(=O)[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S1,C22507050_decoy,CASP3,Decoy,0,-10.4743,-7.35,-3.92,-7.780071580833519
CC(C)=CCC[C@H](C)CCC/C(C)=N/[N-]C1=NC(=O)[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S1,C22507045_decoy,CASP3,Decoy,0,-8.82764,-7.34,-2.23,-7.778087339631813
CC(C)OC(=O)Nc1ncnc2c1ncn2C[C@@H](C)OC[P@@](=O)([O-])OCOC(=O)OC(C)C,C65747878_decoy,CASP3,Decoy,0,-7.4861,-5.49,-3.15,-7.015493293948358
CCCc1nc2cc(NC(=S)NC(=O)OCC)c(NC(=S)NC(=O)OCC)cc2[nH]1,C03914845_decoy,CASP3,Decoy,0,-8.25207,-6.74,-3.09,-6.73813000129938
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1,C02661789_decoy,CASP3,Decoy,0,-9.92837,-6.67,-1.13,-6.4654477647151225
CCOc1ccc([C@H](C(=O)NC(C)(C)CC)N(CCOC)C(=O)c2snc(C(N)=O)c2N)cc1,C06462096_decoy,CASP3,Decoy,0,-8.52486,-5.38,-3.17,-6.549556155171695
CCOC(=O)CN(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCC(C)C)c1ccc(C)cc1,C06546193_decoy,CASP3,Decoy,0,-8.31168,-5.54,-1.62,-7.519204211587781
CCSc1nc(NCCOC)c2cnn(CCNC(=O)[C@@H]3CC(=O)N(c4cccc(OC)c4)C3)c2n1,C08949326_decoy,CASP3,Decoy,0,-7.84496,-6.74,-1.5,-6.034616255612283
CCOc1ccc(CCNC(=O)c2nnn(CC(=O)Nc3cc(C)ccc3C)c2N)cc1OCC,C09678072_decoy,CASP3,Decoy,0,-7.52658,-7.16,-1.84,-5.470423460314062
CC(C)OCCCNc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COc1ccc(Cl)cc1Cl,C10386288_decoy,CASP3,Decoy,0,-8.45636,-7.14,-2.59,-8.301878861711442
COCCOC(=O)c1c(NC(=O)COC(=O)c2cccc(C)c2O)sc(C(N)=O)c1C,C11711843_decoy,CASP3,Decoy,0,-9.3886,-6.45,-1.22,-7.301213300912513
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(NCCOC)c([N+](=O)[O-])c2)cc1OC,C12695604_decoy,CASP3,Decoy,0,-8.2852,-5.38,-0.88,-5.927053228135053
COc1cc(NC(=S)/N=C(\NCc2ccco2)Nc2nc(C)cc(C)n2)cc(OC)c1OC,C14157311_decoy,CASP3,Decoy,0,-8.82686,-5.69,-1.31,-6.673571017787941
COc1cc(NC(=S)/N=C(\NCc2cccnc2)Nc2nc(C)cc(C)n2)cc(OC)c1OC,C14157681_decoy,CASP3,Decoy,0,-8.66473,-6.0,-2.01,-7.534267050414378
CC(=O)c1ccc(NC(=S)/N=C(\NCCc2ccc(S(N)(=O)=O)cc2)Nc2nc(C)cc(C)n2)cc1,C14157916_decoy,CASP3,Decoy,0,-9.40082,-7.05,-3.8,-6.927264557562702
Cc1cc(C)nc(N/C(=N/C(=S)NCc2ccco2)NCCc2ccc(S(N)(=O)=O)cc2)n1,C14157932_decoy,CASP3,Decoy,0,-8.35556,-6.85,-2.84,-6.991135543836982
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCC(C)C)c2ccncc2)cc1,C06089834_decoy,CASP3,Decoy,0,-8.43168,-5.52,-3.27,-7.03222636028081
CCOc1cc(C(=O)NNC(=O)c2ccc(NC)c([N+](=O)[O-])c2)cc(OCC)c1OCC,C15792857_decoy,CASP3,Decoy,0,-8.18986,-5.37,-1.24,-6.6664239386720565
CCOC(=O)C1=C(COC(=O)CNS(=O)(=O)c2ccc(NC)c([N+](=O)[O-])c2)NC(=O)NC1,C18261251_decoy,CASP3,Decoy,0,-8.66893,-6.44,-1.19,-7.275941130325106
CCOC(=O)C1=C(COC(=O)c2c(C)[nH]c(C(=O)OCC)c2C)NC(=O)N[C@@H]1c1ccco1,C18353298_decoy,CASP3,Decoy,0,-7.05936,-6.1,-2.98,-7.091599214436351
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cc(S(=O)(=O)N(C)C)ccc2NCCO)c1C,C18963898_decoy,CASP3,Decoy,0,-7.45326,-7.35,-2.68,-6.841235792600129
CCCCn1c(N)c(N(Cc2ccccc2)C(=O)CSc2nnc(C3CC3)n2CC)c(=O)[nH]c1=O,C19197537_decoy,CASP3,Decoy,0,-6.83217,-7.31,-2.26,-6.799336996320369
CCN[C@H]([NH2+]CC)C(=O)COc1ccc([C@H]2C(C#N)=C(N)Oc3[n-]c(C(F)(F)F)nc32)cc1OC,C19330025_decoy,CASP3,Decoy,0,-8.01331,-6.86,-3.34,-7.323565027723763
CC[NH+](CC)CCNc1nc2c(c([O-])nc(=O)n2C)n1C[C@@H](O)COc1ccc(Cl)cc1,C19833524_decoy,CASP3,Decoy,0,-8.74632,-5.07,-1.54,-6.044957508827699
CC[NH+](CC)CCNc1nc2c(c([O-])nc(=O)n2C)n1C[C@@H](O)COc1ccc(Cl)cc1Cl,C19912649_decoy,CASP3,Decoy,0,-8.61333,-5.82,-2.06,-7.418687830094228
CCOc1cc(/C=N/NC(=O)c2c(CN3CCOCC3)nnn2-c2nonc2N)ccc1OCC(N)=O,C19928397_decoy,CASP3,Decoy,0,-9.69296,-6.07,-0.96,-7.148845965302962
COc1ccc(/C=N/Nc2nc(SCC(=O)NC(C)(C)C)n[nH]2)cc1OCn1cccn1,C20424396_decoy,CASP3,Decoy,0,-9.4681,-7.24,-2.63,-7.216004858448673
COc1ccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCC(N)=O)s3)n[nH]2)cc1O,C20833953_decoy,CASP3,Decoy,0,-12.206,-7.31,-2.01,-8.107282706900879
CCCCN(C(=O)CSc1nnc(C)n1Cc1ccccc1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C20896543_decoy,CASP3,Decoy,0,-8.03181,-7.57,-2.63,-8.358077057602848
COCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3F)n2)s1,C21077398_decoy,CASP3,Decoy,0,-9.22383,-7.03,-3.07,-7.208651179566127
COCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(Cl)c3)n2)s1,C21081125_decoy,CASP3,Decoy,0,-9.10263,-7.54,-0.44,-6.645856237097676
CCCCN(C(=O)CSc1nnc(C2CC2)n1-c1ccccc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C21683411_decoy,CASP3,Decoy,0,-8.82774,-7.67,-1.4,-7.396776210475635
CCCCN(C(=O)CSc1nnc(C)n1Cc1ccccc1)c1c(N)n(CCC)c(=O)[nH]c1=O,C21684729_decoy,CASP3,Decoy,0,-7.48843,-6.29,-3.67,-7.185242234182448
COC(=O)CC[C@@H](NC(=O)c1ccc(N(C)Cc2nc3c(N)nc(N)nc3nc2C#N)cc1)C(=O)OC,C22055206_decoy,CASP3,Decoy,0,-8.85872,-6.82,-1.13,-7.263068468949445
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(CCC(N)=O)n2Cc2ccco2)c1C,C22408140_decoy,CASP3,Decoy,0,-9.86022,-7.41,-1.41,-10.84844572047358
COC(=O)C1=C(CSc2nnc(C3CC3)n2CCC(N)=O)N(C2CC2)C(=O)N[C@@H]1c1ccccc1,C22977467_decoy,CASP3,Decoy,0,-9.2287,-5.78,-2.8,-6.621424141037978
CCOC(=O)C1=C(CSc2nnc(SCC(N)=O)s2)NC(=O)N[C@H]1c1ccc(OC)cc1,C24960872_decoy,CASP3,Decoy,0,-10.5109,-6.77,-2.3,-8.295286175197479
CCCCN(C(=O)COC(=O)Cn1c(C)cc2ccccc21)c1c(N)n(CCC)c(=O)[nH]c1=O,C25190630_decoy,CASP3,Decoy,0,-7.68781,-7.72,-3.13,-7.879139353652497
CCOC(=O)Nc1cc(NC/C(CN(C)c2ccc(C(=O)OC)cc2)=N/O)c([N+](=O)[O-])c(N)n1,C16926991_decoy,CASP3,Decoy,0,-9.30819,-8.0,-1.74,-7.808135971788167
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,CASP3,Decoy,0,-8.65553,-6.94,-1.93,-6.724994020891577
CC(=O)N[C@@H]1[C@@H](Oc2ccc(C(C)=O)c(O)c2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C36597052_decoy,CASP3,Decoy,0,-7.16004,-6.62,-1.24,-6.99631436688237
CCOC(=O)[C@@H]1C(c2ccco2)=CS[C@H]1NC(=O)CSc1nc(C)c(CCC(=O)O)c(=O)[nH]1,C39668001_decoy,CASP3,Decoy,0,-9.12286,-6.44,-2.27,-7.296453542128602
C=CCn1c(CCNC(=O)c2ccc(OC)cc2)nnc1S[C@H](C)C(=O)Nc1nnc(C2CC2)s1,C39745376_decoy,CASP3,Decoy,0,-10.5512,-7.52,-4.44,-12.0363629507468
CCOC(=O)c1c(NC(=O)[C@@H](CC)n2c(N)nnc2SCC(=O)OC)sc2c1CCCC2,C40174044_decoy,CASP3,Decoy,0,-9.90159,-6.19,-1.72,-7.777782133828894
CCOC(=O)CSc1nnc(N)n1[C@@H](C)C(=O)Nc1sc2c(c1C(=O)OCC)CCCC2,C40174550_decoy,CASP3,Decoy,0,-9.684,-5.71,-4.47,-6.132288364034018
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CCCNC(N)=O)(C(=O)[O-])[NH2+][C@H]2c1ccc(OCCC)cc1,C33874529_decoy,CASP3,Decoy,0,-9.46735,-6.06,-2.63,-6.8342626161613325
C[C@H](Sc1nnc(CCC(N)=O)n1C[C@H]1CCCO1)C(=O)c1ccc(NS(C)(=O)=O)cc1,C45842395_decoy,CASP3,Decoy,0,-10.0836,-7.0,-1.84,-7.111030008275117
C[C@H](CNC(=O)c1cc(S(=O)(=O)NC[C@@H](C)CN2CCCC2=O)c[nH]1)CN1CCCC1=O,C57993605_decoy,CASP3,Decoy,0,-8.81333,-6.98,-1.52,-7.161444698515285
CC[NH+](CC)c1ccc(NC(=O)CSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)cc1,C20910222_decoy,CASP3,Decoy,0,-10.6441,-6.12,-4.3,-7.204143762806229
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)Nc3ccc(S(=O)(=O)NCC)cc3)n[nH]2)c1C,C59831302_decoy,CASP3,Decoy,0,-9.89246,-5.51,-3.03,-7.347855009973001
CCN(CC)c1ccc(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)cc1,C59878875_decoy,CASP3,Decoy,0,-8.43678,-6.73,-1.1,-6.94263127088009
CCCCN1C(=O)N=C([O-])[C@@H](N(CCC(C)C)C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)[C@H]1[NH3+],C39789660_decoy,CASP3,Decoy,0,-6.97598,-6.69,-3.7,-6.300228589487376
COc1cc(OS(=O)(=O)[O-])ccc1OCC[NH2+]C[C@H](O)COc1cccc2[nH]c3ccccc3c12,C65742973_decoy,CASP3,Decoy,0,-7.7814,-7.79,-2.34,-6.957325327924611
CC(=O)OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](NC(=O)C(F)(F)F)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C04963044_decoy,CASP3,Decoy,0,-6.08578,-7.28,-1.74,-5.754073247914449
CCOC(=O)CC[C@H](NC(=O)NNC(=O)CNC(=O)Nc1ncccn1)C(=O)OCC,C05606481_decoy,CASP3,Decoy,0,-8.88057,-6.92,-2.11,-7.131771911329208
CCOC(=O)CNC(=O)[C@H](c1ccc(O)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06547088_decoy,CASP3,Decoy,0,-10.1714,-6.18,-0.99,-7.568774802312272
CSCC(=O)N1C[C@@H](NC(=O)NC(C)C)C[C@H]1C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O,C04200842_decoy,CASP3,Decoy,0,-9.35597,-4.55,-3.19,-6.512421881945459
O=S1(=O)C[C@@H](O)[C@@H](S(=O)(=O)NCCCCCc2nnc(S(=O)(=O)Cc3ccccc3)o2)C1,C09028868_decoy,CASP3,Decoy,0,-8.94127,-7.3,-2.79,-6.568275348005189
CCCn1c(N)c(N(CCOC)C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2NC)c(=O)[nH]c1=O,C09493813_decoy,CASP3,Decoy,0,-7.36103,-6.51,-4.27,-6.099121369066492
CCCCOc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1,C09884226_decoy,CASP3,Decoy,0,-7.63954,-6.9,-1.1,-5.565962251560931
CCCCn1c(N)c(N(CCOC)C(=O)CSc2nnnn2Cc2ccco2)c(=O)[nH]c1=O,C11676849_decoy,CASP3,Decoy,0,-8.16484,-6.79,-1.18,-7.189403238326649
CCOc1ccc(C(=O)NCCNC(=O)c2nc(Cn3nc([N+](=O)[O-])cc3C)no2)cc1,C12411715_decoy,CASP3,Decoy,0,-6.74002,-7.17,-1.31,-5.390900084030638
CCOC(=O)CNC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(CC)cc1,C06822222_decoy,CASP3,Decoy,0,-9.76603,-7.44,-1.97,-8.233986858321572
CC(=O)OC[C@H]1O[C@@H](Sc2n[nH]c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C06143861_decoy,CASP3,Decoy,0,-5.92576,-6.84,-2.45,-6.731424688034049
O=C(C[C@@H]1C(=O)NCCN1C(=S)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)OC[C@H]1CCCO1,C14005569_decoy,CASP3,Decoy,0,-7.44497,-8.59,-1.63,-7.571960152099996
CCOC(=O)c1c(C)[nH]c(C(=O)OCc2nc(N)c3c(C(=O)OCC)c(C)oc3n2)c1C,C16209727_decoy,CASP3,Decoy,0,-7.82353,-6.14,-2.15,-5.759287800475583
CCOC(=O)C1=C(COC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)NC(=O)N[C@H]1c1ccco1,C18529704_decoy,CASP3,Decoy,0,-7.36482,-5.77,-3.18,-6.044837270808479
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CC[NH+](C)C)[C@H]2c2cccc([N+](=O)[O-])c2)c1C,C09271468_decoy,CASP3,Decoy,0,-7.29949,-6.65,-4.22,-6.709159181743995
COc1cc(/C=N/Nc2nc(SCC(=O)NC3CCCC3)n[nH]2)ccc1OCn1cccn1,C20228714_decoy,CASP3,Decoy,0,-7.63039,-7.03,-1.83,-5.997375875411223
COc1cc(CNC(=O)CSc2n[nH]c(N/N=C/c3cn(C)nc3C)n2)cc(OC)c1,C20423981_decoy,CASP3,Decoy,0,-9.1015,-6.25,-2.44,-5.6301265997250445
COc1ccc(/C=N/Nc2nc(SCC(=O)NC3CC3)n[nH]2)cc1OCn1cccn1,C20424486_decoy,CASP3,Decoy,0,-9.0236,-7.08,-1.13,-6.426836270010086
Cn1ccc(-c2nnc(SCC(=O)NNC(=S)NC[C@H]3CCCO3)n2C[C@H]2CCCO2)n1,C20613872_decoy,CASP3,Decoy,0,-9.8208,-6.02,-2.13,-7.184818294476632
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(N)=O)s2)n[nH]1)c1ccc(C)cc1,C20837937_decoy,CASP3,Decoy,0,-11.6998,-7.62,-2.15,-8.463616633586987
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)C(C)(C)C)n[nH]2)cc1,C20906172_decoy,CASP3,Decoy,0,-8.64447,-7.13,-0.58,-6.860448508460893
CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)c(C#N)c1C,C20910456_decoy,CASP3,Decoy,0,-9.8177,-7.56,-3.14,-7.287274166281231
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccc4c(c3)OCO4)n2N)cc1,C20913453_decoy,CASP3,Decoy,0,-9.78575,-6.39,-2.37,-6.674281882350033
COc1cc(/C=N/Nc2nnc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n2N)cc(OC)c1OC,C20920316_decoy,CASP3,Decoy,0,-10.2198,-6.81,-2.16,-7.729308178714406
CCOC(=O)c1ccc(N2C(=O)[C@@H](CC(N)=O)N(NC(=O)[C@@H]3C=C(OC)C=C(OC)C3)C2=S)cc1,C22133995_decoy,CASP3,Decoy,0,-8.59755,-7.41,-2.71,-7.3100718834379395
Cc1[nH]c(C(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)c(C)c1C(=O)OC(C)C,C22306603_decoy,CASP3,Decoy,0,-7.79309,-6.69,-2.17,-7.9247349798781155
CCOC(=O)C1=C(COC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)NC(=O)N[C@@H]1c1ccc(C)o1,C23014888_decoy,CASP3,Decoy,0,-6.76025,-6.99,-1.13,-7.592581309195447
C[C@H](Sc1nnc(CCC(N)=O)n1C[C@H]1CCCO1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C23368690_decoy,CASP3,Decoy,0,-10.4558,-7.23,-2.44,-7.081477472390135
C=CCn1c(SCC(=O)c2c(N)n(CCOC)c(=O)[nH]c2=O)nnc1[C@@H]1CCS(=O)(=O)C1,C24789849_decoy,CASP3,Decoy,0,-7.93148,-6.57,-1.6,-7.120422037163363
CCOc1cc(C(=O)NNC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc(OCC)c1OCC,C26957893_decoy,CASP3,Decoy,0,-7.82216,-6.52,-1.41,-8.02062101266909
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(C)CS[C@H]12)c1csc(N)n1,C03922078_decoy,CASP3,Decoy,0,-8.34533,-7.27,-2.14,-6.596477353562069
COc1ccc(C(=O)NCC(=O)N/N=C/[C@@H]2C=NN=C2c2ccc(OC)c(OC)c2)cc1OC,C39188298_decoy,CASP3,Decoy,0,-8.82846,-7.26,-1.2,-6.776551621609721
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1C(=O)OCC(=O)Nc1sccc1C(N)=O,C39547255_decoy,CASP3,Decoy,0,-7.3863,-5.34,-0.69,-5.224277581716295
COc1cc(C(=O)N2C[C@H](C(=O)NCCNC(=O)OC(C)(C)C)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39693447_decoy,CASP3,Decoy,0,-8.78806,-6.42,-1.0,-6.195376419986547
CCN(CC)S(=O)(=O)c1ccc(Nc2ncnc(N3CCN(CCO)CC3)c2[N+](=O)[O-])cc1,C40613413_decoy,CASP3,Decoy,0,-6.60787,-6.75,-1.54,-5.49264356507914
COc1ccc(-c2nnc(C[NH+]3CCC(C(=O)NCCc4ccc(S(N)(=O)=O)cc4)CC3)o2)cc1OC,C41279896_decoy,CASP3,Decoy,0,-10.5547,-9.0,-2.15,-11.938916821696711
CCCCCNc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COc1ccc([N+](=O)[O-])cc1,C10386097_decoy,CASP3,Decoy,0,-7.0507,-6.8,-0.95,-4.932476120826289
CC[C@@H](c1nnnn1C[C@@H]1CCCO1)N(CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C57641342_decoy,CASP3,Decoy,0,-8.76841,-7.87,-1.98,-7.797338622126746
C/C(=N\NC(=O)CCCSc1nnc(-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1N)c1ccncc1,C58991514_decoy,CASP3,Decoy,0,-7.88358,-7.38,-2.8,-5.982164366971434
COc1cc(/C=N/Nc2nc(SCCC(=O)NC(C)(C)C)n[nH]2)c([N+](=O)[O-])cc1O,C59820628_decoy,CASP3,Decoy,0,-7.03773,-6.72,-1.72,-5.050739486421803
COCCn1cc(/C=N/Nc2nc(SCCC(=O)Nc3nc4ccccc4s3)n[nH]2)cn1,C59887388_decoy,CASP3,Decoy,0,-10.2192,-5.96,-2.74,-7.51046740115964
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCCC(=O)Nc2sc3c(c2C#N)CCCC3)n[nH]1,C59888208_decoy,CASP3,Decoy,0,-10.6418,-6.29,-2.89,-7.312122797446904
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)NNc2ccc(F)cc2)n[nH]1,C59888363_decoy,CASP3,Decoy,0,-9.00434,-7.34,-2.44,-6.196884825205989
CCCC/C(C)=N/Nc1nc(SCC(=O)N2CCN(Cc3nnc(C)o3)CC2)n[nH]1,C59891301_decoy,CASP3,Decoy,0,-9.13339,-7.31,-1.49,-7.105064889715594
CCc1nnc(CN2CCN(C(=O)CSc3n[nH]c(N/N=C(\C)CC(C)C)n3)CC2)o1,C59892326_decoy,CASP3,Decoy,0,-8.98034,-5.97,-2.13,-6.204745096390002
COCCn1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3Cl)n2N)cn1,C59913971_decoy,CASP3,Decoy,0,-8.39068,-6.05,-3.92,-6.346435744668403
COCCn1cc(/C=N/Nc2nnc(SCC(=O)N[C@H](C)c3ccccc3)n2N)cn1,C59914150_decoy,CASP3,Decoy,0,-8.30203,-6.18,-1.06,-5.676360318271647
CCOC(Cn1cc(C(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)nn1)OCC,C60295746_decoy,CASP3,Decoy,0,-7.1819,-6.62,-2.24,-5.854358664881696
CCCCN(C(=O)COC(=O)C1=C(c2ccccc2)N=NC1)c1c(N)n(CCC)c(=O)[nH]c1=O,C39937806_decoy,CASP3,Decoy,0,-7.2961,-6.99,-1.9,-6.97716110239145
COc1ccc2c(c1)=C(CC[N-]/C(=N\C(=O)CS[C@H]1N=N[C@H](N)S1)Nc1nc(C)cc(C)n1)C[NH+]=2,C63493740_decoy,CASP3,Decoy,0,-9.83285,-6.33,-2.44,-8.494822004246656
COc1cc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2COc2ccc(F)cc2)ccc1OC(C)=O,C02372596_decoy,CASP3,Decoy,0,-8.24167,-6.29,-1.65,-7.78948078028786
CC(=O)OC[C@H]1O[C@@H](n2c(F)c(C)c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C04428199_decoy,CASP3,Decoy,0,-5.81555,-5.33,-4.74,-5.456561151263913
CC(=O)N[C@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C06073705_decoy,CASP3,Decoy,0,-6.08035,-5.0,-1.39,-5.709988051491954
CC(=O)N[C@H]1[C@@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C06073711_decoy,CASP3,Decoy,0,-5.39037,-7.3,-3.92,-6.645356230674656
COc1ccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)cc1OCC(N)=O,C08780745_decoy,CASP3,Decoy,0,-10.0845,-6.35,-2.01,-6.946160377184658
COc1cc(/C=C/C(=O)NC[C@H]2CN(c3cc(OC)c(OC)c(OC)c3)C(=O)O2)cc(OC)c1OC,C09105089_decoy,CASP3,Decoy,0,-8.52693,-6.25,-2.02,-6.844909272380759
COCC(=O)Nc1nnc(SCc2cc(=O)c(OC(=O)c3ccc([N+](=O)[O-])cc3)co2)s1,C09147606_decoy,CASP3,Decoy,0,-8.11187,-6.41,-3.04,-7.17123745498952
COC(=O)c1sc(NC(=O)COC(=O)CN2C(=O)NC(C)(C)C2=O)c(C(=O)OC)c1C,C09388518_decoy,CASP3,Decoy,0,-7.99611,-6.72,-1.45,-8.282565621955435
CCOC(=O)c1[nH]c(C)c(C(=O)OCc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)c1C,C09579756_decoy,CASP3,Decoy,0,-9.09969,-6.31,-1.58,-8.162476020256404
CCOC(=O)c1cnc(SCC(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)nc1N,C09961543_decoy,CASP3,Decoy,0,-7.70562,-7.41,-0.64,-5.706057207490598
CSc1ccc(S(=O)(=O)NCC(=O)OCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-],C09961570_decoy,CASP3,Decoy,0,-5.98725,-7.13,-0.99,-5.407041521263951
COc1cc(/C=C\C(=O)NCCS(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)cc(OC)c1OC,C10590899_decoy,CASP3,Decoy,0,-6.98632,-6.11,-2.54,-6.675821383156097
CCOC(=O)c1sc(NC(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c(C(=O)OCC)c1C,C10601763_decoy,CASP3,Decoy,0,-8.56391,-7.19,-4.17,-9.05303178307116
CC(=O)N[C@@H]1[C@@H](Oc2nc3cc(C)ccc3o2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C11859887_decoy,CASP3,Decoy,0,-7.4047,-7.63,-2.21,-7.202483562152097
CC(=O)N[C@H]1[C@H](Oc2nc3cc(C)ccc3o2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C11859890_decoy,CASP3,Decoy,0,-6.89008,-7.59,-3.87,-6.592561286834622
CCOC(=O)c1ccc(NC(=O)N[C@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)cc1,C12411067_decoy,CASP3,Decoy,0,-6.21913,-6.23,-2.02,-7.585587921867631
COC(=O)/C=C/c1cn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(=O)[nH]c1=O,C12652048_decoy,CASP3,Decoy,0,-6.10223,-7.41,-1.02,-6.34980366747396
COC(=O)/C=C/c1cn([C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)[nH]c1=O,C12654655_decoy,CASP3,Decoy,0,-6.5556,-6.48,-1.38,-5.448022549393
CCOC(=O)[C@H]1[C@H](C)[C@H](C(=O)OCC)S[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])c1[N+](=O)[O-],C12849481_decoy,CASP3,Decoy,0,-7.62456,-5.67,-1.3,-7.548964169137303
CCOC(=O)[C@H]1[C@H](C)[C@@H](C(=O)OCC)S[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])c1[N+](=O)[O-],C12849486_decoy,CASP3,Decoy,0,-6.16493,-5.77,-1.17,-4.9900422671854745
CCOc1nn(CC)cc1-c1nnc(SCC(=O)NCc2ccc3c(c2)OCO3)n1CCOC,C12875012_decoy,CASP3,Decoy,0,-8.52862,-7.27,-1.64,-9.313063507993093
COc1ccc(C(=O)NN2C[C@H](C(=O)OCC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1OC,C13856699_decoy,CASP3,Decoy,0,-7.10555,-8.24,-2.0,-7.108002710859823
COc1ccc(C(=O)NCC(=O)OCc2nc(N)nc(Nc3ccc(F)cc3)n2)cc1OC,C16617204_decoy,CASP3,Decoy,0,-8.35214,-7.15,-1.98,-7.32156776346453
CSc1nc(N[C@@H]2OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)n1C,C16953040_decoy,CASP3,Decoy,0,-7.34906,-7.29,-3.46,-7.320769504623509
COc1ccc2[nH]cc(CCN/C(=N\C(=O)CSc3nnnn3C)Nc3nc(C)cc(C)n3)c2c1,C18063607_decoy,CASP3,Decoy,0,-8.36427,-8.15,-1.88,-7.320586712211097
CCCCCCc1nc(SCc2nc(N)nc(N)n2)c2c(=O)n(C)c(=O)n(CCC)c2n1,C19297935_decoy,CASP3,Decoy,0,-8.95213,-6.02,-4.57,-8.254499239515003
C=CCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)s1,C20910584_decoy,CASP3,Decoy,0,-9.49662,-5.85,-1.37,-6.251822632793811
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2nnc(SC(C)C)s2)n1N,C20912183_decoy,CASP3,Decoy,0,-8.52741,-7.54,-3.39,-6.068659264418298
COc1cc(/C=N/Nc2nnc(SCC(=O)Nc3ccc(C)cc3F)n2N)cc(OC)c1OC,C20919517_decoy,CASP3,Decoy,0,-9.62633,-5.83,-2.44,-6.373074070894121
CCOC(=O)N1CCN(C(=O)CSc2nnc(NC(=O)c3cn(CC)nc3OCC)s2)CC1,C21011548_decoy,CASP3,Decoy,0,-8.3313,-6.97,-4.87,-5.897285391775537
CCN(CC)c1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1,C21421474_decoy,CASP3,Decoy,0,-7.31182,-5.74,-2.51,-5.856638290502532
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)c1cccc(CN2C(=O)CNC2=O)c1,C25796840_decoy,CASP3,Decoy,0,-9.48215,-6.22,-1.26,-6.52688929048562
CC(=O)N[C@@H]1[C@@H](OC(=O)c2ccncc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C35052893_decoy,CASP3,Decoy,0,-5.31078,-6.13,-2.7,-6.481563201261558
CCOC(=O)[C@@H]1[C@H](C)[C@H](C(=O)OCC)S[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])c1[N+](=O)[O-],C36083357_decoy,CASP3,Decoy,0,-6.3967,-6.12,-1.3,-6.262223957893949
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36528283_decoy,CASP3,Decoy,0,-6.86918,-6.76,-2.06,-7.669940963264657
COc1ccc(CCN(CC(=O)NC(C)(C)C)C(=O)Cn2nnc(-c3ccc(C)o3)n2)cc1OC,C13151240_decoy,CASP3,Decoy,0,-8.16309,-7.16,-2.18,-7.983899466334979
COCCCNC(=O)c1cc2ccc(OC(=O)COc3ccc([N+](=O)[O-])cc3)cc2oc1=O,C40895257_decoy,CASP3,Decoy,0,-6.85334,-6.42,-1.74,-5.608914794733471
CCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccc(OCC(=O)N(CC)CC)c(OC)c1,C40924116_decoy,CASP3,Decoy,0,-6.81907,-6.54,-1.25,-6.187418954649398
CCOC(=O)Cn1nnnc1CN(Cc1ccc2c(c1)OCO2)Cc1cc2cccc(C)c2[nH]c1=O,C00926437_decoy,CASP3,Decoy,0,-8.52678,-7.73,-1.33,-8.82444360248528
[H]/N=C1C(=C/c2ccc(OCCOc3ccc([N+](=O)[O-])cc3)c(OC)c2)/C(=O)N=C2SC(CCC)=NN2/1,C09659357_decoy,CASP3,Decoy,0,-7.45362,-5.35,-1.66,-5.216053989274285
COc1cc2cc([C@@H](c3nnnn3C(C)(C)C)N(Cc3ccco3)C[C@@H]3CCCO3)c(=O)[nH]c2cc1OC,C57608894_decoy,CASP3,Decoy,0,-8.62592,-6.46,-2.62,-5.276060127803602
CCOC(=O)Cn1nnnc1CN(Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C[C@@H]1CCCO1,C57640466_decoy,CASP3,Decoy,0,-9.01819,-7.48,-1.38,-7.153626333853112
CCOC(=O)Cn1nnnc1CN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C[C@H]1CCCO1,C57642750_decoy,CASP3,Decoy,0,-8.66476,-7.5,-2.11,-8.062963483208652
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1ccco1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C13495729_decoy,CASP3,Decoy,0,-8.6042,-8.26,-1.99,-8.138653541057552
COCCn1nnnc1[C@H](C(C)C)N(Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C[C@@H]1CCCO1,C13498815_decoy,CASP3,Decoy,0,-9.43803,-7.7,-1.6,-8.195278141477559
CC[C@H](c1nnnn1CCOC)N(Cc1ccco1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C13510425_decoy,CASP3,Decoy,0,-8.48322,-8.17,-1.91,-8.01381505748536
COc1cc(/C=N/Nc2nc(SCC(=O)NCc3ccc(Cl)cc3)n[nH]2)c([N+](=O)[O-])cc1O,C59040045_decoy,CASP3,Decoy,0,-7.94031,-5.83,-3.22,-6.151972042822453
C=CCn1c(Cn2nnc3ccccc32)nnc1SCC(=O)NCc1nnc(C(C)C)o1,C59877709_decoy,CASP3,Decoy,0,-7.71268,-7.49,-2.26,-7.355594420351718
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,CASP3,Decoy,0,-7.78165,-6.83,-3.16,-6.609963669638378
CC(=O)N[C@H]1[C@@H](Oc2ccc3oc(=O)sc3c2C)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C62725289_decoy,CASP3,Decoy,0,-7.32909,-6.19,-1.02,-6.757325163298607
CC(=O)OC[C@@H]1O[C@@H](n2c(F)c(C)c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C04428197_decoy,CASP3,Decoy,0,-6.73167,-6.94,-3.75,-8.275333848197782
COC(=O)C1=C(N)n2c(s/c(=C\c3ccc(OC)c(OC)c3)c2=O)=C(C(=O)OC)[C@@H]1c1ccc(OC)c(OC)c1,C01879261_decoy,CASP3,Decoy,0,-8.72519,-6.12,-2.18,-6.35345188830744
CCCCn1c(N)c(N(CCC(C)C)C(=O)COC(=O)c2ccc([N+](=O)[O-])s2)c(=O)[nH]c1=O,C09129165_decoy,CASP3,Decoy,0,-7.65787,-7.16,-1.32,-7.982861445186725
COc1cc(C(=O)Oc2coc(CSc3nnc(NC(C)=O)s3)cc2=O)c([N+](=O)[O-])cc1OC,C09147501_decoy,CASP3,Decoy,0,-7.2119,-6.84,-2.7,-5.889209696171394
C=CCc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(OCC)c1OCC(=O)OC,C09323844_decoy,CASP3,Decoy,0,-8.83267,-6.88,-1.08,-7.015038670170607
COc1cc(/C=N/NC(=O)CSc2nncn2C)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C09455141_decoy,CASP3,Decoy,0,-7.08344,-6.27,-0.85,-5.99848127931657
CSc1ccc(S(=O)(=O)NCC(=O)OCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-],C09961580_decoy,CASP3,Decoy,0,-5.7912,-7.08,-1.91,-5.298376242600296
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,C09974846_decoy,CASP3,Decoy,0,-6.68681,-6.48,-2.46,-6.843431442380649
COc1cc(C(=O)NCCn2ncc3c(=O)n(Cc4cccc([N+](=O)[O-])c4)cnc32)cc(OC)c1OC,C12071844_decoy,CASP3,Decoy,0,-6.79506,-7.49,-2.0,-6.193967612163116
CCOC(=O)C1=C(COC(=O)Cn2nc(-c3ccc(F)cc3)oc2=O)NC(=O)N[C@H]1c1ccc(C)o1,C12792714_decoy,CASP3,Decoy,0,-7.3619,-7.2,-2.9,-6.731238513624981
COc1ccc(C(=O)NCCOc2ccc3nnc(-c4ccc(OC)c(OC)c4)n3n2)cc1OC,C13527468_decoy,CASP3,Decoy,0,-7.70133,-6.62,-2.9,-5.950179340314822
COc1ccc(-c2nnc3ccc(OCCNC(=O)c4cc(OC)c(OC)c(OC)c4)nn23)cc1OC,C13527472_decoy,CASP3,Decoy,0,-8.00648,-6.82,-1.55,-6.284575610286878
CC(=O)OC[C@H]1O[C@@H](n2c(F)c(C)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C13574803_decoy,CASP3,Decoy,0,-6.34205,-6.68,-2.27,-6.452010650061832
CC(=O)OC[C@H]1O[C@H](n2c(F)c(C)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C13574814_decoy,CASP3,Decoy,0,-6.00012,-7.08,-3.37,-7.893180015995899
CCNc1nc(NCC)n2c(SCC(=O)NC3=C(C(=O)OCC)[C@@H]4CCC[C@H]4S3)nnc2n1,C16689850_decoy,CASP3,Decoy,0,-8.02573,-7.08,-1.39,-7.018053334244018
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)s1,C16808595_decoy,CASP3,Decoy,0,-8.03174,-6.75,-0.67,-6.623936572369877
CCOc1cc(C(=O)OCc2c(C(=O)OC)sc(N)c2C(=O)OC)c([N+](=O)[O-])cc1OC,C19473306_decoy,CASP3,Decoy,0,-7.37457,-5.34,-1.1,-6.050365030968721
CCn1c(CCn2nc([N+](=O)[O-])cc2C)nnc1SCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1,C20214462_decoy,CASP3,Decoy,0,-6.50909,-6.34,-1.57,-6.583689329795225
CC(C)n1cc(/C=N/Nc2nc(SCCC(=O)Nc3cccc(N4CCCC4=O)c3)n[nH]2)cn1,C20911021_decoy,CASP3,Decoy,0,-9.17451,-6.45,-2.27,-6.055438134071265
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCCc3ccc(OC)cc3)n2N)cc1,C20913551_decoy,CASP3,Decoy,0,-9.48612,-4.84,-2.02,-6.140487701481284
COC(=O)c1ccc(/C=N/Nc2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)cc1,C20924022_decoy,CASP3,Decoy,0,-8.17694,-7.76,-1.63,-7.028727211219087
CC[C@@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(OC)c(O)c3)n2)s1,C21078636_decoy,CASP3,Decoy,0,-10.1179,-6.24,-1.79,-6.643896044273648
CCOC(=O)c1cc(C(=O)N(CC(C)C)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)cc([N+](=O)[O-])c1,C21355817_decoy,CASP3,Decoy,0,-7.11711,-5.6,-1.67,-5.987810477224481
COC(=O)Cc1c(C(=O)OC)sc2[nH]c(CSc3nnnn3C[C@@H]3CCCO3)nc(=O)c12,C21739502_decoy,CASP3,Decoy,0,-8.7178,-6.44,-1.93,-6.563369291809031
CC(=O)N[C@@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C22064770_decoy,CASP3,Decoy,0,-5.12657,-5.57,-4.14,-5.272955312706913
COc1cc(-c2nnc(COC(=O)c3[nH]c(C)c(C(=O)OC(C)C)c3C)o2)cc(OC)c1OC,C22306160_decoy,CASP3,Decoy,0,-8.69433,-7.62,-1.61,-6.599762489105857
CCOC(=O)C1=C(CSc2nnc(COc3ccc(F)cc3)n2N)NC(=O)N[C@@H]1c1ccco1,C25629278_decoy,CASP3,Decoy,0,-8.09419,-7.37,-3.03,-5.520919116950183
CCOC(=O)Cc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C17260645_decoy,CASP3,Decoy,0,-7.62021,-6.89,-3.12,-7.996846217559868
CCOC(=O)c1cccc(N2C(=O)c3c(C(=O)OC)ncn3C[C@]2(C)C(=O)NCc2ccccc2OC)c1,C33048176_decoy,CASP3,Decoy,0,-9.08498,-6.22,-3.51,-7.121991806007001
COc1cc(/C=N\Nc2nncn2/N=C\c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC,C33826577_decoy,CASP3,Decoy,0,-7.60439,-6.3,-2.75,-7.219223144836272
CCOC(=O)CNC(=O)N(Cc1cc(-c2cc(OC)c(OC)c(OC)c2)on1)C[C@H]1CCCO1,C34922437_decoy,CASP3,Decoy,0,-8.08425,-5.99,-2.91,-7.2006175426251495
CC(=O)N[C@H]1[C@@H](OC2=C[C@@H]3OC(=O)C=C(C)[C@H]3C=C2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C35052816_decoy,CASP3,Decoy,0,-7.39318,-7.9,-4.08,-8.760187391237467
COc1cc(-c2n[nH]c(=S)n2/N=C/c2cc(OC)c(OC(C)=O)c(OC)c2)cc(OC)c1OC,C09380171_decoy,CASP3,Decoy,0,-8.01677,-5.22,-2.05,-6.166187784057736
CCOC(=O)N1CCN(C(=O)CSc2ccc3nnc(CCNC(=O)c4ccc(OC)cc4)n3n2)CC1,C09578557_decoy,CASP3,Decoy,0,-9.53332,-6.47,-2.71,-6.770722186310887
CC(=O)OC[C@@H]1O[C@@H](S[C@H]2N=NC(=O)NC2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C38826874_decoy,CASP3,Decoy,0,-6.62301,-5.54,-1.78,-5.294811420965475
CCn1c(CNC(=O)c2ccc(OC)c(OC)c2)nnc1SCC(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C39755873_decoy,CASP3,Decoy,0,-6.82745,-7.5,-2.89,-6.163845351910484
C=CCn1c(CNC(=O)c2ccc(OC)c(OC)c2)nnc1SCC(=O)c1ccc(C)c([N+](=O)[O-])c1,C39759353_decoy,CASP3,Decoy,0,-7.17137,-8.4,-2.27,-10.595665382843718
CCOC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)C2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC)=N[C@H]1C,C40061864_decoy,CASP3,Decoy,0,-7.3812,-5.83,-1.56,-5.8870900119950536
CCOC(=O)C1=C(C)C(C(=O)[C@H](C)OC(=O)C2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC)=N[C@H]1C,C40061870_decoy,CASP3,Decoy,0,-7.47822,-6.73,-1.4,-8.8154174825823
N#C/C(=C\c1ccc(OC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1)C(=O)NCc1ccco1,C40935682_decoy,CASP3,Decoy,0,-7.79253,-7.42,-1.68,-9.4770928716233
CC(=O)OC[C@@H]1O[C@@H](n2c(F)c(C)c(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C43732319_decoy,CASP3,Decoy,0,-6.3088,-6.4,-2.79,-6.270090057873541
CC[C@@H](c1nnnn1C[C@H]1CCCO1)N(Cc1ccc2c(c1)OCO2)Cc1cc2ccc(OC)cc2[nH]c1=O,C01374659_decoy,CASP3,Decoy,0,-9.37291,-7.26,-2.06,-8.055687109049046
CCOC(=O)Cn1nnnc1CN(Cc1cccs1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C57640479_decoy,CASP3,Decoy,0,-8.79625,-6.4,-1.59,-6.652705895654687
CCOC(=O)Cn1nnnc1[C@H](CC)N(Cc1ccco1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C13495731_decoy,CASP3,Decoy,0,-8.73214,-8.71,-1.86,-10.620643257523122
COCCn1nnnc1[C@@H](C(C)C)N(Cc1ccco1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13498816_decoy,CASP3,Decoy,0,-9.11079,-7.88,-2.31,-9.13539229263269
COC(=O)Oc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2OC)S(C)(=O)=O)cc1OC,C20212090_decoy,CASP3,Decoy,0,-8.44106,-6.7,-2.89,-9.788651645869953
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)[C@H]2C(C)=NC(C(=O)OC)=C2C)[C@H]1c1ccc([N+](=O)[O-])cc1,C20219710_decoy2,CASP3,Decoy,0,-7.17469,-6.37,,-6.829905068444504
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]2c2cccc([N+](=O)[O-])c2)C(C)=N1,C09177242_decoy,CASP3,Decoy,0,-8.57438,-6.55,-1.41,-8.128577138538436
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)[C@H]2C(C)=NC(C(=O)OC)=C2C)[C@H]1c1cccc([N+](=O)[O-])c1,C20219706_decoy,CASP3,Decoy,0,-8.19761,-6.22,-1.17,-6.826710074561848
CC(=O)OC[C@@H]1O[C@@H](n2cnc3c(Sc4ccc(C)cc4)nc(N)nc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C65734260_decoy,CASP3,Decoy,0,-7.01809,-6.18,-1.85,-6.177910864234233
CCOC(=O)CNC(=O)[C@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1,C06547149_decoy,CASP3,Decoy,0,-10.122,-3.02,-0.98,-5.998060732480544
COc1cc2c(c(OC)c1OC)-c1ccc(NCCCC[C@@H]([NH3+])C(=O)[O-])c(=O)cc1[C@@H](N(C)N=O)CC2,C08740219_decoy,CASP3,Decoy,0,-8.65621,-6.57,-2.44,-7.07487886602932
CCOc1cc([C@@H]2C(C#N)=C(N)OC(COC)=C2C(=O)OC)cc([N+](=O)[O-])c1OC(=O)N1CCOCC1,C08856061_decoy,CASP3,Decoy,0,-7.49911,-6.29,-2.89,-6.605454075506498
Cn1c(=O)[nH]c(=O)c2c1nc(NCCO)n2CCCn1c(NCCO)nc2c1c(=O)[nH]c(=O)n2C,C10049603_decoy,CASP3,Decoy,0,-8.60281,-6.94,-0.84,-7.365625182817238
CCOC(=O)c1sc(N)c(C#N)c1COC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2,C10069786_decoy,CASP3,Decoy,0,-8.97698,-6.96,-0.82,-7.7846383430397506
CCOC(=O)CNC(=O)CN(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06546489_decoy,CASP3,Decoy,0,-9.20232,-5.46,-1.95,-6.954912328740943
C/C(=N\OCC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2,C12980038_decoy,CASP3,Decoy,0,-7.37829,-7.72,-1.07,-6.09008117634867
CCOC(=O)Cn1nnnc1C[NH+](Cc1ccco1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13033832_decoy,CASP3,Decoy,0,-7.76355,-8.59,-2.76,-7.884204993167006
COCCn1nnnc1C[NH+](CCCO)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3,C13033869_decoy,CASP3,Decoy,0,-7.68896,-6.04,-1.29,-6.336997413809019
CCOC(=O)c1sc(NC(=O)CSc2nnc(CSc3nc(N)cc(N)n3)n2C)nc1C,C06147851_decoy,CASP3,Decoy,0,-9.68219,-6.7,-2.12,-5.987374601553548
CC[C@H](c1nnnn1CCOC)[NH+](Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C[C@@H]1CCCO1,C13064476_decoy,CASP3,Decoy,0,-7.31729,-7.55,-1.91,-7.160065693171382
CCOC(=O)c1cnc(SCC(=O)OCC(=O)NC(=O)c2cccn2C)nc1N,C09635406_decoy,CASP3,Decoy,0,-7.29019,-6.66,-1.77,-5.874235887396155
CCOc1cc(C[NH2+]CCNC(=O)c2nonc2N)ccc1OCC(=O)NC(C)(C)C,C16688911_decoy,CASP3,Decoy,0,-8.37909,-6.34,-1.55,-6.46260807002002
Cn1c(N)c(C(=O)COC(=O)CCCNS(=O)(=O)c2cccc3nsnc23)c(=O)n(C)c1=O,C19077198_decoy,CASP3,Decoy,0,-8.07003,-6.99,-2.19,-6.612413845080339
COC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)n2C[C@@H]2CCCO2)sc(C(N)=O)c1C,C20295052_decoy,CASP3,Decoy,0,-8.46519,-6.16,-1.06,-7.5914362205537245
CCOC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)CN1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C13758042_decoy,CASP3,Decoy,0,-9.41549,-6.33,-2.49,-7.307507946613144
COCCN(C(=O)CN1CC[NH+](CC(=O)N2CCCC2)CC1)c1c(N)n(CC(C)C)c(=O)[nH]c1=O,C20798334_decoy,CASP3,Decoy,0,-7.8107,-6.83,-0.89,-6.324461681113261
COC(=O)c1ccc(/C=N/Nc2nnc(SCC(=O)NCc3ccco3)n2N)cc1,C20806092_decoy,CASP3,Decoy,0,-8.40524,-7.32,-1.06,-6.352436866599696
CCOC(=O)C(C(=O)OCC)n1c(CN2CC[NH+](CC)CC2)nc2c1c(=O)[nH]c(=O)n2C,C20848137_decoy,CASP3,Decoy,0,-7.94298,-5.77,-1.8,-7.289185560025673
CCc1nnc(CN(C)C(=O)CSc2n[nH]c(N/N=C/c3cnn(C(C)C)c3)n2)o1,C20911153_decoy,CASP3,Decoy,0,-8.31867,-7.4,-1.65,-7.582059079171122
COc1cc(/C=N/Nc2nnc(SCC(=O)NNC(C)=O)n2N)cc(OC)c1OC,C20920245_decoy,CASP3,Decoy,0,-8.02434,-6.09,-2.07,-6.105112132749739
CCOc1cc(/C=N/Nc2nnc(SCC(=O)NCc3ccco3)n2N)ccc1O,C21326604_decoy,CASP3,Decoy,0,-7.90161,-7.17,-3.34,-6.670342376089183
COC(=O)[C@H]1O[C@@H](Oc2ccccc2N)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22048816_decoy,CASP3,Decoy,0,-5.117,-4.99,-2.58,-5.328130849648368
COC(=O)[C@H]1O[C@H](Oc2ccc(N)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22048836_decoy,CASP3,Decoy,0,-5.93596,-5.5,-1.79,-5.9584433732238615
CCNc1nc(NCC)n2c(SCC(=O)NNc3oc(C)cc(=O)c3C(C)=O)nnc2n1,C27525956_decoy,CASP3,Decoy,0,-7.75956,-4.9,-0.74,-5.722229048707352
OC[C@@H](O)CNc1nc(N2CCOCC2)nc2c(NC[C@@H](O)CO)nc(N3CCOCC3)nc12,C17164891_decoy,CASP3,Decoy,0,-9.6356,-6.19,-1.87,-7.313078693003057
CCCCCN(C(=O)CCc1c(C)nc2ncnn2c1C)c1c(N)n(CCCC)c(=O)[nH]c1=O,C32531323_decoy,CASP3,Decoy,0,-7.34938,-6.15,-1.7,-6.193241106876503
CCOC(=O)c1c(C)[nH]c(C(=O)N(CCOC)c2c(N)n(CC(C)C)c(=O)[nH]c2=O)c1C,C32994557_decoy,CASP3,Decoy,0,-7.25139,-6.3,-1.79,-7.48745293333864
CCNc1ccc(C(=O)OCC(=O)NCCN2C(=O)CSC2=O)cc1[N+](=O)[O-],C13144442_decoy,CASP3,Decoy,0,-7.85135,-6.34,-1.26,-6.451149410930015
CCOC(=O)CNC(=O)CSC1=NN[C@@H](Cc2cc(=O)[nH]c(=O)[nH]2)N1c1ccc(F)cc1,C39362841_decoy,CASP3,Decoy,0,-9.62427,-7.17,-2.94,-7.870902483454345
COc1cc(/C=N\NC(=O)c2nnn(-c3nonc3N)c2C[NH+]2CCCC[C@H]2C)cc(OC)c1OC(C)=O,C39948770_decoy,CASP3,Decoy,0,-9.27752,-8.32,-1.04,-8.062392922693089
C[NH+](CCOC(=O)N[C@]1(C)CCS(=O)(=O)C1)CCOC(=O)N[C@]1(C)CCS(=O)(=O)C1,C40168862_decoy,CASP3,Decoy,0,-7.9905,-6.91,-3.47,-7.042107417039497
COc1ccc(CCNc2ncnc(N3CCN(CCO)CC3)c2[N+](=O)[O-])cc1OC,C40583668_decoy,CASP3,Decoy,0,-7.26681,-6.54,-1.9,-6.112843370535761
O=C(NNc1ncnc(NCCCn2cc[nH+]c2)c1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1,C40658162_decoy,CASP3,Decoy,0,-5.21908,-6.95,-1.08,-5.435332212965896
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,C44028883_decoy,CASP3,Decoy,0,-5.66904,-5.29,-2.0,-4.880880211540893
C=C(NNc1nc2c(c(=O)[nH]c(=O)n2C)n1C[C@H](O)COC(C)C)c1ccc([N+](=O)[O-])cc1,C01816964_decoy,CASP3,Decoy,0,-7.00567,-7.91,-3.32,-6.710605881219774
COC(=O)[C@@H](CSCC(C)C)n1c(=O)n2n(c1=O)[C@@H](C(=O)NCc1ccc(N)[nH+]c1C)C=CC2,C13489309_decoy,CASP3,Decoy,0,-9.06164,-6.01,-4.52,-7.291769766270054
COc1cc(NC(=O)CSc2n[nH]c(N/N=C/c3cnn(C)c3)n2)cc(OC)c1OC,C59310860_decoy,CASP3,Decoy,0,-7.61735,-6.13,-2.14,-5.228262777839174
COc1cc(/C=N/Nc2nc(SCC(=O)NCCO)n[nH]2)c([N+](=O)[O-])cc1O,C59820564_decoy,CASP3,Decoy,0,-6.53771,-6.25,-1.71,-5.772057151911639
C=CCNC(=O)[C@H](C)Sc1n[nH]c(N/N=C/c2cc(OC)c(O)cc2[N+](=O)[O-])n1,C59820620_decoy,CASP3,Decoy,0,-6.03439,-6.01,-1.04,-6.280761002788098
C=CCn1nc(C)c(/C=N/Nc2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2N)c1C,C59829868_decoy,CASP3,Decoy,0,-6.23538,-7.14,-1.61,-5.655805258959513
C=CCn1nc(C)c(/C=N/Nc2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2N)c1C,C59829917_decoy,CASP3,Decoy,0,-9.1192,-7.54,-1.65,-6.946370649118188
C=CCn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)n[nH]2)cn1,C59831892_decoy,CASP3,Decoy,0,-6.12274,-6.44,-2.14,-5.696714792609988
C/C(=N\Nc1nc(SCC(=O)NCc2nnc(C(C)C)o2)n[nH]1)c1ccc([N+](=O)[O-])cc1,C59880007_decoy,CASP3,Decoy,0,-7.24876,-7.93,-1.65,-5.881237633456939
C=CCn1nc(C)c(/C=N/Nc2nc(S[C@@H](C)C(=O)NNC(=O)C3CCC3)n[nH]2)c1C,C59883813_decoy,CASP3,Decoy,0,-9.66594,-7.51,-2.68,-6.615405283560794
COCCn1cc(/C=N/Nc2nc(SCC(=O)Nc3nccs3)n[nH]2)cn1,C59886848_decoy,CASP3,Decoy,0,-8.45552,-5.85,-2.2,-5.763728265657679
COCCn1cc(/C=N/Nc2nc(SCC(=O)N3CCN(Cc4nnc(C)o4)CC3)n[nH]2)cn1,C59887319_decoy,CASP3,Decoy,0,-8.05453,-6.0,-2.4,-5.2269343112378985
COCCn1cc(/C=N/Nc2nc(SCc3nnc(-c4ccc(F)cc4)o3)n[nH]2)cn1,C59887393_decoy,CASP3,Decoy,0,-8.38646,-5.4,-1.28,-5.556315328288674
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1N,C59914435_decoy,CASP3,Decoy,0,-7.61718,-6.82,-1.55,-5.523573497671267
Cc1nn(CCO)c(C)c1/C=N/Nc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1N,C59914560_decoy,CASP3,Decoy,0,-6.31777,-5.49,-1.65,-5.699745193501188
COCCNC(=O)[C@@H](c1ccc(OC)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06905002_decoy,CASP3,Decoy,0,-10.1822,-6.98,-2.17,-9.072345007730554
COCCNc1nc(SC)nc2c1cnn2CCNC(=O)[C@H]1CC(=O)N(c2ccc(OC)cc2)C1,C08944075_decoy,CASP3,Decoy,0,-7.68691,-6.42,-1.71,-5.76914012408306
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)CCNC1=NS(=O)(=O)c2ccccc21,C09284386_decoy,CASP3,Decoy,0,-8.73327,-6.58,-1.53,-7.262513806568023
C=CCn1c(COc2cccc(C)c2)nnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1,C09466356_decoy,CASP3,Decoy,0,-7.61413,-5.92,-2.07,-5.803033585643897
CCOC(=O)c1sc(NC(=O)CSc2nc(O)c3cnn(C(C)(C)C)c3n2)c(C(=O)OCC)c1C,C09521073_decoy,CASP3,Decoy,0,-10.1035,-6.27,-2.9,-7.636593329700894
CCCCn1c(N)c(N(CCOC)C(=O)CSc2nnc(C(C)C)n2C2CC2)c(=O)[nH]c1=O,C10922240_decoy,CASP3,Decoy,0,-8.95122,-6.7,-1.34,-6.465211184739099
Cc1cc(NC(=O)CCC(=O)N(Cc2ccco2)[C@H](C(=O)NC[C@H]2CCCO2)c2cccnc2)no1,C13505857_decoy,CASP3,Decoy,0,-9.55632,-7.5,-2.26,-9.52442403332375
COc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)ccc1Oc1nnnn1-c1ccccc1,C13729718_decoy,CASP3,Decoy,0,-6.67896,-7.6,-0.62,-6.174196668334645
CCOC(=O)c1c(C)oc(NC(=O)CSc2nnc(N3CCOCC3)n2CC(C)C)c1C(N)=O,C19353647_decoy,CASP3,Decoy,0,-9.0437,-6.74,-0.44,-7.583735254990441
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@H]1c1cccc([N+](=O)[O-])c1,C20149708_decoy,CASP3,Decoy,0,-7.32141,-7.2,-2.12,-7.211107784955807
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@@H]1c1ccc([N+](=O)[O-])cc1,C20150150_decoy1,CASP3,Decoy,0,-8.34106,-6.08,,-6.494704507057633
CCc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(OC)c(OCn4cccn4)c3)n2)s1,C20424490_decoy,CASP3,Decoy,0,-8.61387,-7.15,-1.87,-6.736680068160665
COc1cc(/C=N/Nc2nnc(SCC(=O)NCc3ccc(C)cc3)n2N)cc(OC)c1OC,C20827215_decoy,CASP3,Decoy,0,-8.79251,-5.78,-1.12,-5.813781243134958
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(C(C)C)c3C)n2)s1,C20905123_decoy,CASP3,Decoy,0,-10.4556,-7.85,-2.91,-7.101231668670742
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(C(=O)OC)cc3)n2)s1,C20905964_decoy,CASP3,Decoy,0,-9.46011,-7.41,-0.92,-7.1341397064339
CCN(CC)c1ccc(NC(=O)CSc2nnc(N/N=C/c3ccc(C(=O)OC)cc3)n2N)cc1,C20913339_decoy,CASP3,Decoy,0,-9.9985,-6.55,-2.27,-9.855295876288473
CCN(CC)c1ccc(/C=N/Nc2nnc(SCC(=O)c3ccc(OC)c(OC)c3)n2N)c(O)c1,C21325707_decoy,CASP3,Decoy,0,-8.13017,-6.94,-3.87,-6.350724287850187
CCOc1cc2c(cc1COC(=O)CNS(=O)(=O)c1ccc(NC)c([N+](=O)[O-])c1)O[C@H](C)C2,C21976147_decoy,CASP3,Decoy,0,-8.08675,-6.47,-1.54,-7.881935541022491
CCOc1cc2c(cc1COC(=O)CNS(=O)(=O)c1ccc(NC)c([N+](=O)[O-])c1)O[C@@H](C)C2,C21976150_decoy,CASP3,Decoy,0,-7.29386,-6.84,-4.2,-6.814465346472541
COc1cc(C[NH2+]CCNc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1nnnn1-c1ccc(C)cc1,C22108223_decoy,CASP3,Decoy,0,-7.65546,-7.31,-1.73,-7.424293026202629
COC(CN(Cc1nc(N)nc(Nc2ccc(C)cc2)n1)Cc1nc(N)nc(Nc2ccc(C)cc2)n1)OC,C13131467_decoy,CASP3,Decoy,0,-7.39193,-6.49,-4.19,-7.834721932034571
CCCCCCc1nc(SCc2nc(N)nc(N(C)C)n2)c2c(=O)n(C)c(=O)n(CCC)c2n1,C24898951_decoy,CASP3,Decoy,0,-9.03997,-6.88,-2.38,-7.682453542615814
CCOC(=O)c1c(C2CC2)csc1NC(=O)COC(=O)CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1,C25396288_decoy,CASP3,Decoy,0,-7.95284,-7.12,-1.05,-6.397455816753512
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,CASP3,Decoy,0,-4.87891,-4.87,-4.75,-4.343045794989601
CCCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@H](c3cccc(OC)c3OC)NC(=O)N2CC)CC1,C36017316_decoy,CASP3,Decoy,0,-8.34123,-5.43,-4.04,-6.777172988275258
CCCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@@H](c3cccc(OC)c3OC)NC(=O)N2CC)CC1,C36017318_decoy,CASP3,Decoy,0,-7.8612,-5.47,-2.72,-7.834073066978419
CCCCNC(=O)[C@@H](c1ccc(O)c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)(C)C,C36583839_decoy,CASP3,Decoy,0,-6.40108,-6.03,-1.71,-7.259906122106023
CCCCNC(=O)[C@H](c1ccc(O)c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)(C)C,C36583840_decoy,CASP3,Decoy,0,-6.51031,-6.17,-3.54,-5.973409078840129
CCOC(=O)C1=C(COC(=O)c2ccc(CCNS(C)(=O)=O)s2)NC(=O)N[C@@H]1c1ccco1,C36795091_decoy,CASP3,Decoy,0,-8.6737,-6.91,-1.54,-8.530835175127665
CCCCN1C(=O)N=C([O-])[C@H](N(CCOC)C(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)[C@@H]1[NH3+],C38800645_decoy,CASP3,Decoy,0,-7.42155,-6.63,-2.75,-7.097675431844113
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,C39404326_decoy,CASP3,Decoy,0,-8.88543,-6.83,-4.2,-6.628431680998875
COCCn1c(CCC(=O)N[C@H](C(=O)N2CCCC2)C(C)C)nc2c1c(=O)[nH]c(=O)n2CC(C)C,C39610846_decoy,CASP3,Decoy,0,-7.51968,-6.48,-2.37,-5.911803576838304
O=C([O-])[C@@H](C[NH2+]Cc1ccc2c(c1)OCO2)[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1,C43209065_decoy,CASP3,Decoy,0,-7.40971,-7.54,-0.99,-6.773356319393412
O=[N+]([O-])c1cc(Cl)c(/N=N\c2ccc(N(C[C@H](O)CO)C[C@@H](O)CO)c3ccccc23)c([N+](=O)[O-])c1,C31352112_decoy,CASP3,Decoy,0,-6.59708,-6.3,-2.46,-6.303906063645945
CCNc1cc(NC(C)=O)c(/N=N\c2c(Cl)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1OCCOC,C31362328_decoy,CASP3,Decoy,0,-7.08172,-6.7,-4.34,-6.573201500482348
CCN(CC)c1ccc(/C=N/NC(=O)CSc2nnc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2N)cc1,C58988711_decoy,CASP3,Decoy,0,-8.45562,-6.91,-5.3,-7.180673216224973
CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(N(C)C)cc3)n2)c(C#N)c1C,C59005265_decoy,CASP3,Decoy,0,-9.72081,-7.6,-3.04,-6.955906671967004
COc1cc(/C=N/Nc2nc(SCC(=O)NCc3ccc(OC)c(OC)c3)n[nH]2)c([N+](=O)[O-])cc1O,C59040006_decoy,CASP3,Decoy,0,-7.93899,-7.63,-2.62,-7.459216682012508
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3c(C)nn(C)c3C)n2)s1,C59309967_decoy,CASP3,Decoy,0,-9.80394,-6.87,-3.05,-6.522846578737891
CCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(/C)c3ccc([N+](=O)[O-])cc3)n2)s1,C59311412_decoy,CASP3,Decoy,0,-8.07343,-7.37,-1.64,-6.4450428777361495
C/C(=N\Nc1nc(SCC(=O)Nc2nnc(SCC(C)C)s2)n[nH]1)c1ccc([N+](=O)[O-])cc1,C59311414_decoy,CASP3,Decoy,0,-8.3664,-6.72,-2.09,-5.776986621651028
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C(\C)c3ccc([N+](=O)[O-])cc3)n2)s1,C59311415_decoy,CASP3,Decoy,0,-8.26858,-6.38,-3.4,-6.427063423010235
C=CCn1nc(C)c(/C=N/Nc2nc(SCCC(=O)Nc3cccc(N4CCCC4=O)c3)n[nH]2)c1C,C59831428_decoy,CASP3,Decoy,0,-8.77758,-6.88,-1.98,-6.046001552389985
C=CCn1nc(C)c(/C=N/Nc2nc(SCC(=O)Nc3sc4c(c3C(=O)OC)CCC4)n[nH]2)c1C,C59831510_decoy,CASP3,Decoy,0,-10.3634,-7.55,-2.6,-6.667575386040805
CCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3[N+](=O)[O-])n2)s1,C59844121_decoy,CASP3,Decoy,0,-7.78685,-6.16,-1.61,-5.342967091655362
CCCCSc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3[N+](=O)[O-])n2)s1,C59844127_decoy,CASP3,Decoy,0,-9.03632,-7.88,-2.47,-6.680920931985772
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccccc3[N+](=O)[O-])n2)s1,C59844215_decoy,CASP3,Decoy,0,-7.79144,-6.8,-1.67,-7.018517810168708
COc1ccc(/C=N/Nc2nc(S[C@H](C)c3nnc(C(C)C)o3)n[nH]2)cc1OCn1cccn1,C59880153_decoy,CASP3,Decoy,0,-9.71344,-8.15,-2.64,-7.478815506288095
Cc1nn(CCO)c(C)c1/C=N/Nc1nc(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)n[nH]1,C59887716_decoy,CASP3,Decoy,0,-9.00042,-6.34,-1.75,-7.847965730187099
CCc1nnc(CN2CCN(C(=O)CSc3n[nH]c(N/N=C/c4c(C)nn(CCO)c4C)n3)CC2)o1,C59888228_decoy,CASP3,Decoy,0,-9.30375,-6.43,-1.85,-6.3464114465796815
CCOC(=O)C[C@]1(O)Oc2cc3c(cc2[C@@H](c2cc(OC)c(OC)c(OC)c2)[C@@H]1C(=O)OCC)OCO3,C05664474_decoy,CASP3,Decoy,0,-7.88793,-5.56,-2.9,-6.534443696950322
CCOC(=O)[C@@]1(c2cc(NS(=O)(=O)N(C)C)c(Cl)cc2NS(=O)(=O)N(C)C)CCCC1=O,C01610488_decoy,CASP3,Decoy,0,-8.3837,-6.89,-2.16,-7.799289587116518
CCC[C@@H](C(=O)NC(C)(C)C)N(Cc1ccc2c(c1)OCO2)C(=O)Cn1nnc(-c2ccc(C)o2)n1,C06500947_decoy,CASP3,Decoy,0,-7.59952,-6.66,-1.42,-6.484704138501259
CCOC(=O)CN(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)[C@@H](C(=O)NC1CCCC1)c1ccc(C)o1,C06546324_decoy,CASP3,Decoy,0,-8.74641,-6.81,-3.47,-6.205926685860342
CCOC(=O)c1sc(NC(=O)CSc2nnnn2-c2ccc(OC)c(OC)c2)nc1C,C06599634_decoy,CASP3,Decoy,0,-8.49408,-7.07,-1.59,-6.856859901830623
O=C(CCCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C08820527_decoy,CASP3,Decoy,0,-6.92568,-7.1,-2.03,-5.666873009039839
CCc1nnc(NC(=O)CSc2ccc3nnc(CCNS(=O)(=O)c4ccccc4)n3n2)s1,C09116677_decoy,CASP3,Decoy,0,-9.3814,-7.58,-2.97,-7.055534336001778
COc1cc(OC)nc(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)n1,C11166534_decoy,CASP3,Decoy,0,-4.9098,-7.68,-2.42,-4.875558554428423
CCCCOc1ccc(C(=O)NCCn2ncc3c(=O)n(Cc4cccc([N+](=O)[O-])c4)cnc32)cc1,C12071837_decoy,CASP3,Decoy,0,-7.5052,-6.9,-2.16,-6.027608002675493
Cc1ccc(-c2nnn(CC(=O)N(Cc3ccco3)[C@@H](C(=O)NC[C@@H]3CCCO3)c3ccc(F)cc3)n2)o1,C00888638_decoy,CASP3,Decoy,0,-7.66911,-6.61,-0.64,-6.986368713062035
CCOC(=O)c1c(NC=C2C(=O)N(CC)C(=S)N(CC)C2=O)sc(C(=O)OC)c1CC(=O)OC,C13150306_decoy,CASP3,Decoy,0,-8.59306,-6.31,-1.71,-10.173696906495636
COc1ccc(C(=O)NN2C[C@H](C(=O)OCC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1OC,C13856701_decoy,CASP3,Decoy,0,-6.75242,-6.66,-0.51,-6.742766463795664
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(CO)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C14443751_decoy,CASP3,Decoy,0,-6.67548,-6.84,-2.22,-6.55410259077626
CC(=O)OC[C@@H]1O[C@H](NC(=S)Oc2ccc(Cl)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16321728_decoy,CASP3,Decoy,0,-6.38724,-5.23,-1.14,-4.499604376991941
CCCCn1c(=O)[nH]c(=O)c2c1nc(COC(=O)Cn1c(=O)n(CCC)c3ccccc31)n2CC,C17245498_decoy,CASP3,Decoy,0,-7.83717,-7.03,-1.38,-6.174094149971851
C[C@@H](OC(=O)CCNS(=O)(=O)c1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1,C17724368_decoy,CASP3,Decoy,0,-8.23636,-7.63,-3.56,-6.4103310723765095
Cc1cc(N(CCC#N)CCC#N)ccc1C(/N=N\c1ccc([N+](=O)[O-])cc1)=N/NC(=O)c1ccccc1,C08665788_decoy,CASP3,Decoy,0,-7.94918,-6.04,-1.37,-6.112869908594977
CCOC(=O)c1ccc(N2CCOCC2)c(NC(=S)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1,C20497851_decoy,CASP3,Decoy,0,-7.17114,-7.62,-1.8,-5.803899617804645
COc1ccc(CCNC(=O)CSc2nnc(NC(=O)c3cn(C)nc3OC)s2)cc1OC,C21011218_decoy,CASP3,Decoy,0,-9.09996,-6.15,-0.72,-6.088245080114828
CCOc1ccc(CCNC(=O)Cn2cc([N+](=O)[O-])c(-c3cnn(-c4ccccc4)c3)n2)cc1OCC,C21573566_decoy,CASP3,Decoy,0,-8.05318,-6.84,-1.85,-7.818529386640679
CCOC(=O)C1=C(COC(=O)Cn2nnc(-c3ccc(C)cc3)n2)NC(=O)N[C@@H]1c1ccccc1,C22025249_decoy,CASP3,Decoy,0,-7.62061,-7.46,-2.04,-5.991579055223752
CCN(CC)c1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2C)cc1,C23293828_decoy,CASP3,Decoy,0,-6.89508,-6.43,-1.48,-5.34735505448791
CCOC(=O)c1sc(NC(=O)CSc2nnnn2-c2ccc(OC)cc2)c(C(=O)OCC)c1C,C32699635_decoy,CASP3,Decoy,0,-10.1356,-7.17,-2.15,-9.702881455686851
COC(=O)Cc1c(C(=O)OC)sc(NC(=O)Cn2ncc3cc([N+](=O)[O-])ccc32)c1C(=O)OC,C32810179_decoy,CASP3,Decoy,0,-7.53037,-7.21,-1.57,-6.653439909382746
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(CO)cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C34187328_decoy,CASP3,Decoy,0,-6.60867,-6.4,-2.79,-6.533959063835891
CC(=O)N[C@@H]1[C@@H](Oc2ccc3c(c2)OCO3)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C35052842_decoy,CASP3,Decoy,0,-6.07298,-7.17,-2.45,-6.1339854156840605
CCOCCCNC(=O)CN1CN(c2ccccc2)C2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1=O,C35357789_decoy,CASP3,Decoy,0,-8.63914,-6.24,-4.89,-6.383260116121282
COc1c(OC(C)=O)ccc(/C=N/NC(=O)/C(=C\c2cccs2)NC(=O)c2ccccc2)c1[N+](=O)[O-],C35419919_decoy,CASP3,Decoy,0,-10.7411,-7.91,-3.53,-8.823832089605013
CCCCNC(=O)[C@@H](c1ccccc1)N(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36497611_decoy,CASP3,Decoy,0,-5.8776,-6.11,-2.95,-6.44712542052447
CN(C)c1ccc([C@@H](C(=O)NC(C)(C)C)N(Cc2ccco2)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1,C36497662_decoy,CASP3,Decoy,0,-6.59315,-6.23,-1.23,-7.431911844770104
Cc1ccc(S(=O)(=O)CNC(=O)[C@@H](c2ccc([N+](=O)[O-])cc2)N(Cc2ccco2)C(=O)CO)cc1,C36503877_decoy,CASP3,Decoy,0,-6.9825,-7.38,-3.82,-6.816257520076802
CCCCNC(=O)[C@@H](c1ccc(OC)c(OC)c1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36528202_decoy,CASP3,Decoy,0,-7.55089,-6.73,-3.77,-7.510955050271063
CCCCNC(=O)[C@@H](c1ccccc1)N(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,C36595097_decoy,CASP3,Decoy,0,-6.11024,-5.85,-4.05,-5.60622725446084
CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4[N+](=O)[O-])ccc32)cc1OC,C38659493_decoy,CASP3,Decoy,0,-6.21247,-7.76,-2.58,-5.47685495127479
CCOC(=O)C1=C(COC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)NC(=O)N[C@H]1c1ccccc1,C39574594_decoy,CASP3,Decoy,0,-7.46425,-6.13,-2.97,-6.417066308520255
CC[C@H](Sc1nnc(CNC(=O)c2ccco2)n1CC)C(=O)Nc1ccc([N+](=O)[O-])cc1,C39766877_decoy,CASP3,Decoy,0,-6.58234,-7.57,-0.87,-6.937912591511722
CC[C@@H](Sc1nnc(CNC(=O)c2ccco2)n1CC)C(=O)Nc1ccc([N+](=O)[O-])cc1,C39766879_decoy,CASP3,Decoy,0,-7.40345,-7.43,-2.61,-6.576003329496664
CCOC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)C2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC)=N[C@@H]1C,C40061861_decoy,CASP3,Decoy,0,-7.74474,-6.5,-1.89,-8.08970118494868
CCOc1cc(C(=O)Nc2nn3c(-c4ccc(OC)c(OC)c4)nnc3s2)cc(OCC)c1OCC,C41076484_decoy,CASP3,Decoy,0,-9.09724,-5.99,-2.53,-6.550490165867755
CCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1,C46538884_decoy,CASP3,Decoy,0,-7.07961,-6.83,-0.95,-5.86466482687993
CCOC(=O)c1sc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(C(=O)OC(C)(C)C)c1C,C46875393_decoy,CASP3,Decoy,0,-8.40384,-5.94,-1.58,-5.87669817530363
CCOC(=O)Cn1nnnc1[C@H](CC)N(Cc1ccc2c(c1)OCO2)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C01375615_decoy,CASP3,Decoy,0,-9.01616,-7.51,-1.64,-7.911943368399216
COc1ccc(CN(Cc2cc3cc(OC)c(OC)cc3[nH]c2=O)Cc2nnnn2C[C@@H]2CCCO2)cc1,C57640382_decoy,CASP3,Decoy,0,-7.93076,-6.59,-1.29,-6.531932686835057
CC[C@H](c1nnnn1CCOC)N(Cc1cccnc1)Cc1cc2cc(OC)c(OC)cc2[nH]c1=O,C57641411_decoy,CASP3,Decoy,0,-8.02674,-7.24,-1.73,-7.834171302580434
CCOC(=O)C1=C(COC(=O)Cn2nnc3ccccc32)NC(=O)N[C@@H]1c1ccc(OC)cc1,C57646184_decoy,CASP3,Decoy,0,-7.69836,-6.23,-2.36,-7.738184200370434
C=CCn1c(Cn2nnc3ccccc32)nnc1SCC(=O)N/N=C/c1cnn(CCOC)c1,C59913935_decoy,CASP3,Decoy,0,-7.08058,-7.06,-1.49,-8.408652636199516
CC[C@@H](C)N(C(=O)COC(=O)C1C(C(=O)OC)=C(C)NC(C)=C1C(=O)OC)[C@H]1CCS(=O)(=O)C1,C25720991_decoy,CASP3,Decoy,0,-5.90346,-6.87,-2.46,-4.906535055537709
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1C(=O)OCC(=O)N(C)[C@H]1CCS(=O)(=O)C1,C25436418_decoy,CASP3,Decoy,0,-8.23195,-7.6,-3.06,-7.998308009094042
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)[C@@H]2C(C)=NC(C(=O)OC)=C2C)[C@@H]1c1ccc([N+](=O)[O-])cc1,C20150150_decoy2,CASP3,Decoy,0,-8.60508,-6.51,,-8.535725611995879
CCOC(=O)NN(C(=O)OCC)/C(=C\C=C\N1CCCC1)c1nnn(-c2ccc(Cl)cc2)n1,C63603666_decoy,CASP3,Decoy,0,-8.93552,-6.92,-1.24,-6.588735031420766
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccc(C(C)(C)C)cc2)cc1Cl,C09292901_decoy,CASP3,Decoy,0,-8.6626,-7.04,-2.67,-7.5863480799413345
Cc1ccccc1COc1ccc(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2cccs2)cc1,C09424810_decoy,CASP3,Decoy,0,-8.60487,-7.1,-1.25,-7.671596794768962
C=CCOc1cccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2c2nc(C)c(C(=O)OCC)s2)c1,C33371121_decoy,CASP3,Decoy,0,-10.0154,-5.75,-0.94,-6.244451024246277
CCCCOc1ccc([C@@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2Cc2ccco2)cc1OC,C33379774_decoy,CASP3,Decoy,0,-7.98753,-6.96,-2.9,-7.053082245174159
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OCC)s3)[C@H]2c2cccs2)cc1,C09462349_decoy,CASP3,Decoy,0,-9.90711,-6.38,-2.04,-7.511780847459529
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OCC)s3)[C@@H]2c2cccs2)cc1,C09462348_decoy,CASP3,Decoy,0,-9.8635,-6.26,-0.58,-9.532175237705314
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OCC)s3)[C@@H]2c2cccs2)cc1,C09461233_decoy,CASP3,Decoy,0,-10.1899,-5.23,-1.53,-6.514788196517814
CCCCCOc1ccc([C@H]2C(C(=O)c3cc(C)ccc3C)=C([O-])C(=O)N2c2nnc(C)s2)cc1OC,C33662080_decoy,CASP3,Decoy,0,-8.07387,-6.36,-2.32,-7.162411287259359
CCOc1cc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nnc(C)s2)ccc1OCCC(C)C,C34918038_decoy,CASP3,Decoy,0,-8.2544,-6.67,-2.11,-8.112363756198977
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCN(CCOC)CC3)N2[C@H]1c1cccc(OC)c1,C34922827_decoy,CASP3,Decoy,0,-8.5731,-5.3,-3.39,-6.115042772162508
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C34935001_decoy,CASP3,Decoy,0,-6.52879,-6.12,-1.66,-7.036488320972043
CCOc1cc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2c2nccs2)ccc1OCCC(C)C,C34941109_decoy,CASP3,Decoy,0,-10.1268,-6.35,-4.26,-8.23164614388859
CCOc1cc([C@@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2c2nnc(C)s2)ccc1OCCC(C)C,C34941110_decoy,CASP3,Decoy,0,-8.28195,-6.5,-4.45,-6.784843334928842
C=CCOc1ccc([C@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2c2nc(C)c(C(C)=O)s2)cc1OCC,C35270081_decoy,CASP3,Decoy,0,-9.20172,-6.94,-1.66,-7.767319593186272
CCOCCOc1nc(-c2ccccc2F)n(-c2ccc([N-]S(=O)(=O)c3ccc(Cl)cc3)cc2)n1,C35403434_decoy,CASP3,Decoy,0,-7.8691,-6.88,-4.59,-5.952432609729248
CCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35420240_decoy,CASP3,Decoy,0,-6.95416,-7.38,-4.15,-6.692644232359582
C=CCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35420241_decoy,CASP3,Decoy,0,-7.50554,-5.89,-2.49,-6.3919613967343984
C=CCOc1cccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2c2nc(C)c(C(=O)OC)s2)c1,C35420572_decoy,CASP3,Decoy,0,-9.25872,-5.75,-4.92,-6.756543766186743
COCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCc3ccccc3C)cc2)[C@@H]1c1cccc([N+](=O)[O-])c1,C35445278_decoy,CASP3,Decoy,0,-7.3394,-6.55,-3.61,-8.266692475615185
CCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35484693_decoy,CASP3,Decoy,0,-7.69829,-7.12,-2.98,-7.507374289464265
C=CCOc1ccc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2Cc2ccco2)cc1OCC,C35484694_decoy,CASP3,Decoy,0,-7.44094,-6.04,-1.87,-6.146782606013374
CCCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2c2nccs2)cc1OC,C35565898_decoy,CASP3,Decoy,0,-8.77818,-5.8,-1.7,-7.528973137913139
CCCCCCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2c2nnc(C)s2)cc1,C35566207_decoy,CASP3,Decoy,0,-9.77844,-5.35,-2.06,-6.837448875248736
C=CCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCc2ccccc2)cc1OC,C35568100_decoy,CASP3,Decoy,0,-7.41007,-7.33,-4.14,-8.120488336920113
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2C[C@H]2CCCO2)cc1OC,C35568425_decoy,CASP3,Decoy,0,-7.86625,-7.2,-2.51,-7.438854961995603
CCCc1nn(-c2ccc(C)cc2C)c([O-])c1C1=C(N(C)Cc2ccccc2)C(=O)N(CCOC)C1=O,C35621387_decoy,CASP3,Decoy,0,-7.2172,-6.47,-2.89,-6.9168812356193765
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCCC3)N2[C@H]1c1cc(OC)cc(OC)c1,C35700974_decoy,CASP3,Decoy,0,-8.29215,-7.1,-3.12,-6.217913264575016
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCCC3)N2[C@@H]1c1cc(OC)ccc1OC,C35703658_decoy,CASP3,Decoy,0,-7.97843,-5.84,-3.45,-6.335398864093402
CCOCCOc1nc(-c2ccc(F)cc2)n(-c2ccc([N-]S(=O)(=O)c3ccc(F)cc3)cc2)n1,C37384916_decoy,CASP3,Decoy,0,-8.44389,-6.26,-5.45,-6.286561923302906
CCCn1c(N2CCCC2)c(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33813461_decoy,CASP3,Decoy,0,-9.39478,-6.89,-1.47,-7.672587489782393
CCCn1c(N2CCCCCC2)c(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33813467_decoy,CASP3,Decoy,0,-9.79651,-7.17,-0.75,-9.8725458289495
CCCn1c(N2CCCCCC2)c(/C=C2/SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33813468_decoy,CASP3,Decoy,0,-8.18844,-6.23,-2.85,-6.80001718539572
CCCCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3ccc(C)cc3)SC2=S)c(C)c(C#N)c1=O,C38616853_decoy,CASP3,Decoy,0,-9.05965,-7.96,-1.34,-6.933777425856658
COCCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3ccc(C)cc3)SC2=S)c(C)c(C#N)c1=O,C38620996_decoy,CASP3,Decoy,0,-7.65874,-6.43,-2.35,-8.672601011188258
CCOCCCn1c([O-])c(C(=O)/C=C/c2cn(-c3ccccc3)nc2-c2ccc(F)cc2)c(C)c(C#N)c1=O,C38621164_decoy,CASP3,Decoy,0,-7.83416,-8.94,-1.45,-8.537471936461175
CCCCCCn1c([O-])c(C(=O)CCN2C(=O)/C(=C/c3ccccc3)SC2=S)c(C)c(C#N)c1=O,C38627413_decoy,CASP3,Decoy,0,-8.26742,-7.97,-2.54,-11.412932470921472
CCCCCCn1c([O-])c(C(=O)CCN2C(=O)/C(=C/c3ccc(C)cc3)SC2=S)c(C)c(C#N)c1=O,C38627422_decoy,CASP3,Decoy,0,-9.16832,-8.03,-1.42,-9.068738680601852
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OC)s3)[C@@H]2c2ccccc2OC)cc1,C39828090_decoy,CASP3,Decoy,0,-10.3273,-7.13,-1.15,-11.12530414132431
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nc(C)c(C(=O)OC)s3)[C@H]2c2ccccc2OC)cc1,C39828091_decoy,CASP3,Decoy,0,-9.07028,-5.95,-1.08,-6.286527427343094
CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OCC(C)C)cc3)[C@H]2c2ccccc2)nc1C,C39828116_decoy,CASP3,Decoy,0,-10.4919,-5.12,-2.01,-7.143014250817386
CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OCC(C)C)cc3)[C@@H]2c2ccccc2)nc1C,C39828117_decoy,CASP3,Decoy,0,-9.53726,-6.91,-2.79,-6.507294320200886
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OC(C)C)cc3)[C@H]2c2ccccc2)nc1C,C39828136_decoy,CASP3,Decoy,0,-9.92927,-5.85,-1.93,-7.923898489238818
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OC(C)C)cc3)[C@H]2c2ccncc2)nc1C,C39834452_decoy,CASP3,Decoy,0,-9.77368,-5.79,-0.57,-8.973703716564257
C=CCOc1ccc(-c2nn(-c3ccccc3)cc2/C=C(C#N)/C([O-])=N/c2nnc(CC(C)C)s2)cc1,C39997982_decoy,CASP3,Decoy,0,-7.24353,-5.42,-2.63,-5.583168044684058
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1OC,C39999654_decoy,CASP3,Decoy,0,-9.75387,-5.74,-2.37,-7.388443889299848
CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC)c(C)c3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1,C40000163_decoy,CASP3,Decoy,0,-10.0996,-6.2,-1.33,-6.856159168960675
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCC)s3)[C@H]2c2ccc(OC)cc2)cc1C,C40000223_decoy,CASP3,Decoy,0,-8.5021,-5.81,-1.58,-6.122354381947692
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCC=C)s3)[C@H]2c2ccccc2F)cc1,C40003240_decoy,CASP3,Decoy,0,-9.45011,-7.52,-1.16,-10.478712162619484
COC(=O)CCS/C=C(\[O-])N1N=C(c2ccc(Br)cc2)C[C@@H]1c1cccc(OC)c1OC,C45076934_decoy,CASP3,Decoy,0,-10.1987,-6.31,-1.89,-6.700445759387817
CCOc1ccc(OCC)c(N2C(=O)N=C([O-])/C(=C\c3cc(Cl)c(O[C@H](C)CC)c(OC)c3)C2=O)c1,C59105076_decoy,CASP3,Decoy,0,-9.08178,-6.34,-2.9,-9.005984822831794
CSCC[C@H](NC(=O)C1CCN(C(=O)[C@H](CCSC)NC(=O)OC(C)(C)C)CC1)C(=O)[O-],C12864936_decoy,CASP3,Decoy,0,-8.56689,-5.57,-2.16,-7.428712068034018
CCCOc1ccc([C@@H](C)Nc2ccc(C(=O)N[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])cc1OCCC,C13037506_decoy,CASP3,Decoy,0,-6.66211,-6.34,-1.45,-6.376031590405054
CCOc1ccc(-c2nnc(SCC(=O)N[C@@H](C)c3ccc4c(c3)OCO4)n2CCC(=O)[O-])cc1,C13194358_decoy,CASP3,Decoy,0,-8.64027,-7.15,-0.4,-8.368127371457769
O=C([O-])CCn1c(SCC(=O)NCCCSc2ccccc2)nc2cc(Cl)ccc2c1=O,C13220752_decoy,CASP3,Decoy,0,-9.57542,-7.44,-2.95,-8.2203248836128
CCOc1ccc(CCNC(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)cc1OCC,C13221858_decoy,CASP3,Decoy,0,-8.94394,-6.89,-1.49,-7.68087554349947
CCN(CCNC(=O)CSc1nnc(-c2cccs2)n1[C@@H](C)C(=O)[O-])c1cccc(C)c1,C13232950_decoy,CASP3,Decoy,0,-8.67616,-7.47,-1.97,-7.279233975873474
CCOCCCNC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1Cc1ccco1,C13266034_decoy,CASP3,Decoy,0,-7.0662,-5.9,-1.82,-6.214772464957064
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)N[C@H](CC(=O)OC(C)C)c2ccc(C)cc2)c1OC,C13313732_decoy,CASP3,Decoy,0,-8.55062,-5.89,-1.48,-5.423491556377399
CCOCCCn1c(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)nc2ccccc2c1=O,C13415233_decoy,CASP3,Decoy,0,-7.43983,-6.55,-2.05,-6.853895634922436
CCCSc1ccc([N+](=O)[O-])c(NC(=O)CSc2nnc(-c3cccs3)n2CC(=O)[O-])c1,C13443356_decoy,CASP3,Decoy,0,-8.88699,-7.01,-0.51,-6.379211919564288
CCOC(=O)c1ccsc1NC(=O)CSc1nnc(-c2cccs2)n1CCC(=O)[O-],C13443765_decoy,CASP3,Decoy,0,-9.70286,-5.51,-0.69,-7.14534107897748
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)[O-])C3=O)c(NCCCOC(C)C)nc12,C13689645_decoy,CASP3,Decoy,0,-8.04766,-6.92,-3.06,-6.8491602983988455
CCCC[C@H](S)C(=O)NC1(C(=O)N[C@@H](Cc2ccc(-c3ccsc3)nc2)C(=O)[O-])CCCC1,C13859936_decoy,CASP3,Decoy,0,-11.1821,-6.31,-1.69,-10.17149511549774
COC(=O)c1ccc([C@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)cc1,C09465004_decoy,CASP3,Decoy,0,-7.18981,-6.86,-2.14,-6.800850574112124
CC(C)OCCCNC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@H](C)O,C13052046_decoy,CASP3,Decoy,0,-7.40198,-7.43,-4.13,-6.692886543789683
CCOc1ccc([C@H]2NN=C(SCC(=O)NCCc3c[nH]c4ccccc34)N2CC(=O)[O-])cc1,C39715628_decoy,CASP3,Decoy,0,-7.79989,-7.82,-1.18,-7.435385375638154
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40053774_decoy,CASP3,Decoy,0,-8.48212,-5.89,-3.57,-6.849816090412228
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCCO)cc1OCC,C40053775_decoy,CASP3,Decoy,0,-7.89646,-7.08,-3.72,-8.05971326954489
CCN(CC)c1ccc([C@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40076651_decoy,CASP3,Decoy,0,-8.70143,-6.13,-2.87,-7.377786395814648
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc(Br)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40076948_decoy,CASP3,Decoy,0,-8.68879,-5.87,-2.41,-7.094300932306033
CC(C)COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(Cl)cc2)cc1,C40080432_decoy,CASP3,Decoy,0,-8.97472,-7.25,-2.28,-7.259920454598919
CC(C)COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(Cl)c2)cc1,C40080535_decoy,CASP3,Decoy,0,-8.59277,-5.87,-2.13,-6.818734106240849
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(Cl)c2)c(C)c1,C40082969_decoy,CASP3,Decoy,0,-8.27285,-6.03,-2.06,-6.988661266420809
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OCC)c(OC)c2)c(C)c1,C40083530_decoy,CASP3,Decoy,0,-9.1016,-5.67,-1.7,-7.8740914489504865
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OC)c(OC)c2)cc1C,C40085094_decoy,CASP3,Decoy,0,-7.22862,-6.21,-1.43,-6.231367869844008
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(O)c(OCC)c2)cc1C,C40086022_decoy,CASP3,Decoy,0,-8.96238,-6.35,-4.94,-7.499324098682164
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccccc2Cl)cc1C,C40091513_decoy,CASP3,Decoy,0,-8.68243,-7.23,-1.96,-10.26945845442078
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cc(OC)c(OC)c(OC)c2)cc1C,C40091594_decoy,CASP3,Decoy,0,-7.88105,-7.16,-2.43,-11.95141706191931
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(Cl)c2)cc1C,C40091989_decoy,CASP3,Decoy,0,-8.07001,-6.54,-0.96,-6.628992665867929
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2Cl)cc1C,C40092023_decoy,CASP3,Decoy,0,-8.90858,-6.04,-1.14,-6.4620117011032665
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2c(F)cccc2Cl)cc1C,C40092063_decoy,CASP3,Decoy,0,-9.34617,-7.08,-1.17,-10.029562352382529
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2c(F)cccc2Cl)cc1C,C40092064_decoy,CASP3,Decoy,0,-8.73839,-5.81,-0.94,-6.333731339210898
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2cccc(OC)c2OC)cc1C,C40092864_decoy,CASP3,Decoy,0,-7.85032,-6.16,-2.41,-6.393680458908808
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40093491_decoy,CASP3,Decoy,0,-8.23272,-6.59,-2.6,-7.200369700233178
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)ccc1OCC(C)C,C40093750_decoy,CASP3,Decoy,0,-7.31303,-6.11,-1.25,-6.617673161687814
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccccc2F)ccc1OCC(C)C,C40093801_decoy,CASP3,Decoy,0,-9.38097,-7.26,-2.89,-9.84092668984674
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(O)c2)ccc1OCC(C)C,C40093810_decoy,CASP3,Decoy,0,-9.38243,-7.07,-2.06,-8.200242878135223
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(N(C)C)cc2)ccc1OCC(C)C,C40093849_decoy,CASP3,Decoy,0,-7.88966,-7.14,-1.04,-6.892412463968701
CCOc1cc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40094569_decoy,CASP3,Decoy,0,-8.63025,-7.07,-1.55,-8.153399651869515
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc3ccccc23)c1,C40102149_decoy,CASP3,Decoy,0,-8.30978,-6.85,-1.97,-8.043364312536955
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2c(F)cccc2Cl)c1,C40102162_decoy,CASP3,Decoy,0,-9.14131,-6.53,-0.58,-9.009388075888872
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1cccs1)c1cccc(OCc2ccccc2)c1,C40102552_decoy,CASP3,Decoy,0,-7.95024,-6.68,-0.62,-7.205639727003198
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1cccc(O)c1)c1cccc(OCc2ccc(Cl)cc2)c1,C40103004_decoy,CASP3,Decoy,0,-9.39661,-7.91,-2.2,-7.724715047130537
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccc(O)c1)c1ccc(OCc2ccc(Cl)cc2)cc1,C40109707_decoy,CASP3,Decoy,0,-9.38234,-7.8,-2.16,-7.449063950207123
CCc1ccc([C@H]2C(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40110451_decoy,CASP3,Decoy,0,-8.67831,-6.42,-0.94,-7.57035580219457
CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3ccc(C)cc3)n2CCC(=O)[O-])c1C,C13196589_decoy,CASP3,Decoy,0,-5.79843,-7.45,-1.1,-5.4804114158298525
CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3cccc(C)c3)n2CCC(=O)[O-])c1C,C13198074_decoy,CASP3,Decoy,0,-7.72533,-6.72,-1.64,-6.811635638061126
C=CCn1c(CCNC(=O)c2ccccc2C)nnc1SCC(=O)Nc1ccc(C(=O)[O-])cc1,C59177150_decoy,CASP3,Decoy,0,-6.89893,-8.34,-2.14,-6.9175388344449615
CCOC(=O)[C@H]1[C@@H](C)[C@H](C(=O)OCC)S[C@@H]1NC(=O)CSc1nnc(-c2ccccc2)[n-]1,C39962568_decoy,CASP3,Decoy,0,-8.50958,-7.57,-1.69,-8.848524254191734
CCOC(=O)C1=C(C)[C@@H](C(=O)OCC)S[C@@H]1NC(=O)CSc1nnc(Cc2ccccc2)[n-]1,C39969010_decoy,CASP3,Decoy,0,-10.414,-6.44,-3.3,-6.660545288360946
COCCOC(=O)c1c(NC(=O)CSc2nc(C)cc(C)c2C(=O)[O-])sc(C(N)=O)c1C,C13022271_decoy,CASP3,Decoy,0,-8.81386,-6.2,-2.05,-6.965015715389364
NC(=O)CSc1ccccc1NC(=O)CSc1nnc(-c2cccs2)n1CCC(=O)[O-],C13035577_decoy,CASP3,Decoy,0,-9.8853,-5.98,-1.89,-6.626867174828004
C/C(=N\NC(=S)NC1CCCCC1)c1ccc(S(=O)(=O)N(C)CCCC(=O)[O-])cc1,C13066522_decoy,CASP3,Decoy,0,-9.44434,-6.7,-2.45,-6.931655141289551
CCOc1ccc(CN(CC)S(=O)(=O)c2cc(/C=C/C(=O)[O-])ccc2OC)cc1OC,C13094248_decoy,CASP3,Decoy,0,-8.57372,-6.58,-2.02,-8.54084739858491
CCOc1cc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2[O-])cc(OCC)c1OCC,C02880699_decoy,CASP3,Decoy,0,-6.3728,-6.56,-2.92,-6.369542588489459
CCCc1nnc(SCC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OCCOC)n1CC(=O)[O-],C13202476_decoy,CASP3,Decoy,0,-8.75724,-6.05,-0.8,-7.512999884510344
CCCc1nnc(SCC(=O)c2cc(C)n(-c3ccc(OCC)cc3)c2C)n1CC(=O)[O-],C13203176_decoy,CASP3,Decoy,0,-7.57736,-6.31,-2.07,-7.678592803930954
CCN(Cc1ccc(OC)c(OC)c1)C(=O)CSc1nnc(-c2ccc(C)cc2)n1CCC(=O)[O-],C13219719_decoy,CASP3,Decoy,0,-10.0733,-6.23,-2.38,-7.0743512953630425
COCCn1c(C)cc(C(=O)CSc2nnc(-c3cccs3)n2[C@H](C(=O)[O-])C(C)C)c1C,C13271602_decoy,CASP3,Decoy,0,-9.90276,-5.93,-3.07,-8.75455482077153
C[C@H](OCCCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1)c1ccccc1,C13298735_decoy,CASP3,Decoy,0,-7.7418,-8.24,-1.55,-7.716747204321382
O=C([O-])c1ccccc1NS(=O)(=O)c1ccc(NNC(=S)NC[C@H]2CCCO2)c([N+](=O)[O-])c1,C09631562_decoy,CASP3,Decoy,0,-8.69898,-6.88,-2.66,-6.558275857291915
CCNc1ccc(C(=O)NNS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)cc1[N+](=O)[O-],C13346073_decoy,CASP3,Decoy,0,-6.75776,-7.95,-0.45,-6.0680363202072245
CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])cc1C,C13443091_decoy,CASP3,Decoy,0,-8.75342,-6.62,-0.73,-7.745743357457922
COC(=O)[C@H](C)Sc1nn([C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)nc1[O-],C19898442_decoy,CASP3,Decoy,0,-7.41826,-5.88,-1.34,-5.704002756683861
CCOc1cc([C@H]2C(C(=O)c3cccc([N+](=O)[O-])c3)=C([O-])C(=O)N2CCOCCO)ccc1O,C09358769_decoy,CASP3,Decoy,0,-7.71465,-6.77,-1.79,-7.391172193968688
CCc1cccc(OC[C@H](O)Cn2c(NCCCN3CCOCC3)nc3c2c([O-])nc(=O)n3C)c1,C23115119_decoy,CASP3,Decoy,0,-8.28939,-6.07,-1.93,-6.9187804553107295
COC(=O)CCS/C=C(\[O-])N1N=C(c2ccc(OC)cc2)C[C@H]1c1cccc(OC)c1OC,C33248881_decoy,CASP3,Decoy,0,-9.14123,-5.29,-2.52,-6.653927936002745
C=CCOc1ccc([C@@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCCN2CCOCC2)cc1OCC,C33498022_decoy,CASP3,Decoy,0,-8.60861,-6.1,-2.41,-7.134251748081281
O=C(CCc1nnc(-c2ccc(OCC3CCC3)cc2)nc1[O-])NCCCN1CCOCC1,C34764081_decoy,CASP3,Decoy,0,-8.9683,-6.29,-1.16,-6.888445207082175
CCOc1cc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOC)ccc1OCc1ccccc1,C35566704_decoy,CASP3,Decoy,0,-10.1829,-6.1,-2.0,-7.450632991962353
CCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCCOC)cc1OCC,C35566906_decoy,CASP3,Decoy,0,-7.51589,-5.68,-1.58,-6.559539866692391
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2Cc2cccnc2)cc1OCC,C35567556_decoy,CASP3,Decoy,0,-8.35019,-5.41,-2.73,-6.376147235179893
CC1=C[C@H]2O[C@H]3C[C@@H](OC(=O)/C=C/C=C/C(=O)[O-])[C@@](C)([C@@]2(COC(=O)/C=C(\C)CCO)CC1)[C@]31CO1,C37538467_decoy,CASP3,Decoy,0,-10.8446,-6.63,-2.39,-7.909979231221408
CCOc1ccc(N2C(=O)C[C@H](N(CCc3ccc(OC)c(OC)c3)C(=O)/C=C/C(=O)[O-])C2=O)cc1,C18121945_decoy,CASP3,Decoy,0,-7.89486,-6.91,-1.65,-7.713528592489918
CCOC(=O)[C@@]([N-]S(=O)(=O)c1ccccc1)(C(F)(F)F)P(=O)(OC(C)C)OC(C)C,C02570376_decoy,CASP3,Decoy,0,-5.5103,-4.86,-3.8,-5.605409646059098
CCOCCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3ccccc3)SC2=S)c(C)c(C#N)c1=O,C38621443_decoy,CASP3,Decoy,0,-8.61657,-6.41,-2.68,-7.45527173486916
CCCCOc1ccc(/C=C2\SC(=S)N([C@H](CCC(N)=O)C(=O)[O-])C2=O)cc1OC,C39862116_decoy,CASP3,Decoy,0,-9.01,-6.07,-1.2,-7.006256794937397
CCOc1ccc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCOCCO)cc1OC,C40076247_decoy,CASP3,Decoy,0,-7.92993,-6.9,-2.92,-7.563797023785227
COc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40079085_decoy,CASP3,Decoy,0,-9.08547,-7.35,-2.3,-8.009158197154592
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OCC)cc3C)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40081391_decoy,CASP3,Decoy,0,-8.18154,-6.06,-4.31,-7.087359119327896
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(O)c2)c(C)c1,C40083590_decoy,CASP3,Decoy,0,-9.17847,-6.74,-2.1,-7.939345595896544
Cc1cc(OCC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1cccnc1,C40084685_decoy,CASP3,Decoy,0,-8.29357,-5.83,-1.52,-6.395282240847407
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1C,C40085539_decoy,CASP3,Decoy,0,-8.17529,-6.88,-2.77,-6.4987651570484655
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCC)c(OCC)c2)cc1C,C40085758_decoy,CASP3,Decoy,0,-8.32945,-6.0,-2.03,-7.159373572626413
CCOc1ccccc1[C@H]1C(C(=O)c2ccc(OC(C)C)c(C)c2)=C([O-])C(=O)N1CCOCCO,C40093235_decoy,CASP3,Decoy,0,-8.22263,-6.3,-2.08,-6.461568131645497
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc([N+](=O)[O-])c2)ccc1OCC(C)C,C40093749_decoy,CASP3,Decoy,0,-7.80076,-7.28,-1.33,-7.541017469633343
COc1ccc(OC)c([C@H]2C(C(=O)c3ccc(OCC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)c1,C40093870_decoy,CASP3,Decoy,0,-7.95228,-6.04,-3.09,-7.207946014469389
COc1cc([C@@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc(OC)c1OC,C40094352_decoy,CASP3,Decoy,0,-7.97524,-6.05,-1.5,-6.784857586355203
COc1cc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc(OC)c1OC,C40094354_decoy,CASP3,Decoy,0,-8.15657,-6.99,-3.14,-7.857378416714223
COc1cc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc(OC)c1OC,C40096329_decoy,CASP3,Decoy,0,-7.5639,-5.89,-1.52,-6.94835278870284
C=CCOc1cccc([C@H]2C(C(=O)c3cc4ccccc4o3)=C([O-])C(=O)N2CCOCCO)c1,C40097055_decoy,CASP3,Decoy,0,-8.81481,-7.33,-3.21,-8.315984952713107
Cc1nc(C)c(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc(OCCC(C)C)c2)s1,C40098636_decoy,CASP3,Decoy,0,-8.83556,-6.41,-2.72,-8.186745520850744
C=CCOc1ccccc1[C@H]1C(C(=O)c2sc(C)nc2C)=C([O-])C(=O)N1CCOCCO,C40098738_decoy,CASP3,Decoy,0,-8.6466,-5.77,-1.53,-6.5744839694834685
CCCC/C=C/CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1nccs1,C43218336_decoy,CASP3,Decoy,0,-10.4012,-7.57,-1.48,-8.503197746534445
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-],C13200343_decoy,CASP3,Decoy,0,-6.57354,-6.55,-1.08,-6.005646069460111
CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(-c3cccs3)n2CCC(=O)[O-])c1C,C13192775_decoy,CASP3,Decoy,0,-8.26753,-6.12,-1.45,-7.391104202476646
CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)NCCCCCC(=O)[O-])C2=O)ccc1O,C15048039_decoy,CASP3,Decoy,0,-7.03872,-6.61,-0.65,-6.0393332564423785
CC(C)(C)C(=O)C(=O)NCCCC[C@H](NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)C(=O)[O-],C48547236_decoy,CASP3,Decoy,0,-7.55401,-7.06,-3.37,-8.935068500070365
COc1ccc(/C=N/Nc2nc(SC/C([O-])=N/c3ncn[nH]3)n[nH]2)cc1OCn1cccn1,C20424533_decoy,CASP3,Decoy,0,-8.884,-6.17,-2.7,-6.19620683876003
CCOC(=O)C1=NN=C(/N=C(\C)[C@H]2C(=O)OC(C)=C[C@@H]2O/C([O-])=C(\C(C)=O)C(=O)CC(C)=O)C1,C64427276_decoy,CASP3,Decoy,0,-10.0032,-7.53,-2.54,-9.66273839470048
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(C(=O)N[C@H](C(=O)[O-])[C@H](C)O)CC1,C08918327_decoy,CASP3,Decoy,0,-8.25668,-6.11,-0.91,-7.504841838713491
C=CCn1c(CNC(=O)c2ccc(OC)c(OC)c2)nnc1SCC(=O)Nc1ccc(C(=O)[O-])cc1,C10127376_decoy,CASP3,Decoy,0,-6.84599,-7.44,-2.6,-6.009857621552958
CC[C@H](C)[C@H](NC(=O)C1CCN(C(=O)[C@H](CCSC)NC(=O)OC(C)(C)C)CC1)C(=O)[O-],C12861702_decoy,CASP3,Decoy,0,-9.06558,-6.34,-1.27,-9.446325371185646
CCOc1ccc(-c2nnc(SCC(=O)N(CCC#N)CCC#N)n2CC(=O)[O-])cc1,C13034799_decoy,CASP3,Decoy,0,-8.64676,-6.4,-1.86,-5.956501397624878
CN(CCCC(=O)[O-])S(=O)(=O)c1ccc(C(=O)/C=C/c2ccccc2OCC#N)cc1,C13066806_decoy,CASP3,Decoy,0,-8.22688,-5.26,-2.07,-5.8895884721144816
CCOc1ccc(-c2nnc(SCC(=O)NC[C@H]3CCCO3)n2CCC(=O)[O-])cc1,C13193616_decoy,CASP3,Decoy,0,-9.09825,-7.02,-1.31,-7.561103555177409
CCCc1nnc(SCC(=O)c2cc(C)n(CCCCCC(=O)OC)c2C)n1CC(=O)[O-],C13202828_decoy,CASP3,Decoy,0,-8.1125,-5.89,-2.92,-6.247806645852276
CCCOc1ccc([C@@H](C)Nc2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])cc1OCCC,C13212808_decoy,CASP3,Decoy,0,-8.04911,-7.42,-1.63,-7.577239691513341
CC(C)OCCCNC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1Cc1ccco1,C13231976_decoy,CASP3,Decoy,0,-9.56315,-5.99,-0.69,-5.45337249946002
CCCc1nnc(SCC(=O)c2c(C(=O)OC)c(C)n(C3CC3)c2C)n1CC(=O)[O-],C13237276_decoy,CASP3,Decoy,0,-7.69379,-5.62,-3.45,-6.021230477437709
Cc1cccc(OCCN(C)c2ccc(S(=O)(=O)NCCC(=O)[O-])cc2[N+](=O)[O-])c1,C13298991_decoy,CASP3,Decoy,0,-6.3037,-5.78,-1.66,-5.400577342934583
CCOc1cc(/C=C/C(=O)c2ccc(O[C@@H](C)C(=O)[O-])cc2)ccc1OCC(=O)N(C)C,C13365887_decoy,CASP3,Decoy,0,-6.64997,-5.68,-2.0,-5.617057792591012
COc1ccc(CCN(C)C(=O)CSc2nnc(-c3cccc(C)c3)n2CC(=O)[O-])cc1OC,C13443108_decoy,CASP3,Decoy,0,-8.35384,-6.82,-3.54,-8.29747445471598
COCCN(CCOC)C(=O)CSc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13444288_decoy,CASP3,Decoy,0,-6.31779,-5.57,-4.2,-5.22133603977673
COC(=O)CCn1c(C)cc(C(=O)CSc2nc(C)c(CCC(=O)[O-])c(=O)[nH]2)c1C,C13449388_decoy,CASP3,Decoy,0,-6.21035,-7.16,-1.89,-7.243276660771964
COCCN(CC(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(CC(=O)[O-])s1,C13454408_decoy,CASP3,Decoy,0,-7.34915,-6.56,-1.97,-6.963262018253687
CCC(=O)OC[C@@H]1O[C@H](n2cnc3c([S-])nc(N)nc32)[C@H](OC(=O)CC)[C@H]1OC(=O)CC,C17004341_decoy,CASP3,Decoy,0,-8.00505,-5.7,-1.56,-6.543155275670536
CCOC(=O)CN(CP(=O)([O-])CN(CC(=O)OCC)C(=O)OCC)C(=O)OCC,C20167591_decoy,CASP3,Decoy,0,-5.82005,-4.69,-2.73,-6.368642607528368
CCOc1ccc([C@H]2C(C(=O)c3cccc([N+](=O)[O-])c3)=C([O-])C(=O)N2CCOCCO)cc1,C09470750_decoy,CASP3,Decoy,0,-7.11064,-7.16,-3.4,-6.775188123602472
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1,C09424338_decoy,CASP3,Decoy,0,-7.47373,-6.88,-1.43,-7.003629043966932
CCCCOc1ccc(-c2nnc(CCC(=O)NCc3cccnc3)c([O-])n2)cc1OC,C34766806_decoy,CASP3,Decoy,0,-8.12135,-6.25,-2.0,-5.198698821565118
C=CCCOc1ccc(-c2nnc(CCC(=O)N3CCN(C(=O)OCC)CC3)c([O-])n2)cc1OC,C35922871_decoy,CASP3,Decoy,0,-8.61115,-6.24,-1.69,-6.317643580801324
COc1ccc2c(c1)c([C@H](C(=O)[O-])[NH+]1CCN(CCOCCO)CC1)cn2CC(=O)[O-],C36360855_decoy,CASP3,Decoy,0,-7.1396,-5.63,-2.65,-6.090798023212902
CCOC(=O)[C@]([N-]S(=O)(=O)c1ccccc1)(C(F)(F)F)P(=O)(OC(C)C)OC(C)C,C04277115_decoy,CASP3,Decoy,0,-5.58988,-5.51,-2.2,-6.3212569690046
CO[C@H](/C=C/CC/C=C/C(=O)[O-])[C@@H](O)[C@H](C)[C@H](O)/C(C)=C/[C@@H](C)C(=O)CCCC1CC(=O)NC(=O)C1,C35457112_decoy,CASP3,Decoy,0,-8.89145,-5.98,-4.19,-6.005914362653117
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)[C@@H]3N=C(C)C(C(C)=O)=C3C)n2CCC(=O)[O-])cc1,C13333095_decoy,CASP3,Decoy,0,-8.00785,-7.41,-2.81,-6.418825120173015
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCCO)cc1OCC,C40052997_decoy,CASP3,Decoy,0,-8.82746,-6.0,-1.43,-7.169296778091474
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCOCCO)cc1,C40067962_decoy,CASP3,Decoy,0,-8.03958,-5.42,-1.37,-6.879303581421838
CCCCCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCOCCO)cc1,C40067964_decoy,CASP3,Decoy,0,-8.09845,-5.76,-2.07,-7.057962456335988
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCO)cc1OC,C40075604_decoy,CASP3,Decoy,0,-7.91529,-6.54,-2.09,-5.608689449281098
COc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)c(OC)c1,C40079162_decoy,CASP3,Decoy,0,-9.22874,-7.38,-1.17,-8.341220393253648
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40079673_decoy,CASP3,Decoy,0,-8.59134,-6.94,-1.83,-11.569314368200027
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)c(C)c1,C40082877_decoy,CASP3,Decoy,0,-6.43146,-6.18,-2.55,-6.3111962685645295
Cc1cc(OCC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccco1,C40084737_decoy,CASP3,Decoy,0,-7.92608,-5.83,-1.09,-6.228522717233851
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(OCC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40085813_decoy,CASP3,Decoy,0,-7.83517,-7.14,-1.59,-8.035841187271773
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1C,C40085995_decoy,CASP3,Decoy,0,-8.23326,-6.61,-1.56,-7.097209249078747
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(C)o2)cc1C,C40092053_decoy,CASP3,Decoy,0,-7.35602,-6.32,-2.54,-6.09735947915471
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(OCC)c(OC)c2)cc1C,C40092119_decoy,CASP3,Decoy,0,-8.08333,-5.65,-2.38,-6.579220229742975
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccco2)ccc1OCC(C)C,C40093854_decoy,CASP3,Decoy,0,-7.79966,-5.86,-0.74,-5.673266606081368
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCOCCO)cc1,C40095176_decoy,CASP3,Decoy,0,-7.84273,-6.58,-1.55,-9.360207246443167
C=CCOc1ccccc1[C@@H]1C(C(=O)c2ccc3c(c2)C[C@@H](C)O3)=C([O-])C(=O)N1CCOCCO,C40095228_decoy,CASP3,Decoy,0,-7.52376,-7.57,-2.21,-8.593281202856312
CCCOc1ccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40098566_decoy,CASP3,Decoy,0,-8.51797,-6.84,-2.81,-7.752046986514041
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40098651_decoy,CASP3,Decoy,0,-9.70633,-6.35,-2.81,-7.616234524539723
CCOC(=O)CC(=O)SC1=C(C#N)[C@@H](c2ccc(OCC)cc2)C(C(=O)OC)=C([O-])N1,C40486384_decoy,CASP3,Decoy,0,-8.82406,-6.11,-1.46,-7.466487229547389
CCCOCCN1C(=O)[C@H]2[C@@H](c3ccccc3OC)N[C@@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]2C1=O,C43218317_decoy,CASP3,Decoy,0,-6.33229,-6.59,-0.88,-6.217050416404703
C[C@H](C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@@H](CC[C@H](O)C[C@@H](O)CC(=O)[O-])[C@@H]21)[C@@H](C)O,C44020824_decoy,CASP3,Decoy,0,-9.23209,-6.8,-0.76,-8.087110704356439
C[C@H](C(=O)O[C@@H]1C[C@H](O)C=C2C=C[C@H](C)[C@@H](CC[C@H](O)C[C@@H](O)CC(=O)[O-])[C@@H]21)[C@@H](C)O,C44020827_decoy,CASP3,Decoy,0,-10.2108,-6.34,-2.41,-7.345736511673051
C[C@H](C(=O)O[C@@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@H](O)CC(=O)[O-])[C@H]21)[C@@H](C)O,C44963603_decoy,CASP3,Decoy,0,-7.84317,-6.85,-1.85,-7.680738307621021
COc1cc(/C=C2\SC(=S)N(CC(=O)NCCCCCC(=O)[O-])C2=O)cc(OC)c1O,C15036590_decoy,CASP3,Decoy,0,-8.94186,-6.62,-1.39,-7.901067725018382
CC(C)(C)C(=O)C(=O)NCCCC[C@@H](NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]12)C(=O)[O-],C48547238_decoy,CASP3,Decoy,0,-8.36948,-6.77,-2.41,-6.416729018825705
CCCOc1ccc([C@H](C)Nc2ccc(C(=O)N[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])cc1OCCC,C13037507_decoy,CASP3,Decoy,0,-7.22951,-7.08,-3.0,-6.519451312642921
COCCOc1ccc(C(F)(F)F)cc1NC(=O)COc1ccc(C(=O)[O-])cc1[N+](=O)[O-],C13054099_decoy,CASP3,Decoy,0,-5.81567,-7.07,-2.65,-5.946935605253469
COc1ccc(-c2nnc(SCC(=O)c3cc(C)n(Cc4ccco4)c3C)n2CCC(=O)[O-])cc1,C13178162_decoy,CASP3,Decoy,0,-9.07468,-7.69,-2.27,-7.706024632087492
CCCc1nnc(SCC(=O)Nc2sc3c(c2C(=O)OCC)CCC3)n1CC(=O)[O-],C13202056_decoy,CASP3,Decoy,0,-8.34261,-6.53,-1.75,-6.566900741624242
CCCc1nnc(SCC(=O)Nc2sc(C(=O)OC)c(C)c2C(=O)OC)n1CC(=O)[O-],C13202097_decoy,CASP3,Decoy,0,-8.69441,-6.77,-1.33,-11.001657591818477
COc1ccc(CCN(C)c2ccc(S(=O)(=O)NCCC(=O)[O-])cc2[N+](=O)[O-])cc1OC,C13211220_decoy,CASP3,Decoy,0,-6.3715,-7.06,-0.81,-6.682715363901941
CCOc1ccc(-c2nnc(SCC(=O)N(C)Cc3ccc(SC)cc3)n2CC(=O)[O-])cc1,C13219624_decoy,CASP3,Decoy,0,-9.07245,-6.84,-1.34,-7.080100696110649
COC(=O)c1c(C(=O)CSc2nnc(-c3ccc(C)cc3)n2CCC(=O)[O-])c(C)n(C(C)C)c1C,C13244726_decoy,CASP3,Decoy,0,-8.15135,-7.04,-2.73,-6.636123285698767
CCOC(=O)/C=C/c1ccc(NS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)cc1,C13278669_decoy,CASP3,Decoy,0,-9.18088,-7.51,-1.3,-7.956879559860474
Cc1cccc(-c2nnc(SCC(=O)N(Cc3ccco3)CC(F)(F)F)n2CCC(=O)[O-])c1,C13444303_decoy,CASP3,Decoy,0,-7.54781,-6.88,-2.63,-6.432235825324464
COCCOc1cc(NS(=O)(=O)CCN2C(=O)NC(C)(C)C2=O)c(C(=O)[O-])cc1OC,C13454369_decoy,CASP3,Decoy,0,-7.84907,-6.58,-2.03,-9.99322221805124
CC(C)(C)OC(=O)N[C@H](CCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)[O-],C22052645_decoy,CASP3,Decoy,0,-7.54908,-6.59,-3.25,-6.5062749116758205
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCCn2ccnc2)cc1,C09471306_decoy,CASP3,Decoy,0,-8.89614,-6.59,-1.65,-7.306236501077573
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2ccc(OCC(N)=O)cc2)cc1C,C33770228_decoy,CASP3,Decoy,0,-10.7411,-7.3,-1.56,-8.278739653860745
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC)cc3)=C([O-])C(=O)N2CCN2CCOCC2)cc1OC,C33777147_decoy,CASP3,Decoy,0,-8.99818,-6.06,-2.13,-7.408398414629343
CCOCCOc1ccc(-c2nnc(CCC(=O)N3CCN(c4ccc(F)cc4)CC3)c([O-])n2)cc1OC,C34767006_decoy,CASP3,Decoy,0,-8.79315,-7.92,-1.57,-6.357624040351725
CCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCOC)cc1OCC,C35443227_decoy,CASP3,Decoy,0,-8.10166,-4.85,-2.55,-6.583334815523421
C=CCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCOC)cc1OCC,C35443235_decoy,CASP3,Decoy,0,-8.62509,-4.96,-1.93,-7.300006584770784
C=CCOc1ccc([C@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2CCOC)cc1OCC,C35443237_decoy,CASP3,Decoy,0,-7.34252,-6.49,-1.3,-6.551652082893449
C=CCOc1ccc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCOC)cc1OCC,C35484188_decoy,CASP3,Decoy,0,-8.95483,-6.32,-3.44,-7.281567468359004
CCCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2C[C@H]2CCCO2)cc1OC,C35568365_decoy,CASP3,Decoy,0,-9.35532,-5.79,-2.65,-7.122358793953376
CCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2C[C@H]2CCCO2)cc1OCC,C35568485_decoy,CASP3,Decoy,0,-7.62943,-6.97,-3.37,-7.558523565642442
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@H](c3cccs3)N12,C35695839_decoy,CASP3,Decoy,0,-9.05343,-4.31,-1.5,-6.522304223381444
COCCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3cccs3)N12,C35695841_decoy,CASP3,Decoy,0,-9.43808,-4.99,-1.68,-7.136079482818764
CCCOc1ccc(-c2nnc(CCC(=O)N3CCC(C(=O)OCC)CC3)c([O-])n2)cc1OC,C35922775_decoy,CASP3,Decoy,0,-8.47064,-7.01,-1.34,-6.008156488613735
CCOC(=O)CC(=O)CSC1=C(C#N)[C@@H](c2ccc(OCC)cc2)[C@H](C(=O)OC)C([O-])=N1,C02369767_decoy,CASP3,Decoy,0,-7.86564,-5.62,-2.63,-5.797695421684155
COC(=O)c1ccc2c(c1)c(C[N-]S(=O)(=O)Oc1ccccc1)cn2C[C@@H](C)S(=O)(=O)C(C)C,C39491349_decoy,CASP3,Decoy,0,-8.02785,-6.79,-2.13,-6.599308499330429
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@@H]2c2ccc(OC)c(OC)c2)cc1,C39827842_decoy,CASP3,Decoy,0,-8.88713,-6.16,-1.59,-6.511814397484629
C=CCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C40003577_decoy,CASP3,Decoy,0,-8.20245,-6.57,-3.43,-8.911833636166048
COc1cc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2CCCO)ccc1OCCC(C)C,C40046328_decoy,CASP3,Decoy,0,-7.28493,-6.33,-3.39,-7.516022857987703
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCCO)cc1OCC,C40046818_decoy,CASP3,Decoy,0,-8.00431,-4.93,-1.94,-6.464220844820121
CCOc1cc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40075523_decoy,CASP3,Decoy,0,-8.78151,-6.88,-4.16,-7.385319010354917
CCOc1cc([C@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40076063_decoy,CASP3,Decoy,0,-7.94868,-6.04,-2.83,-7.329926781464899
C=CCOc1cccc([C@H]2C(C(=O)c3ccc(Cl)cc3)=C([O-])C(=O)N2CCOCCO)c1,C40076617_decoy,CASP3,Decoy,0,-8.03337,-6.88,-2.09,-7.463523614978402
CCCOc1ccccc1[C@H]1C(C(=O)c2ccc(Cl)cc2)=C([O-])C(=O)N1CCOCCO,C40076671_decoy,CASP3,Decoy,0,-8.57631,-6.86,-1.29,-8.24145209008653
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40077318_decoy,CASP3,Decoy,0,-9.02199,-5.51,-1.95,-8.244450919181022
C=CCOc1ccccc1[C@H]1C(C(=O)c2ccc(OCCC)cc2)=C([O-])C(=O)N1CCOCCO,C40078019_decoy,CASP3,Decoy,0,-8.23581,-5.16,-0.87,-6.202455690583793
C=CCOc1ccccc1[C@H]1C(C(=O)c2ccc(OCC)cc2C)=C([O-])C(=O)N1CCOCCO,C40081467_decoy,CASP3,Decoy,0,-8.44246,-5.11,-2.83,-6.280802258810256
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1,C40082883_decoy,CASP3,Decoy,0,-8.36599,-6.05,-1.64,-7.1306473624253455
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084260_decoy,CASP3,Decoy,0,-9.28272,-6.97,-3.73,-8.13765688815383
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OC,C40085267_decoy,CASP3,Decoy,0,-8.1562,-7.32,-1.65,-10.040048787814218
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OCC)c(OC)c2)cc1C,C40085556_decoy,CASP3,Decoy,0,-7.40076,-6.64,-2.21,-6.84058303128157
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(CC)cc2)cc1C,C40085568_decoy,CASP3,Decoy,0,-9.26123,-6.56,-2.81,-8.679856482471262
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2/C=C/c2ccccc2)cc1C,C40085670_decoy,CASP3,Decoy,0,-7.90787,-7.19,-2.3,-7.454234913389689
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)cc1C,C40085996_decoy,CASP3,Decoy,0,-7.09778,-5.76,-2.56,-6.067116848503984
COc1cccc([C@@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)c1OC,C40093259_decoy,CASP3,Decoy,0,-7.91361,-6.04,-2.1,-6.614401880016826
CCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40098568_decoy,CASP3,Decoy,0,-7.15971,-6.89,-3.25,-6.765269188269138
CN(C)S(=O)(=O)c1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2/C=C/c2ccccc2)cc1,C40110526_decoy,CASP3,Decoy,0,-7.9691,-6.65,-1.36,-5.966465084360272
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)c3[nH]c(C)c(C(=O)OC)c3C)n2CC(=O)[O-])cc1,C13195763_decoy,CASP3,Decoy,0,-7.12372,-7.32,-1.29,-6.454807689589355
CCOc1cc(/C=C2\SC(=S)N(CCCCCC(=O)N[C@H](C)C(=O)[O-])C2=O)ccc1O,C15044971_decoy,CASP3,Decoy,0,-8.63709,-5.88,-3.46,-7.575868839109025
Cc1nnsc1C(=O)N[C@H]1CCN(C(=O)CSCC(=O)[O-])[C@H](C(=O)N[C@H](CC(C)C)C(N)=O)C1,C04221710_decoy,CASP3,Decoy,0,-9.64708,-7.34,-3.92,-9.17529689687651
COc1ccc(/C=N/NC(=O)CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])cc2)c(C(=O)[O-])c1OC,C08771672_decoy,CASP3,Decoy,0,-6.26865,-6.73,-1.26,-5.311122026503963
Cc1cccc(C(=O)O[C@H](C(=O)NNC(=O)c2ccco2)[C@@H](OC(=O)c2cccc(C)c2)C(=O)[O-])c1,C09973901_decoy,CASP3,Decoy,0,-7.18519,-8.12,-3.48,-6.935035836908108
CCn1cc(C(=O)[O-])c(=O)c2cnc(N3CCN(C(=S)N[C@@H](CC(=O)OC)C(=O)OC)CC3)nc21,C12413829_decoy,CASP3,Decoy,0,-7.63505,-7.01,-1.35,-6.299110950913265
COc1ccc(OCc2noc(CSc3nnc(-c4cccs4)n3CCC(=O)[O-])n2)cc1,C12795872_decoy,CASP3,Decoy,0,-10.0662,-4.98,-1.77,-7.466083329051074
COCCOc1cc(NS(=O)(=O)c2cc(C(=O)OC)ccc2C)c(C(=O)[O-])cc1OC,C12525870_decoy,CASP3,Decoy,0,-7.77835,-5.84,-1.19,-8.15355812840729
COC(=O)CNC(=O)c1ccc(NS(=O)(=O)c2cc(/C=C/C(=O)[O-])cc(OC)c2OC)cc1,C13031243_decoy,CASP3,Decoy,0,-7.95891,-7.96,-2.22,-11.06128384859655
COCCNC(=S)N/N=C(\C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1,C13058888_decoy,CASP3,Decoy,0,-8.88448,-6.57,-2.67,-8.520235094124683
COCCN(CCOC)C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CCC(=O)[O-],C13177947_decoy,CASP3,Decoy,0,-8.70363,-5.98,-0.93,-7.536142557784199
COCCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CCC(=O)[O-])c1C,C13178079_decoy,CASP3,Decoy,0,-8.9086,-6.49,-1.15,-6.145105888320603
CCOC(=O)C1CCN(C(=O)[C@H](C)Sc2nnc(-c3ccc(OC)cc3)n2CCC(=O)[O-])CC1,C13178453_decoy,CASP3,Decoy,0,-8.16913,-7.52,-2.14,-7.670128792993653
COCCNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1[N+](=O)[O-],C13189825_decoy,CASP3,Decoy,0,-6.26381,-7.51,-4.66,-6.797806193307995
CCOc1ccc(-c2nnc(S[C@@H](C)C(=O)NCc3ccc4c(c3)OCO4)n2CCC(=O)[O-])cc1,C13193944_decoy,CASP3,Decoy,0,-7.24592,-7.89,-5.2,-7.213957356544108
CCOc1ccc(-c2nnc(SCC(=O)N(C)Cc3ccc(OC)cc3)n2CC(=O)[O-])cc1,C13195610_decoy,CASP3,Decoy,0,-7.79735,-6.87,-1.18,-7.055542044370307
CCOc1ccc(-c2nnc(SCC(=O)Nc3ccccc3SCC#N)n2CC(=O)[O-])cc1,C13195761_decoy,CASP3,Decoy,0,-8.41632,-7.51,-2.2,-7.9424757047943775
CCOCCCNC(=O)NC(=O)CSc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-],C13198851_decoy,CASP3,Decoy,0,-9.38843,-7.43,-4.9,-7.239436746785545
CCOc1ccc(CN(C)C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])cc1,C13201047_decoy,CASP3,Decoy,0,-8.34906,-6.96,-0.57,-6.709615135080923
COCCCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])c1C,C13201088_decoy,CASP3,Decoy,0,-7.46353,-6.63,-2.57,-5.881440752617734
CCOc1ccc(-c2nnc(SCC(=O)N(C)CC(=O)NC3CC3)n2CCC(=O)[O-])cc1,C13232128_decoy,CASP3,Decoy,0,-8.49043,-6.29,-1.77,-6.744920724720281
COCCNC(=O)CN(C)c1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])cc1[N+](=O)[O-],C13298844_decoy,CASP3,Decoy,0,-6.90769,-5.87,-1.69,-6.080199249027042
CCOc1ccc(-c2nnc(SCC(=O)O[C@@H]3CCS(=O)(=O)C3)n2CCC(=O)[O-])cc1,C13403584_decoy,CASP3,Decoy,0,-9.32764,-6.95,-1.64,-6.839142188142549
COCCOc1cc(NS(=O)(=O)CCn2nnc3ccccc32)c(C(=O)[O-])cc1OC,C13454359_decoy,CASP3,Decoy,0,-7.47408,-5.99,-1.51,-5.501929071080603
COC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccc(OC)c(OC)c2)c1C,C09271476_decoy,CASP3,Decoy,0,-8.90859,-6.37,-1.32,-8.11089968418772
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1,C09008615_decoy,CASP3,Decoy,0,-7.5985,-7.0,-0.91,-7.038974085803106
COc1ccc([C@@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)c(OC)c1,C09464789_decoy,CASP3,Decoy,0,-6.14043,-5.97,-3.71,-6.1028280556696055
COc1ccc(OC)c([C@@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)c1,C09471393_decoy,CASP3,Decoy,0,-6.23496,-5.6,-3.45,-5.726208243286513
COC(=O)c1ccc([C@H]2C(C(=O)c3cccc([N+](=O)[O-])c3)=C([O-])C(=O)N2CCOCCO)cc1,C09424627_decoy,CASP3,Decoy,0,-6.8828,-7.2,-2.24,-7.255267609091794
COc1ccc(NC(=O)CSc2nnc(N/N=C/c3cc(OC)c([O-])c([N+](=O)[O-])c3)n2N)cc1OC,C21326924_decoy,CASP3,Decoy,0,-7.59657,-7.75,-3.94,-7.391678764721133
CCOc1ccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)cc1S(=O)(=O)N(CC)CC,C22021506_decoy,CASP3,Decoy,0,-7.01616,-6.87,-2.04,-5.899347733537174
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2NCCO)c1OC,C22990059_decoy,CASP3,Decoy,0,-8.28407,-7.28,-2.13,-7.130456870020608
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC,C24273400_decoy,CASP3,Decoy,0,-7.39889,-7.22,-2.64,-6.723947698337332
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@@H]2c2ccc(OC)cc2)c1C,C09308634_decoy,CASP3,Decoy,0,-8.25787,-7.28,-2.53,-8.6384427515121
CCCCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCn2ccnc2)cc1OCC,C33530393_decoy,CASP3,Decoy,0,-8.05265,-6.73,-1.79,-7.659539191494068
CCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCn2ccnc2)cc1OCC,C33530394_decoy,CASP3,Decoy,0,-7.32984,-5.74,-2.46,-6.842533350430125
CCOC(=O)C1(C(=O)OCC)CN(c2cc3c(cc2F)c(=O)c(C(=O)[O-])cn3CC)O[C@@H]1OCC,C34571801_decoy,CASP3,Decoy,0,-7.27503,-6.08,-1.09,-6.203639607648526
COc1ccccc1Cc1nnc(CCC(=O)N(C)CCc2ccc(OC)c(OC)c2)c([O-])n1,C34768283_decoy,CASP3,Decoy,0,-8.93993,-7.4,-1.85,-6.664222814614156
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOC)cc1OC,C35003332_decoy,CASP3,Decoy,0,-7.68668,-5.16,-4.81,-6.295300445732754
COC(=O)[C@H]1O[C@H](Oc2ccccc2C(=O)[O-])[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C35645165_decoy,CASP3,Decoy,0,-5.06476,-5.37,-4.27,-4.230647402464027
COc1cccc(Cc2nnc(CCC(=O)N(C)CCc3ccc(OC)c(OC)c3)c([O-])n2)c1,C35930832_decoy,CASP3,Decoy,0,-8.2909,-6.45,-2.03,-6.378489113622911
COC(=O)[C@@H]1O[C@H](Oc2ccccc2C(=O)[O-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C39937251_decoy,CASP3,Decoy,0,-5.21061,-4.81,-3.46,-5.0554778286381215
CCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40075510_decoy,CASP3,Decoy,0,-7.24033,-5.9,-1.62,-6.74000152616229
C=CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40079715_decoy,CASP3,Decoy,0,-7.86197,-7.3,-2.2,-8.307802538198839
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2[N+](=O)[O-])c(C)c1,C40083022_decoy,CASP3,Decoy,0,-7.77105,-5.82,-2.93,-6.637501196527581
COC(=O)c1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084261_decoy,CASP3,Decoy,0,-7.74441,-6.83,-1.59,-6.872353385750711
[H]/N=C(\NCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-])NS(=O)(=O)c1c(C)cc(C)cc1C,C33438874_decoy,CASP3,Decoy,0,-6.80693,-7.63,-1.39,-8.730468236631625
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nnc(-c2cccs2)n1[C@H](C(=O)[O-])C(C)C,C13271558_decoy,CASP3,Decoy,0,-9.21128,-6.5,-2.32,-7.604435448856912
O=C([O-])CCCCCNC(=O)CCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S,C47152209_decoy,CASP3,Decoy,0,-7.87181,-6.74,-1.46,-6.754842568790209
CCO/C([O-])=C1\C(COCCNC(=O)NCC(N)=O)=NC(C)=C(C(=O)OC)[C@H]1c1ccccc1Cl,C27650576_decoy,CASP3,Decoy,0,-8.90828,-6.63,-2.51,-7.673087606673487
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(/N=C/c2cc(OC)c(OC)c(OC)c2)cc1,C59466864_decoy,CASP3,Decoy,0,-7.23713,-5.55,-1.29,-5.098207887269441
COC(=O)[C@@H]1O[C@H](Oc2ccccc2C(=O)[O-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C65743279_decoy,CASP3,Decoy,0,-4.76528,-6.19,-2.29,-4.636888534975275
CCOc1ccc(-c2nnc(S[C@H](C)C(=O)N(C)C3(C#N)CCCCC3)n2CCC(=O)[O-])cc1,C13017901_decoy,CASP3,Decoy,0,-9.35718,-7.82,-0.91,-8.393749515342408
CCCCn1c(SCC(=O)N(CCC)[C@@H]2CCS(=O)(=O)C2)nc2cc(C(=O)[O-])ccc2c1=O,C13044325_decoy,CASP3,Decoy,0,-8.80912,-7.83,-3.21,-7.335596940183868
COCCCn1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nc2cc(C(=O)[O-])ccc2c1=O,C13048440_decoy,CASP3,Decoy,0,-6.64785,-6.09,-1.09,-5.478895073560374
CCOc1ccc(-c2nnc(S[C@@H](C(=O)N3CCOCC3)c3ccccc3)n2CCC(=O)[O-])cc1,C13194462_decoy,CASP3,Decoy,0,-8.34212,-6.75,-1.6,-6.688194324420495
CCOc1ccc(-c2nnc(SCC(=O)c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)[O-])cc1,C13195273_decoy,CASP3,Decoy,0,-8.99366,-7.56,-1.75,-7.642637175567399
Cc1ccc(-c2nnc(SCC(=O)c3cc(C)n(C[C@H]4CCCO4)c3C)n2CCC(=O)[O-])cc1,C13196712_decoy,CASP3,Decoy,0,-8.4717,-6.91,-1.75,-6.741923162886362
COc1ccc(-c2nnc(SCC(=O)c3cc(C)n(Cc4cccs4)c3C)n2CC(=O)[O-])cc1,C13200579_decoy,CASP3,Decoy,0,-7.51515,-6.35,-1.53,-8.955501026039904
CCOC(=O)CN(C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CC)c1ccc(F)cc1,C13202037_decoy,CASP3,Decoy,0,-7.5923,-5.89,-1.84,-7.394782639178973
CCc1cc2c(=O)n(CCCOC)c(SCc3nc4cc(C(=O)[O-])ccc4n3CC)nc2s1,C13218926_decoy,CASP3,Decoy,0,-9.4953,-6.89,-1.44,-7.134325317037017
CCC(C)(C)C1CCC(NC(=O)CSc2nnc(-c3ccc(OC)cc3)n2CCC(=O)[O-])CC1,C13220857_decoy,CASP3,Decoy,0,-8.20679,-7.11,-4.9,-9.508485908259246
COC(=O)c1c(C(=O)CSc2nnc(-c3cccc(C)c3)n2CC(=O)[O-])c(C)n(C(C)C)c1C,C13244883_decoy,CASP3,Decoy,0,-8.41902,13.11,-5.12,0.7415384346418815
COC(=O)c1c(C(=O)CSc2nnc(-c3ccc(C)cc3)n2CC(=O)[O-])c(C)n(C(C)C)c1C,C13246008_decoy,CASP3,Decoy,0,-7.73434,-7.42,-1.6,-7.095862978028451
COc1ccc(N(C(C)=O)c2nc(/C=C/C(=O)c3ccc(OCC(=O)[O-])c(OC)c3)cs2)cc1,C13299722_decoy,CASP3,Decoy,0,-9.80999,-6.42,-2.76,-6.960004577331809
CCOC(=O)CN(C(=O)CSc1nc2ccccc2c(=O)n1[C@H](C)C(=O)[O-])c1ccc(F)cc1,C13334137_decoy,CASP3,Decoy,0,-7.64175,-6.18,-3.86,-6.353224596513413
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@@H]1c1ccc([N+](=O)[O-])cc1,C15229524_decoy,CASP3,Decoy,0,-8.03221,-6.63,-1.83,-7.680488053973426
COCCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)c(C)c2)[C@H]1c1ccc([N+](=O)[O-])cc1,C15229526_decoy,CASP3,Decoy,0,-7.87223,-7.24,-1.57,-7.596314690259859
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCCOC)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1C,C09379713_decoy,CASP3,Decoy,0,-8.13063,-6.48,-3.47,-7.829874451953555
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1,C01155551_decoy,CASP3,Decoy,0,-7.5133,-5.88,-4.97,-6.461539376656649
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1,C09244206_decoy,CASP3,Decoy,0,-9.0348,-7.24,-0.99,-7.10346722399595
CC(C)Oc1ccc(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1,C09373698_decoy,CASP3,Decoy,0,-8.45617,-6.18,-2.77,-7.199541889270132
C=CCN(Cc1cccs1)C(=O)c1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2OC)cc1,C21930343_decoy,CASP3,Decoy,0,-6.60909,-6.37,-3.86,-4.929429802335135
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc(OC)cc2)cc1C,C22276100_decoy,CASP3,Decoy,0,-9.00722,-6.63,-4.31,-7.396245055288022
N#CCCN(C(=O)COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1)c1ccc(F)cc1,C23538470_decoy,CASP3,Decoy,0,-8.7793,-6.93,-4.57,-7.669316164871891
CCCCOc1ccc([C@@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C33507611_decoy,CASP3,Decoy,0,-9.07876,-5.48,-3.14,-7.876275120438165
CCCCOc1ccc([C@H]2C(C(=O)c3cc4cccc(OC)c4o3)=C([O-])C(=O)N2CCCn2ccnc2)cc1,C33522418_decoy,CASP3,Decoy,0,-8.70425,-7.71,-3.02,-7.42831113823199
C=CCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nc(C)c(C(C)=O)s2)cc1OCC,C33529050_decoy,CASP3,Decoy,0,-8.86187,-6.92,-1.6,-8.358540037349188
CCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C33532363_decoy,CASP3,Decoy,0,-8.18684,-6.83,-4.5,-8.306299401613163
CCOCCOc1ccc(-c2nnc(CCC(=O)N3CCN(c4ccc(F)cc4)CC3)c([O-])n2)cc1,C34763545_decoy,CASP3,Decoy,0,-9.27497,-6.45,-0.82,-5.972007413577321
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nccs2)cc1OCC,C34917446_decoy,CASP3,Decoy,0,-8.78032,-7.0,-2.22,-8.05783849708915
CCOc1cc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nccs2)ccc1OCCC(C)C,C34917818_decoy,CASP3,Decoy,0,-8.29977,-7.15,-4.54,-8.138622948681963
CCCCOc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCN2CCOCC2)cc1,C35005461_decoy,CASP3,Decoy,0,-9.18629,-6.38,-2.68,-7.382427258808261
C=CCOc1cccc([C@@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2c2nc(C)c(C(=O)OCC)s2)c1,C35263432_decoy,CASP3,Decoy,0,-9.60927,-6.73,-2.09,-8.94008980801211
C=CCOc1ccc([C@@H]2C(C(=O)/C=C/c3ccccc3)=C([O-])C(=O)N2c2nnc(C)s2)cc1OCC,C35421184_decoy,CASP3,Decoy,0,-8.41424,-7.33,-2.37,-6.5400275384549165
COCCN1C(=O)C([O-])=C(C(=O)c2nc3c(C)cccn3c2C)[C@@H]1c1cccc(OCCC(C)C)c1,C35484182_decoy,CASP3,Decoy,0,-8.84783,-8.08,-3.47,-7.222227943719488
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@H]1c1cccc(Cl)c1,C36052687_decoy,CASP3,Decoy,0,-9.73125,-6.61,-1.31,-7.855891243727379
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCN3CCOCC3)N2[C@H]1c1ccccc1F,C36058653_decoy,CASP3,Decoy,0,-9.59168,-5.69,-0.85,-8.204569282247203
CCCCOc1ccc([C@H]2C(C(=O)C3CC3)=C([O-])C(=O)N2c2cc(C(=O)[O-])ccc2Cl)cc1OC,C13276798_decoy,CASP3,Decoy,0,-7.98783,-7.71,-3.38,-7.189398554696307
CCCOc1ccc([C@@H]2C(C(=O)C3CC3)=C([O-])C(=O)N2c2cc(C(=O)[O-])ccc2Cl)cc1OCC,C13276809_decoy,CASP3,Decoy,0,-7.14512,-5.35,-1.59,-6.41867665029424
COC(=O)c1ccc(N2[C@@H](C)C=C(C(=O)CSc3nc(C)c(CCC(=O)[O-])c([O-])n3)[C@@H]2C)cc1,C39667920_decoy,CASP3,Decoy,0,-7.0098,-6.87,-1.95,-5.630311865084184
COC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)c2ccccc2[N-]S(=O)(=O)c2cccs2)=N[C@@H]1C,C39785794_decoy,CASP3,Decoy,0,-9.08243,-7.29,-1.83,-7.204699537809005
CCOc1ccc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nnc(SCC)s2)cc1OCC,C39999641_decoy,CASP3,Decoy,0,-7.54011,-6.26,-1.33,-6.7598570892685
CCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C40003573_decoy,CASP3,Decoy,0,-7.78875,-7.12,-3.46,-6.904772205973878
CCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C40003574_decoy,CASP3,Decoy,0,-7.28336,-5.85,-1.84,-7.460978789457835
CCOc1cc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCCO)ccc1OCCC(C)C,C40048709_decoy,CASP3,Decoy,0,-8.71883,-7.43,-3.39,-8.187781737580055
COc1cc([C@@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCO)ccc1OCCC(C)C,C40084817_decoy,CASP3,Decoy,0,-9.55459,-6.58,-2.54,-7.690354151220596
Cc1cc(C(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)c(C)n1-c1ccc(OC(F)(F)F)cc1,C13093062_decoy,CASP3,Decoy,0,-6.93182,-7.69,-3.22,-6.040849180277353
CCO/C([O-])=C1\C(COCCn2ccnn2)=NC(C)=C(C(=O)OC)[C@H]1c1cccc(Cl)c1Cl,C29488803_decoy,CASP3,Decoy,0,-8.78755,-5.82,-3.45,-6.76841830029241
CCO/C([O-])=C1/C(C)=NC(SCc2ccc(C(=O)[O-])cc2)=N[C@H]1c1cc(OC)c(OC)c(OC)c1,C58961746_decoy,CASP3,Decoy,0,-8.6731,-6.94,-2.46,-7.292527297678803
COC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2)=N[C@H]1C,C64230976_decoy,CASP3,Decoy,0,-8.97599,-6.85,-1.48,-6.464536186583819
C=CCOC(=O)C1=C(C)N=C(C)/C(=C(/[O-])OCC=C)[C@@H]1c1cn(-c2ccccc2)nc1-c1ccco1,C19800690_decoy,CASP3,Decoy,0,-8.99281,-5.74,-2.39,-7.311518598467536
CCOC(=O)C1CCN(C(=O)CSc2nnc(-c3ccc(OCC)cc3)n2CC(=O)[O-])CC1,C13194761_decoy,CASP3,Decoy,0,-7.06731,-5.87,-2.31,-5.281436686460676
COCCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(C)cc3)n2CCC(=O)[O-])c1C,C13196704_decoy,CASP3,Decoy,0,-8.13266,-6.9,-3.06,-6.744039075695918
COCCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CC(=O)[O-])c1C,C13200520_decoy,CASP3,Decoy,0,-7.45671,-6.13,-1.57,-6.519677722476553
CCOC(=O)CN(C(=O)CSc1nnc(-c2cccs2)n1CC(=O)[O-])c1ccccc1,C13203813_decoy,CASP3,Decoy,0,-9.36535,-6.06,-0.91,-9.468328068420158
CCOC(=O)CN(C(=O)CSc1nc2nc(C)c(CCC(=O)[O-])c(C)n2n1)c1ccccc1,C13210278_decoy,CASP3,Decoy,0,-6.92401,-6.49,-3.86,-6.549322233974015
O=C(CNC(=O)N[C@H](CC(=O)N1CCOCC1)C(=O)[O-])NCCCSc1ccccc1,C13243977_decoy,CASP3,Decoy,0,-7.34607,-7.31,-1.41,-6.112677936032598
COc1ccc(-c2nnc(SCC(=O)N(CCC(N)=O)c3ccc(OC)cc3)n2CC(=O)[O-])cc1,C13244559_decoy,CASP3,Decoy,0,-8.19489,-6.05,-4.22,-6.472191679453318
COc1ccc(N(CCC(N)=O)C(=O)CSc2nc3nc(C)c(CCC(=O)[O-])c(C)n3n2)cc1,C13245613_decoy,CASP3,Decoy,0,-9.11545,-5.78,-1.64,-7.101857009132796
CCCc1nnc(SCC2=C(C(=O)OCC)[C@@H](c3ccccc3)NC(=O)N2)n1CC(=O)[O-],C13279380_decoy,CASP3,Decoy,0,-8.30196,-6.62,-2.7,-6.353518916269986
COC(=O)CCCn1c(C)cc(C(=O)CSc2nc3ccccc3c(=O)n2[C@H](C)C(=O)[O-])c1C,C13334217_decoy,CASP3,Decoy,0,-6.59522,-6.82,-1.3,-5.506017897880862
CCOc1cc(/C=C/C(=O)c2ccc(OCCCC(=O)[O-])cc2)ccc1OCC(=O)N(C)C,C13357326_decoy,CASP3,Decoy,0,-9.14026,-6.58,-2.14,-7.199962122939316
CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CSc1nc(CC(=O)[O-])cs1,C13415184_decoy,CASP3,Decoy,0,-6.89918,-6.38,-1.94,-5.7761496395207175
CCCOc1c(Cl)cc(C(=O)N(CCC#N)[C@@H](Cc2ccccc2)C(=O)[O-])cc1OCC,C13426797_decoy,CASP3,Decoy,0,-7.40235,-6.14,-2.39,-6.0622142068228655
O=C([O-])CCn1c(SCC(=O)N(Cc2ccco2)CC(F)(F)F)nnc1-c1cccs1,C13443741_decoy,CASP3,Decoy,0,-7.14383,-5.8,-1.72,-6.6771496072182766
CCn1cc(C(=O)[O-])c(=O)c2cnc(N3CCN(C(=S)N[C@@H](CCSC)C(=O)OC)CC3)nc21,C15321577_decoy,CASP3,Decoy,0,-7.56561,-6.61,-2.62,-6.77753419508524
COC(=O)C1=CN(Cc2ccc(OC)c(OC)c2)C=C(C(=O)OC)C1c1cc(OC)c([O-])c([N+](=O)[O-])c1,C01459535_decoy,CASP3,Decoy,0,-8.02317,-7.2,-2.04,-7.342791463544978
COc1ccc(OC)c([C@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)c1,C09471394_decoy,CASP3,Decoy,0,-7.09869,-5.63,-3.11,-6.372617301323982
CCCCOc1ccc(C(=O)N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)N[C@H](C)C(=O)[O-])cc1,C22258328_decoy,CASP3,Decoy,0,-7.81802,-6.5,-0.86,-6.322396392977481
CCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCCOC)cc1OCC,C33814317_decoy,CASP3,Decoy,0,-8.04495,-5.55,-2.34,-7.793677400551515
CCOC(=O)C1(C(=O)OCC)CN(c2cc3c(cc2F)c(=O)c(C(=O)[O-])cn3CC)O[C@H]1OCC,C34571799_decoy,CASP3,Decoy,0,-6.45422,-7.04,-0.75,-5.160820622233008
COCCCN1C(=O)C([O-])=C(C(=O)c2sc(C)nc2C)[C@@H]1c1ccc(OCC(C)C)c(OC)c1,C35567011_decoy,CASP3,Decoy,0,-8.74988,-6.8,-3.57,-7.192118447173357
O=C([O-])C[C@H](Cc1csc(CCCCNc2cc(N3CCOCC3)ccn2)n1)c1ccc2c(c1)OCO2,C36269215_decoy,CASP3,Decoy,0,-9.11008,-7.22,-3.09,-8.230527355268979
C=CCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40068017_decoy,CASP3,Decoy,0,-7.78168,-6.8,-1.94,-6.702519920446114
CCN(CC)c1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40076312_decoy,CASP3,Decoy,0,-7.12246,-6.7,-2.89,-7.377311105355914
CCOc1cc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)ccc1O,C40079050_decoy,CASP3,Decoy,0,-8.27424,-6.21,-1.71,-6.990244902412046
CSc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40079206_decoy,CASP3,Decoy,0,-6.83165,-5.93,-1.3,-6.1003221333105735
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40079299_decoy,CASP3,Decoy,0,-8.21791,-6.88,-1.92,-10.134953049316255
CCOc1ccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3)=C([O-])C(=O)N2CCO)cc1OCC,C40079300_decoy,CASP3,Decoy,0,-7.74089,-5.75,-1.63,-6.406978824520825
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(OCC(C)C)c(OC)c2)c(C)c1,C40079824_decoy,CASP3,Decoy,0,-8.09351,-6.41,-2.77,-6.925178761576436
CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(SC)cc2)c(C)c1,C40081475_decoy,CASP3,Decoy,0,-8.14495,-7.6,-2.46,-11.070692530274108
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1,C40082885_decoy,CASP3,Decoy,0,-7.55621,-6.29,-0.94,-6.2340061986630735
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc(F)cc2)c(C)c1,C40082889_decoy,CASP3,Decoy,0,-8.28256,-6.62,-1.23,-7.327290431867039
COc1cccc([C@H]2C(C(=O)c3ccc(OC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)c1,C40084236_decoy,CASP3,Decoy,0,-7.25833,-7.77,-0.72,-9.36413046999566
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1,C40085087_decoy,CASP3,Decoy,0,-7.89435,-5.96,-1.63,-7.410806170873128
C=CCOc1ccc([C@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40085304_decoy,CASP3,Decoy,0,-8.08946,-5.69,-1.93,-7.190406441155477
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(F)cc2)cc1C,C40091922_decoy,CASP3,Decoy,0,-8.79282,-5.8,-1.39,-6.9482080522768594
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(O)cc2)cc1C,C40091931_decoy,CASP3,Decoy,0,-8.3761,-5.88,-1.29,-6.163484308258064
C=CCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@H]2c2ccc(OCC)c(OC)c2)cc1C,C40092121_decoy,CASP3,Decoy,0,-8.01388,-5.91,-3.4,-7.2456484531514675
Cc1cc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(N(C)C)cc2)ccc1OC(C)C,C40093246_decoy,CASP3,Decoy,0,-8.04377,-6.15,-1.33,-7.085368027891743
COc1cccc([C@H]2C(C(=O)c3ccc(OC(C)C)c(C)c3)=C([O-])C(=O)N2CCOCCO)c1OC,C40093261_decoy,CASP3,Decoy,0,-7.41556,-6.0,-4.54,-6.707622601713749
CCN(CC)c1ccc([C@H]2C(C(=O)c3ccc(F)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40094442_decoy,CASP3,Decoy,0,-8.75654,-7.31,-2.42,-10.044718615485412
CCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCOCCO)cc1,C40096341_decoy,CASP3,Decoy,0,-8.38666,-7.32,-1.04,-7.916862642008998
C=CCOc1ccccc1[C@H]1C(C(=O)c2cc3ccccc3o2)=C([O-])C(=O)N1CCOCCO,C40097151_decoy,CASP3,Decoy,0,-8.53972,-7.13,-1.45,-8.410149775488057
C=CCOc1ccccc1[C@@H]1C(C(=O)c2ccc(C)c(F)c2)=C([O-])C(=O)N1CCOCCO,C40099874_decoy,CASP3,Decoy,0,-8.68017,-6.2,-1.36,-7.803915029917461
C=CCOc1cccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2Cl)c1,C40102134_decoy,CASP3,Decoy,0,-9.19079,-6.63,-4.78,-7.6746871042054305
CCOc1ccc([C@H]2C(C(=O)c3ccc(S(=O)(=O)N(C)C)cc3)=C([O-])C(=O)N2CCOCCO)cc1,C40110439_decoy,CASP3,Decoy,0,-8.52497,-6.66,-1.87,-11.212974114717063
CCCCOc1ccccc1[C@H]1C(C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)=C([O-])C(=O)N1CCO,C40110762_decoy,CASP3,Decoy,0,-8.74427,-6.95,-3.52,-8.13878663056862
C[C@H](O)C(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@H](O)C[C@@H](O)CC(=O)[O-])[C@@H]21,C44020910_decoy,CASP3,Decoy,0,-8.68661,-7.55,-0.99,-8.588895459106594
CCO/C([O-])=C1\C(COCCNc2n[nH]c(N)n2)=NC(C)=C(C(=O)OC)[C@@H]1c1ccccc1Cl,C27639795_decoy,CASP3,Decoy,0,-7.93182,-7.55,-3.21,-8.070522580618968
CCOC(=O)C1=NN=C(/N=C(\C)[C@H]2C(=O)OC(C)=C[C@H]2O/C([O-])=C(\C(C)=O)C(=O)CC(C)=O)C1,C64427274_decoy,CASP3,Decoy,0,-8.87957,-6.13,-2.11,-5.575949107632894
COc1cc(C[C@@H](C(=O)[O-])[C@H](CO)C(=O)c2ccc3c(c2)OCO3)cc(OC)c1OC,C01601029_decoy,CASP3,Decoy,0,-7.27841,-6.24,-1.66,-6.616787229597098
CCOP(=O)(OCC)[C@@H](Cc1cn(S(=O)(=O)c2ccc(C)cc2)cn1)C(=O)[O-],C06002007_decoy,CASP3,Decoy,0,-4.78556,-6.56,-1.86,-5.570741114311238
CCCC[C@H](Sc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)s1)C(=O)[O-],C09517933_decoy,CASP3,Decoy,0,-8.59149,-6.58,-1.05,-6.907605909015354
COCCOc1cc(NS(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c(C(=O)[O-])cc1OC,C10512124_decoy,CASP3,Decoy,0,-8.65063,-5.95,-3.31,-7.317809323529169
CCCN(C(=O)CSc1nnc(-c2ccc(C)cc2)n1CCC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13033672_decoy,CASP3,Decoy,0,-8.38023,-7.76,-2.06,-10.473410925605997
COC[C@@H](C)n1c(C)cc(C(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2CCO)c1C,C13045626_decoy,CASP3,Decoy,0,-8.11281,-6.45,-1.77,-7.751942179956999
CCCn1c(=O)[nH]c(=O)c2c1nc(-c1ccc(OCC(=O)[O-])c(OC)c1)n2CCOC,C13061199_decoy,CASP3,Decoy,0,-6.80692,-6.29,-2.82,-5.941914702044587
COC(=O)c1ccc(OC)cc1OS(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC,C13070816_decoy,CASP3,Decoy,0,-8.36749,-7.38,-1.14,-8.659399892857063
CCOC(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N([C@H](CCC(=O)[O-])C(=O)[O-])C3=O)o2)cc1,C13073969_decoy,CASP3,Decoy,0,-7.55855,-6.08,-1.76,-5.460550208449573
CCOc1ccc(-c2nnc(SCC(=O)NCc3ccc4c(c3)OCO4)n2CC(=O)[O-])cc1,C13194792_decoy,CASP3,Decoy,0,-8.23488,-7.05,-0.94,-8.318816015231686
COC(=O)CCCn1c(C)cc(C(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2C)c1C,C13200274_decoy,CASP3,Decoy,0,-6.83162,-6.61,-3.11,-5.502441071337712
CC[C@H](C)N(C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13200961_decoy,CASP3,Decoy,0,-7.42586,-8.04,-2.29,-7.432535998674564
CCCc1nnc(SCC(=O)c2cc(C)n(Cc3ccc4c(c3)OCO4)c2C)n1CC(=O)[O-],C13203056_decoy,CASP3,Decoy,0,-7.78849,-6.46,-1.98,-6.351436665461389
CCCc1nnc(SCC(=O)N(Cc2cccs2)[C@@H]2CCS(=O)(=O)C2)n1CC(=O)[O-],C13203434_decoy,CASP3,Decoy,0,-8.76335,-6.34,-3.6,-6.7242514509021545
CN(C(=O)CSc1nc2ccccc2c(=O)n1CCCCCC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13234686_decoy,CASP3,Decoy,0,-8.48257,-8.0,-3.86,-7.999196867045087
COC(=O)c1c(C(=O)CSc2nnc(-c3cccc(C)c3)n2CC(=O)[O-])c(C)n(C2CC2)c1C,C13237491_decoy,CASP3,Decoy,0,-7.74247,-6.96,-1.89,-5.515944493860027
COC[C@@H](C)n1c(COc2ccccc2F)nnc1SCC(=O)N1CCC[C@@H](C(=O)[O-])C1,C13253573_decoy,CASP3,Decoy,0,-7.2329,-7.51,-3.16,-6.739284660138193
COC[C@@H](C)n1c(COc2ccccc2F)nnc1SCC(=O)N1CCC[C@H](C(=O)[O-])C1,C13253577_decoy,CASP3,Decoy,0,-7.65834,-7.15,-2.63,-6.0878617651063465
CCOCCCn1c(SCC(=O)N2CCC[C@@H](C(=O)[O-])C2)nnc1-c1ccncc1,C13253771_decoy,CASP3,Decoy,0,-6.65039,-5.55,-1.31,-4.83320876820173
COC(=O)c1sc(S(=O)(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])c(C(=O)OC)c1C,C13263137_decoy,CASP3,Decoy,0,-6.74489,-6.07,-2.09,-5.1732770436099065
COC(=O)CCn1c(C)cc(C(=O)CSc2nc3ccccc3c(=O)n2[C@H](C)C(=O)[O-])c1C,C13335413_decoy,CASP3,Decoy,0,-6.74281,-7.21,-1.51,-5.956448925366533
COCCOc1cc(NC(=O)/C=C/c2cc(OC)c3c(c2)OCCO3)c(C(=O)[O-])cc1OC,C13453184_decoy,CASP3,Decoy,0,-8.61908,-6.12,-2.86,-6.378524459871
COCCOc1cc(NS(=O)(=O)c2ccc(F)cc2[N+](=O)[O-])c(C(=O)[O-])cc1OC,C13453660_decoy,CASP3,Decoy,0,-7.13714,-6.07,-4.23,-5.995831989545934
CCc1ccc([C@H]2C(C(=O)c3cccc([N+](=O)[O-])c3)=C([O-])C(=O)N2CCOCCO)cc1,C09451922_decoy,CASP3,Decoy,0,-6.75329,-7.43,-1.54,-6.961518009182864
CCc1ccc([C@H]2C(C(=O)c3ccc([N+](=O)[O-])cc3)=C([O-])C(=O)N2CCOCCO)cc1,C09471156_decoy,CASP3,Decoy,0,-8.38887,-7.88,-2.02,-8.124566248376013
COC[C@@H](C)NS(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)cc1,C28794004_decoy,CASP3,Decoy,0,-7.74272,-5.14,-2.2,-6.215020701277561
CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccncc3)[C@H]2c2ccc(OCC)c(OC)c2)nc1C,C33752983_decoy,CASP3,Decoy,0,-10.0878,-5.19,-4.78,-7.6240796819452
CCOc1ccc([C@@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C33814223_decoy,CASP3,Decoy,0,-6.79293,-6.71,-1.52,-7.05583780659626
COCCN1CCN(C(=O)CCc2nnc(-c3cc(OC)c(OC)c(OC)c3)nc2[O-])CC1,C34767994_decoy,CASP3,Decoy,0,-7.88853,-6.95,-1.76,-7.444941766786837
COC(=O)/C(=C/N=C([S-])/N=C/C(NC(=O)c1ccccc1)=C(\[O-])OC)NC(=O)c1ccccc1,C34895097_decoy,CASP3,Decoy,0,-9.40868,-7.12,-3.26,-9.342285246329448
CN(Cc1ccco1)C(=O)COC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1,C39581370_decoy,CASP3,Decoy,0,-6.55116,-6.78,-3.28,-6.6906914743523584
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)[C@@H](C)Sc1nnc(CCC(=O)[O-])c([O-])n1,C39703832_decoy,CASP3,Decoy,0,-8.9299,-7.41,-2.26,-8.29347868219546
COC(=O)c1ccc(N2[C@H](C)C(C(=O)CSc3nnc(CCC(=O)[O-])c([O-])n3)=C[C@@H]2C)cc1,C39704051_decoy,CASP3,Decoy,0,-7.14432,-7.87,-1.37,-11.122829900756406
CC1=[N+](c2ccc(OC(F)F)cc2)[C@H](C)[C@@H](C(=O)[C@@H](C)Sc2nnc(CCC(=O)[O-])c([O-])n2)C1,C39704259_decoy,CASP3,Decoy,0,-8.33748,-7.1,-1.23,-7.307660007547271
CCOc1ccc(-c2nnc(SCC(=O)N(C3CC3)[C@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13195978_decoy,CASP3,Decoy,0,-9.92172,-6.7,-1.98,-6.281897750736612
CCOc1ccc([C@H]2C(C(=O)c3c(C)nc4c(C)cccn34)=C([O-])C(=O)N2CCCOC)cc1OC,C40003612_decoy,CASP3,Decoy,0,-7.34406,-6.48,-2.0,-8.30512704616888
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2[N+](=O)[O-])cc1C,C40085165_decoy,CASP3,Decoy,0,-6.23,-7.8,-0.83,-7.362911021102739
COc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)cc1OC,C40098537_decoy,CASP3,Decoy,0,-8.45573,-6.71,-1.55,-7.490869834937901
COc1cccc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)c1OC,C40098704_decoy,CASP3,Decoy,0,-7.09749,-5.25,-3.03,-6.2245212771683205
N/C(=N\[N+](=O)[O-])NCCC[C@@H](NS(=O)(=O)c1ccc2sc([O-])nc2c1)C(=O)[O-],C40545777_decoy,CASP3,Decoy,0,-9.45533,-8.65,-1.12,-10.41957233164327
CCCOCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](CC(=O)[O-])(C(=O)[O-])[NH2+][C@H]2c1ccccc1OC,C43218394_decoy,CASP3,Decoy,0,-5.91064,-5.53,-0.79,-5.378757116470578
CCOC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)c2ccccc2[N-]S(C)(=O)=O)=N[C@@H]1C,C44649718_decoy,CASP3,Decoy,0,-8.93905,-6.76,-1.02,-6.257584881083372
COc1ccc(-c2nnc([S-])n2CC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1,C11081981_decoy,CASP3,Decoy,0,-8.01571,-6.56,-2.14,-6.012594886234994
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(-c3cccs3)n2[C@@H](C)C(=O)[O-])c1C,C13403162_decoy,CASP3,Decoy,0,-7.17203,-6.2,-1.37,-7.546338342896812
CCO/C([O-])=C1\C(Cn2ccnc2)=NC(Cn2ccnc2)=C(C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1,C27728331_decoy,CASP3,Decoy,0,-8.47832,-6.2,-2.07,-7.004235606497057
COc1ccc(CN(C[C@H]2CCCO2)/C([O-])=N/S(=O)(=O)c2ccc(C)cc2)c(OC)c1OC,C59076365_decoy,CASP3,Decoy,0,-8.55012,-5.64,-1.54,-7.34377868476809
CCCCOC(=O)c1ccc(N[C@@H]2CC(=O)N(c3nc(CC(=O)[O-])cs3)C2=O)cc1,C16902264_decoy1,CASP3,Decoy,0,-7.33159,-7.94,,-10.777674262392294
CCCCOC(=O)c1ccc(N[C@H]2CC(=O)N(c3nc(CC(=O)[O-])cs3)C2=O)cc1,C16902264_decoy2,CASP3,Decoy,0,-7.85858,-7.06,,-6.668753654980297
C[N+](C)(C)CCO[P@@](=O)([O-])Oc1ccc(/N=N/c2cc(CC(=O)[O-])ccc2O)cc1,C22060594_decoy,CASP3,Decoy,0,-7.88135,-5.4,-2.98,-5.698417539409859
CCOC(=O)/C(C#N)=C\Nc1ccc(S(=O)(=O)[N-]c2cc(OC)nc(OC)n2)cc1,C10156396_decoy,CASP3,Decoy,0,-6.5006,-5.82,-1.05,-5.091548581131789
CCCC[C@H](Sc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)s1)C(=O)[O-],C08908426_decoy,CASP3,Decoy,0,-7.89559,-6.16,-1.13,-6.057109616692044
CCCC[C@@H](Sc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)s1)C(=O)[O-],C09517934_decoy,CASP3,Decoy,0,-7.98474,-6.72,-1.57,-5.753372160999708
CCN(C(=O)[C@@H](C)Sc1nnc(-c2ccc(OC)cc2)n1CCC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13021155_decoy,CASP3,Decoy,0,-9.37518,-7.45,-1.47,-8.997335116970431
CCN(C(=O)[C@H](C)Sc1nnc(-c2ccc(OC)cc2)n1CCC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13021161_decoy,CASP3,Decoy,0,-8.48061,-7.56,-1.38,-12.303646836031964
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1c(C(=O)[O-])cc(OC)c(OC)c1OC,C13032807_decoy,CASP3,Decoy,0,-7.51216,-7.07,-2.91,-7.21607902991122
CN(CCCC(=O)[O-])S(=O)(=O)c1ccc(C(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1,C13066736_decoy,CASP3,Decoy,0,-5.97769,-7.71,-2.14,-8.83790692770397
CCOc1ccc(-c2nnc(SCC(=O)NC3(C#N)CCCC3)n2CCC(=O)[O-])cc1,C13194198_decoy,CASP3,Decoy,0,-8.50411,-7.37,-1.24,-6.585936823245641
CC[C@@H](C)N(C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13200964_decoy,CASP3,Decoy,0,-8.23751,-7.35,-5.51,-6.840458080857974
CCCc1nnc(SCC(=O)Nc2sc3c(c2C(=O)OC)CCCCC3)n1CC(=O)[O-],C13202069_decoy,CASP3,Decoy,0,-7.82974,-6.69,-0.52,-5.996240808857195
CCCc1nnc(SCC(=O)Nc2sc3c(c2C(=O)OC)CCC3)n1CC(=O)[O-],C13202071_decoy,CASP3,Decoy,0,-8.15129,-6.63,-1.49,-8.645529169750786
CCCc1nnc(SCC(=O)N(Cc2cccs2)c2ccc3c(c2)OCCO3)n1CC(=O)[O-],C13203432_decoy,CASP3,Decoy,0,-8.06729,-5.72,-2.41,-6.194529130676609
COc1ccc(-c2nnc(SCC(=O)N(C)CC(=O)N3CCOCC3)n2CCC(=O)[O-])cc1,C13233385_decoy,CASP3,Decoy,0,-8.54672,-6.45,-0.32,-6.44774441745913
CCCc1nnc(SCC(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)n1CC(=O)[O-],C13237272_decoy,CASP3,Decoy,0,-7.41842,-6.89,-3.47,-6.702385010417567
COC(=O)c1c(C(=O)CSc2nnc(-c3cccs3)n2CC(=O)[O-])c(C)n(C2CC2)c1C,C13239193_decoy,CASP3,Decoy,0,-9.6347,-6.13,-0.68,-10.768781390077889
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1OC,C13251285_decoy,CASP3,Decoy,0,-10.3075,-7.33,-3.91,-9.002960669052028
CCCc1nnc(SCC(=O)N2N=C(/C=C/c3ccco3)C[C@@H]2c2ccco2)n1CC(=O)[O-],C13270492_decoy,CASP3,Decoy,0,-8.74872,-6.4,-2.51,-6.927330378440255
CCN(CC)C(=O)CN(C)c1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])cc1[N+](=O)[O-],C13276585_decoy,CASP3,Decoy,0,-7.3788,-7.05,-1.64,-7.256374187151694
COc1cc(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)c([N+](=O)[O-])cc1OC,C13343194_decoy,CASP3,Decoy,0,-7.25813,-6.02,-0.62,-9.441839814609672
C=CCn1c(SCC(=O)NCc2ccc(OC)c(C(=O)[O-])c2)nnc1-c1ccoc1C,C13346942_decoy,CASP3,Decoy,0,-7.36552,-6.5,-1.57,-6.105651343621026
CCOc1cc(/C=C2\SC(=S)N(CC(=O)[O-])C2=O)ccc1OCCn1c([N+](=O)[O-])cnc1C,C13351914_decoy,CASP3,Decoy,0,-8.11207,-6.07,-2.88,-9.107428523193478
CCOC(=O)CN(C(=O)CSc1nc2nc(C)c(CC(=O)[O-])c(C)n2n1)c1ccccc1,C13404995_decoy,CASP3,Decoy,0,-6.20219,-7.08,-2.79,-5.98352369268703
CCCc1nnc(SCC(=O)Nc2cc(OC)c(Cl)cc2OC)n1CC(=O)[O-],C13442785_decoy,CASP3,Decoy,0,-7.56604,-6.74,-1.77,-8.729274848944723
CCCc1nnc(SCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(=O)[O-],C13442906_decoy,CASP3,Decoy,0,-7.63626,-5.74,-1.18,-6.828839797679248
COC(=O)c1c(C(=O)CSc2nc(C)c(CCC(=O)[O-])c(=O)[nH]2)c(C)n(C2CC2)c1C,C13451160_decoy,CASP3,Decoy,0,-7.20001,-6.69,-1.1,-6.310813383986469
CCOc1c(/C=N/n2c(SCC(=O)[O-])nnc2-c2ccoc2C)c(C)nn1CC(C)C,C13459769_decoy,CASP3,Decoy,0,-9.1008,-5.17,-2.49,-7.278118241520212
CCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCCn2ccnc2)cc1OC,C15934771_decoy,CASP3,Decoy,0,-9.14938,-5.91,-1.96,-6.793294859342334
CCOC(=O)CNC(=O)CSc1nnc(/N=C(\[O-])c2cccc([N+](=O)[O-])c2C)s1,C08822009_decoy,CASP3,Decoy,0,-6.14284,-5.57,-2.77,-4.898385414833459
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2ccccc2)c1C,C09160165_decoy,CASP3,Decoy,0,-7.9607,-6.7,-1.29,-6.842418796581022
COc1cc(/C=C/C(=O)O[C@H](C(=O)[O-])[C@](O)(Cc2ccc(O)cc2)C(=O)[O-])ccc1O,C31166504_decoy,CASP3,Decoy,0,-8.16202,-6.73,-1.94,-6.512074677522032
COc1cc([C@H]2C(C(=O)c3ccc4c(c3)OCO4)=C([O-])C(=O)N2CCCn2ccnc2)cc(OC)c1OC,C33515321_decoy,CASP3,Decoy,0,-8.38701,-7.32,-1.31,-7.692687033237118
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCN3CCOCC3)[C@H]2c2ccc([N+](=O)[O-])cc2)c1C,C33515748_decoy,CASP3,Decoy,0,-9.10373,-7.08,-4.48,-8.089425458128439
CCOC(=O)c1c(/N=C2\S/C(=C\C(=O)[O-])C(=O)N2Cc2ccccc2)ncn1CC(=O)OC,C33592426_decoy,CASP3,Decoy,0,-8.8094,-6.06,-1.55,-7.307208396877589
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2cccc([N+](=O)[O-])c2)cc1,C33692054_decoy,CASP3,Decoy,0,-7.31139,-6.19,-3.31,-6.730147359012191
CCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCOC)cc1OCC,C33814224_decoy,CASP3,Decoy,0,-7.8114,-5.94,-2.27,-6.981727647561792
CCOCCOc1ccc(-c2nnc(CCC(=O)N3CCN(C)CC3)c([O-])n2)cc1OC,C34766978_decoy,CASP3,Decoy,0,-7.60502,-7.07,-1.57,-6.05971762945428
CCc1c2nc(-c3cc(C(C)=O)cnc3OCCOC)nc([O-])c2nn1CCN1CCOCC1,C14955611_decoy,CASP3,Decoy,0,-8.62126,-5.98,-1.64,-6.522152966317579
C[C@H]1C=C(C(=O)CSc2nnc(CCC(=O)[O-])c([O-])n2)[C@H](C)N1c1ccc(OC(F)F)cc1,C39703973_decoy,CASP3,Decoy,0,-7.45283,-8.06,-1.89,-10.58309720274305
COC(=O)c1ccc(N2[C@H](C)C=C(C(=O)CSc3nnc(CCC(=O)[O-])c([O-])n3)[C@H]2C)cc1,C39704049_decoy,CASP3,Decoy,0,-8.84361,-7.35,-1.4,-8.664965830119613
CC1=[N+](c2ccc(OC(F)F)cc2)[C@H](C)[C@H](C(=O)[C@@H](C)Sc2nnc(CCC(=O)[O-])c([O-])n2)C1,C39704255_decoy,CASP3,Decoy,0,-8.13314,-8.36,-2.99,-9.514981466087283
CC1=[N+](c2ccc(OC(F)F)cc2)[C@@H](C)[C@@H](C(=O)[C@@H](C)Sc2nnc(CCC(=O)[O-])c([O-])n2)C1,C39704261_decoy,CASP3,Decoy,0,-8.63827,-7.35,-2.7,-7.536726391937115
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)NC[C@H]2CN(CC(C)C)CCO2)c1OC,C13196312_decoy,CASP3,Decoy,0,-9.2198,-6.62,-1.99,-6.975982833841069
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1C,C40085076_decoy,CASP3,Decoy,0,-7.45264,-6.93,-2.43,-6.932325392778005
COc1cccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCOCCO)c1OC,C40098706_decoy,CASP3,Decoy,0,-8.25316,-5.95,-1.34,-6.534184626257953
COC(=O)c1ccc([C@H]2[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C(=O)N(CCCSC)C(=O)[C@@H]23)cc1,C43218434_decoy,CASP3,Decoy,0,-8.77221,-6.46,-1.72,-8.42956771450501
CCOC(=O)C1=C(C)C(C(=O)[C@@H](C)OC(=O)c2ccccc2[N-]S(C)(=O)=O)=N[C@H]1C,C44649720_decoy,CASP3,Decoy,0,-6.47156,-6.49,-1.47,-6.48997226782561
CCOC(=O)C1=C(C)C(C(=O)[C@H](C)OC(=O)c2ccccc2[N-]S(C)(=O)=O)=N[C@H]1C,C44649724_decoy,CASP3,Decoy,0,-8.66437,-6.46,-2.83,-7.959589753543957
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(-c3cccs3)n2CCC(=O)[O-])c1C,C13193012_decoy,CASP3,Decoy,0,-8.56987,-5.57,-0.58,-5.969828429893682
CCN(CC[NH+](C)C)c1ncc(C(=O)[O-])cc1[N-]S(=O)(=O)c1cc(Cl)ccc1OC,C64843913_decoy,CASP3,Decoy,0,-8.1468,-6.98,-3.78,-8.091590752499847
CC(=O)OC[C@@H]1O[C@@H](n2cnc3c(Sc4ccc(C)cc4)nc([O-])nc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C65743411_decoy,CASP3,Decoy,0,-8.35524,-7.61,-1.88,-7.599879885446531
CCOC(=O)C1=C(C)N=C(C)/C(=C(/[O-])OCC)[C@@H]1C(=O)OCC(=O)NC1CCCCC1,C25702481_decoy,CASP3,Decoy,0,-7.68624,-6.68,-1.91,-7.102685523501584
COc1cc(C(=O)OCc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)cc(Cl)c1OC(C)C,C10145656_decoy,CASP3,Decoy,0,-8.92941,-5.93,-1.57,-7.847761758825686
CCOC(=O)c1c(NC(=O)[C@@H](C)Sc2nnc(-c3cccnc3)n2CCOC)sc2c1CCCC2,C10611053_decoy,CASP3,Decoy,0,-9.57895,-7.02,-1.69,-7.661271306945277
CCOC(=O)c1c(NC(=O)[C@H](C)Sc2nnc(-c3ccncc3)n2CCCOC)sc2c1CCCC2,C10612572_decoy,CASP3,Decoy,0,-9.91929,-7.07,-3.57,-7.560092214526794
CCOC(=O)CN(C(=O)COC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)c1ccccc1,C11308539_decoy,CASP3,Decoy,0,-8.08309,-7.43,-2.27,-7.342906144912005
COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)CN3CCCCCC3=O)c2C)c1,C11385069_decoy,CASP3,Decoy,0,-8.11446,-7.69,-2.27,-7.66869545756329
CCOc1cccc2sc(N(CCCn3ccnc3)C(=O)c3cc(OC)c(OC)c(OC)c3)nc12,C10580822_decoy,CASP3,Decoy,0,-7.86528,-6.47,-3.44,-8.696571582722079
CCCCn1c(SCC(=O)Nc2sc(C)c(C)c2C(=O)OCC)nnc1-c1nn(C)cc1Cl,C13958195_decoy,CASP3,Decoy,0,-10.3827,-7.05,-3.59,-9.907973515970845
CCN(CC)S(=O)(=O)c1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(=O)OC)CCC3)cc1,C15186665_decoy,CASP3,Decoy,0,-7.73923,-6.62,-1.83,-7.020371354015507
COCCn1nnnc1[C@@H](c1cc2ccc(C)cc2[nH]c1=O)N(Cc1ccccc1)Cc1ccc(OC)cc1,C20082685_decoy,CASP3,Decoy,0,-8.83934,-6.98,-3.3,-7.922616252597739
COCCn1nnnc1[C@@H](c1cc2cccc(C)c2[nH]c1=O)N(Cc1ccccc1)Cc1ccc(OC)cc1,C20082960_decoy,CASP3,Decoy,0,-9.33623,-7.19,-1.34,-7.87487314034891
Cc1cc(OCC(C)C)ccc1C(=O)C1=C([O-])C(=O)N(CCC[NH+](C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1,C09339642_decoy,CASP3,Decoy,0,-8.50699,-7.48,-5.82,-9.001168598416237
CCSCCOC(=O)C1=C(C)NC2=C(C(=O)[C@@H](C(=O)OC)[C@@H](C)C2)[C@@H]1c1cc(OC)c(OC)cc1OC,C20190398_decoy,CASP3,Decoy,0,-10.5062,-4.52,-0.92,-9.900601986626295
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2ccc(OC)c(Cl)c2)[C@@H]1c1cccc([N+](=O)[O-])c1,C20232182_decoy,CASP3,Decoy,0,-8.43413,-5.88,-1.1,-6.44249831558389
CCOc1cc(C(=O)Nc2nnc([C@H]3CC(=O)N(c4ccc(CC)cc4)C3)s2)cc(OCC)c1OCC,C20578763_decoy,CASP3,Decoy,0,-8.86259,-6.91,-1.49,-6.064422987229783
COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3cc(C(=O)OC)cc([N+](=O)[O-])c3)c2C)cc1,C20833580_decoy,CASP3,Decoy,0,-6.99904,-7.78,-2.87,-7.999220151873033
CCOC(=O)c1cc2n(n1)C[C@](C)(C(=O)NCc1ccc(C)cc1)N(CCc1ccc(OCC)cc1)C2=O,C21879517_decoy,CASP3,Decoy,0,-8.44166,-7.11,-2.2,-7.51681484343853
CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3cccc(F)c3)o2)c(C(=O)OCC)c1C,C32698812_decoy,CASP3,Decoy,0,-9.35135,-7.08,-1.79,-7.67582435700063
C=CCN(CC(=O)Nc1sc(C(=O)N(C)C)c(C)c1C(=O)OCC)S(=O)(=O)c1ccccc1,C32957799_decoy,CASP3,Decoy,0,-7.77823,-7.11,-1.5,-7.34871246604369
CCCCOc1ccc([C@H]2C(C(=O)c3cc4cccc(OC)c4o3)=C([O-])C(=O)N2CC[NH+](C)C)cc1OC,C33522958_decoy,CASP3,Decoy,0,-7.04641,-6.31,-2.17,-6.68807352161801
CCCCC(=O)N1CCN(c2cc(Cl)nc(SCC(=O)NCCCN3CCOCC3)n2)C[C@@H]1C,C16604393_decoy,CASP3,Decoy,0,-9.95215,-6.3,-2.45,-7.161187139226215
COc1ccc(C(=O)N/N=C/c2ccc(OC(=O)c3cc(OC)c(OC)c(OC)c3)cc2)cc1OC,C33959280_decoy,CASP3,Decoy,0,-7.53201,-6.94,-1.82,-5.7543344893216615
COc1ccc([C@@H]2SC[C@H](C(=O)NCCC(C)C)N2C(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC,C35213780_decoy,CASP3,Decoy,0,-8.0792,-6.29,-2.42,-7.319196786205282
COc1ccc(CCN(Cc2ccc(C)o2)C(=O)CN(C[C@@H]2CCCO2)C(=O)NC(C)(C)C)cc1OC,C35363395_decoy,CASP3,Decoy,0,-7.09243,-6.69,-0.87,-6.592121311730485
Cc1nc2ccccn2c1C(=O)C1=C([O-])C(=O)N(CCCn2cc[nH+]c2)[C@@H]1c1cccc(OCCC(C)C)c1,C35420294_decoy,CASP3,Decoy,0,-8.74239,-7.46,-2.53,-10.369679641308384
CCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CC[NH+](C)C)cc1OCC,C35484373_decoy,CASP3,Decoy,0,-8.18053,-6.71,-2.2,-7.499604994579182
CCCCOc1ccc([C@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CC[NH+](C)C)cc1OCC,C35484377_decoy,CASP3,Decoy,0,-8.19875,-6.63,-2.94,-6.848609019663346
CCCCOc1ccc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCCn2cc[nH+]c2)cc1,C35484732_decoy,CASP3,Decoy,0,-8.37275,-8.01,-3.13,-7.988545925354403
CCC/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C,C36593586_decoy,CASP3,Decoy,0,-8.39421,-7.37,-4.56,-7.944827698836584
CCCCNC(=O)c1coc(CN2C(=O)COc3ccc(C(=O)COc4cccc(CC)c4)cc32)n1,C37512124_decoy,CASP3,Decoy,0,-8.17596,-8.46,-2.71,-7.656919530326827
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2cnn(-c3ccccc3)c2C)[C@@H]1c1ccc(OC)c(OC)c1,C33813117_decoy,CASP3,Decoy,0,-7.39995,-6.3,-2.2,-5.864052960402679
CC[NH+](CC)CCN1C(=O)C([O-])=C(C(=O)c2cnn(-c3ccccc3)c2C)[C@H]1c1cc(OC)ccc1OC,C33813118_decoy,CASP3,Decoy,0,-7.28081,-6.86,-4.36,-7.790114992577547
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)nc3c(C)cccn23)[C@@H]1c1ccc(C(=O)OC)cc1,C40004124_decoy,CASP3,Decoy,0,-7.07286,-6.57,-3.38,-6.093149958187142
CCOC(=O)c1cnc(N2CCCCC2)nc1CSc1nnc(-c2ccc(Cn3cccn3)o2)n1CC,C41386177_decoy,CASP3,Decoy,0,-8.55912,-8.12,-4.77,-6.867785595023464
CCOC(=O)c1cnc(N2CCCCC2)nc1CSc1nnc(COc2ccc(OC)cc2)n1C,C41661404_decoy,CASP3,Decoy,0,-9.34337,-6.75,-2.34,-7.471958961137212
CC(C)(C)OC(=O)[C@@H]1OC(C)(C)O[C@@]1(C(=O)OC(C)(C)C)[C@@](O)(CBr)C(=O)OC(C)(C)C,C43199056_decoy,CASP3,Decoy,0,-7.52074,-4.54,-3.81,-6.125338146064955
COc1cc2cc(CN(Cc3ccc(C)cc3)Cc3nnnn3CCc3ccccc3)c(=O)[nH]c2cc1OC,C01373683_decoy,CASP3,Decoy,0,-8.90233,-7.79,-2.02,-8.256789058296299
CC[C@H](c1nnnn1CCc1ccccc1)N(Cc1ccco1)Cc1cc2cc(OC)ccc2[nH]c1=O,C01374595_decoy,CASP3,Decoy,0,-9.32046,-8.12,-4.22,-8.743634739840092
CC[C@H](c1nnnn1C(C)(C)CC)N(Cc1ccc(OC)cc1)Cc1cc2ccc(OC)cc2[nH]c1=O,C01374636_decoy,CASP3,Decoy,0,-7.84398,-7.53,-3.14,-7.469661997144687
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1cccs1)Cc1cc2cc(C)c(C)cc2[nH]c1=O,C01375108_decoy,CASP3,Decoy,0,-9.70566,-6.7,-1.62,-8.061031445437749
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1ccc(C)cc1)Cc1cc2cc(C)c(C)cc2[nH]c1=O,C01375187_decoy,CASP3,Decoy,0,-9.34381,-8.22,-4.2,-8.15418917038029
CCOC(=O)Cn1nnnc1[C@H](CC)N(Cc1cccs1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C01375321_decoy,CASP3,Decoy,0,-11.0046,-7.29,-1.83,-9.168012242949612
CCOC(=O)Cn1nnnc1[C@H](CC)N(Cc1ccc(C)cc1)Cc1cc2ccc(C)c(C)c2[nH]c1=O,C01375537_decoy,CASP3,Decoy,0,-8.49783,-6.36,-1.06,-6.561216823202664
CC[C@H](c1nnnn1CCOC)N(Cc1ccc(OC)cc1)Cc1cc2c(C)ccc(C)c2[nH]c1=O,C57642421_decoy,CASP3,Decoy,0,-8.11686,-8.03,-2.45,-7.942247279083934
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1ccc(C)cc1)Cc1cc2cc(C)cc(C)c2[nH]c1=O,C13494834_decoy,CASP3,Decoy,0,-6.72294,-8.68,-1.31,-7.629731531874529
CCOc1ccc2[nH]c(=O)c(CN(Cc3cccs3)[C@@H](CC)c3nnnn3Cc3ccco3)cc2c1,C13495788_decoy,CASP3,Decoy,0,-7.91354,-7.14,-1.82,-8.03200978913911
CCOC(=O)Cn1nnnc1[C@H](C(C)C)N(Cc1ccco1)Cc1cc2c(C)cc(C)cc2[nH]c1=O,C13499061_decoy,CASP3,Decoy,0,-10.0847,-8.01,-2.0,-8.734979385901338
CCOc1cc(/C=N/Nc2nc(C)cc(COC)c2C#N)cc(Br)c1OCC(=O)OC,C59641490_decoy,CASP3,Decoy,0,-8.26989,-6.54,-1.92,-8.545947560071633
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CCCn3cc[nH+]c3)[C@H]2c2ccc(C(C)(C)C)cc2)C(C)=N1,C08836592_decoy2,CASP3,Decoy,0,-8.48516,-6.46,,-6.581111173070983
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)[C@@H]2C(C)=NC(C(=O)OC)=C2C)[C@@H]1c1ccc(OC)cc1,C20149810_decoy,CASP3,Decoy,0,-8.49868,-7.33,-2.02,-11.394587975179588
[H]/N=C1C(=C/c2ccc(OCCOc3cccc(OC)c3)c(OC)c2)/C(=O)N=C2SC(CCCC)=NN2/1,C13895121_decoy,CASP3,Decoy,0,-8.4562,-6.66,-0.91,-6.1378594755137215
O=[N+]([O-])c1ccc(OCCO[C@H]2OCCO[C@@H]2OCCOc2ccc([N+](=O)[O-])cc2)cc1,C04552023_decoy,CASP3,Decoy,0,-6.21848,-6.61,-2.2,-6.081636334214803
CC(=O)OC[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C04915302_decoy,CASP3,Decoy,0,-5.16933,-6.55,-1.38,-5.655691979776692
CC(=O)OC[C@@H]1[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](Sc2ccccn2)O[C@@H]1COC(C)=O,C05225148_decoy,CASP3,Decoy,0,-7.35956,-6.48,-1.54,-6.8684016087503545
CCOC(=O)CN(C(=O)CSc1nnc(-c2ccncc2)n1CCOC)c1ccccc1,C06546440_decoy,CASP3,Decoy,0,-8.5164,-6.1,-2.36,-6.95747046701759
CCOCCCn1/c(=N/C(=O)/C=C/C=C\OC)c(C(=O)OCC)cc2c(=O)n3cccc(C)c3nc21,C09222309_decoy,CASP3,Decoy,0,-7.88926,-6.27,-4.8,-6.751625361958584
CCOC(=O)c1sc(NC(=O)COc2ccc(C#N)cc2OC)c(C(=O)OCC)c1C,C09437894_decoy,CASP3,Decoy,0,-8.67,-6.18,-3.26,-7.05086698527379
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1,C09508505_decoy,CASP3,Decoy,0,-7.54931,-6.57,-1.6,-6.3983758534777015
CCOC(=O)[C@@H](CC)Sc1ccc2nnc(CCNC(=O)c3ccc(OC)cc3)n2n1,C09578659_decoy,CASP3,Decoy,0,-8.76519,-7.12,-2.28,-6.794668868632013
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)c2[nH]c(C)c(C(=O)OC)c2C)c1C,C09605185_decoy,CASP3,Decoy,0,-7.95965,-6.25,-2.34,-5.482284291742782
CCSc1nnc(NC(=O)CSc2nnc(Cc3cccn3C)n2CCOC)s1,C02713871_decoy,CASP3,Decoy,0,-9.39024,-6.33,-3.08,-9.082442728953676
CC(=O)OC[C@]1(C)O[C@@H](OC(C)=O)[C@](C)(OC(C)=O)[C@](C)(OC(C)=O)[C@]1(C)OC(C)=O,C09915825_decoy,CASP3,Decoy,0,-5.2147,-4.45,-1.29,-5.607393747459792
CCOC(=O)[C@@H](C)N1C(=O)S/C(=C\c2ccc(OCc3ccc(C(=O)OC)o3)c(OC)c2)C1=O,C09972843_decoy,CASP3,Decoy,0,-8.78801,-6.0,-1.59,-6.295527931815966
CCOC(=O)CN(C(=O)COC(=O)/C=C/c1cc(OC)c(OC)cc1OC)c1ccccc1,C10781752_decoy,CASP3,Decoy,0,-6.891,-6.23,-2.57,-5.076075992149374
CC(=O)OC[C@H]1O[C@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C12659976_decoy,CASP3,Decoy,0,-6.21666,-7.2,-3.53,-6.682694040443432
CCOc1nn(CC)cc1-c1nnc(SCC(=O)N(C)c2ccccc2)n1CCOC,C12875194_decoy,CASP3,Decoy,0,-7.03296,-5.47,-3.11,-6.487354820437013
CC(=O)OC[C@H]1O[C@@H](SCCOc2ccccc2C)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C15823203_decoy,CASP3,Decoy,0,-6.14169,-7.34,-3.73,-7.148232877559784
CCOCCCN(Cc1nc(C(=O)OCC)cs1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1,C16457976_decoy,CASP3,Decoy,0,-7.8795,-5.98,-2.78,-6.174484436901538
COCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1)C(=O)COCc1ccccc1,C16652774_decoy,CASP3,Decoy,0,-8.67794,-6.38,-3.44,-7.321779683145692
CC(=O)OC[C@H]1O[C@@H](SSc2ccccc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C17020259_decoy,CASP3,Decoy,0,-7.24213,-7.39,-2.97,-7.5610197329799025
COC(=O)C1=C(c2ccc(OC)c(OC)c2)O[C@H](c2ccc(OC)c(OC)c2)[C@@H]1COC(C)=O,C17188401_decoy,CASP3,Decoy,0,-8.05264,-5.93,-3.4,-8.432902214877682
CCOC(=O)[C@H]1C(=O)N(CCCOC)c2nc3ccccc3n2[C@H]1c1cc(OC)c(OC)c(OC)c1,C19818355_decoy,CASP3,Decoy,0,-6.38608,-6.55,-4.8,-7.561436063719482
COc1ccc(CCN(C)Cc2nc(-c3ccc(OC)c(OC)c3OC)no2)cc1OC,C15065283_decoy,CASP3,Decoy,0,-7.71427,-6.65,-2.44,-6.839994679826593
CCn1c(SCC(=O)OCC(=O)N(CCC#N)c2ccccc2F)nnc1-c1ccco1,C21181425_decoy,CASP3,Decoy,0,-8.50371,-6.62,-1.23,-6.845706939366919
COc1ccc(CCn2c(C)cc(C(=O)COC(=O)c3ccc([N+](=O)[O-])o3)c2C)cc1OC,C21374858_decoy,CASP3,Decoy,0,-7.79988,-6.5,-2.5,-6.008222859226509
COc1ccc(CCn2c(C)cc(C(=O)COC(=O)c3ccc(-n4cnnn4)cc3)c2C)cc1OC,C21375197_decoy,CASP3,Decoy,0,-8.26242,-7.12,-3.14,-7.536791278092751
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)/C=C/c2cc(OC)c(OC)cc2OC)c1C,C21465825_decoy,CASP3,Decoy,0,-8.41196,-6.77,-2.6,-5.87107326331036
CCc1nn2c(=O)cc(COC(=O)CCNC(=O)CCC(=O)c3cccs3)nc2s1,C21732073_decoy,CASP3,Decoy,0,-10.556,-7.23,-1.01,-7.411423174157262
C=CCn1c(SCC(=O)N(CC)Cc2ccc(OC)c(OC)c2)nnc1[C@H]1CCS(=O)(=O)C1,C21999725_decoy,CASP3,Decoy,0,-7.65249,-7.5,-1.7,-6.981014330181391
CC(=O)OC[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2Cl)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C22054778_decoy,CASP3,Decoy,0,-5.33572,-6.23,-1.77,-5.425644340160016
COc1cccc(-c2nnc(SCC(=O)N(CCC#N)Cc3ccco3)n2Cc2ccco2)c1,C24827938_decoy,CASP3,Decoy,0,-9.07519,-6.09,-2.76,-6.7394103441941935
C=CCN(Cc1cnc(S(=O)(=O)Cc2ccc(C)cc2)n1CCOC)C(=O)c1ccc2c(c1)OCO2,C35670116_decoy,CASP3,Decoy,0,-8.10908,-7.07,-3.43,-7.110522122830945
C=CCOC(=O)c1c(C)nc(-c2ccccc2)nc1C(=O)N1CCN(C(=O)CCC(=O)OCC)[C@@H](C)C1,C35703064_decoy,CASP3,Decoy,0,-8.08644,-7.7,-3.78,-7.854962453997883
CCCCN(CC(=O)N(Cc1ccco1)C[C@H]1CCCO1)C(=O)c1ccc([N+](=O)[O-])cc1,C35766824_decoy,CASP3,Decoy,0,-7.9292,-6.63,-1.25,-6.63111356449854
COCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C(=O)c1ccc2c(c1)OCO2,C35771079_decoy,CASP3,Decoy,0,-8.84291,-6.23,-3.01,-8.096503493715078
CCn1c(C)c(C(=O)CN(C[C@H]2CCCO2)C(=O)c2cc(OC)cc(OC)c2)c(C)c1C(=O)OC,C35868918_decoy,CASP3,Decoy,0,-8.1409,-6.58,-3.57,-7.041523500433238
O=C(C1CC1)N(CCN1CCOCC1)Cc1cnc(S(=O)(=O)Cc2ccccc2F)n1C[C@H]1CCCO1,C36030645_decoy,CASP3,Decoy,0,-10.535,-6.38,-2.37,-8.06012294369675
CCn1nccc1CN(CCc1ccc(OC)c(OC)c1)S(=O)(=O)c1c(C)nn(C(F)F)c1C,C36615286_decoy,CASP3,Decoy,0,-7.92713,-6.5,-2.17,-7.947269873683576
CC(C)N(C(=O)[C@@H](C)OC(=O)c1cccc(C(=O)O[C@H](C)C(=O)N(C(C)C)C(C)C)n1)C(C)C,C21604396_decoy,CASP3,Decoy,0,-8.62268,-6.49,-3.59,-10.18720850298716
CCOC(=O)C1=C(C(=O)CSc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)C(C)=N[C@@H]1C,C40061651_decoy,CASP3,Decoy,0,-8.59539,-6.13,-1.33,-6.321375129565725
CCOC(=O)C1=C(C(=O)CSc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)C(C)=N[C@H]1C,C40061653_decoy,CASP3,Decoy,0,-7.54949,-6.44,-1.58,-5.848471227955169
CCCCN(CC(=O)N1CCN(c2ccc(-c3ccc(OC)c(OC)c3)nn2)CC1)C(=O)COC,C40401986_decoy,CASP3,Decoy,0,-8.93728,-6.4,-2.27,-6.559814554346929
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C44170033_decoy,CASP3,Decoy,0,-7.03255,-7.11,-4.3,-6.563263087929048
CC(=O)OC[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2Cl)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C44699242_decoy,CASP3,Decoy,0,-5.91281,-5.6,-1.47,-5.8452530203640505
CC(=O)OC[C@@H]1O[C@@H](Sc2ccc(C)cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C44963855_decoy,CASP3,Decoy,0,-6.52815,-5.72,-2.09,-5.771322688703933
CCCOc1ccc(-c2nc3c(c(=O)[nH]c(=O)n3CC(C)C)n2CCOC)cc1OCC,C32834876_decoy,CASP3,Decoy,0,-8.18279,-5.82,-2.85,-5.189365452459856
COc1ccc(CCn2c(C)cc(C(=O)COC(=O)Cn3nnc4ccccc43)c2C)cc1OC,C57646401_decoy,CASP3,Decoy,0,-7.94589,-7.16,-2.12,-6.659325944121857
COCCOC(=O)CCc1cc2c(C)cc(=O)oc2cc1OC(=O)CCc1cc(Cl)no1,C41358918_decoy,CASP3,Decoy,0,-6.73377,-6.72,-2.77,-7.292656322913042
CCOC(=O)C1=C(C)C(C(=O)COC(=O)CCc2cc(OC)c(OC)c(OC)c2)=N[C@H]1C,C39948598_decoy,CASP3,Decoy,0,-8.09148,-5.72,-1.33,-6.581545373539168
C=CCN1[C@@H](CSc2nc(C)cc(C)n2)N=N[C@H]1SCC(=O)/N=C1\N=C(C)[C@H](C(=O)OCC)S1,C63641394_decoy,CASP3,Decoy,0,-8.75382,-7.53,-2.37,-6.56833325860239
CCOC(=O)C1=C(C)C(C(=O)[C@H](C)OC(=O)CCc2c(C)nc3nc(SC)nn3c2C)=N[C@H]1C,C64137409_decoy,CASP3,Decoy,0,-8.23929,-6.03,-2.16,-7.308764484121853
CCOC(=O)c1c(-c2cccs2)csc1NC(=O)COC(=O)CCNC(=O)c1ccco1,C08880204_decoy,CASP3,Decoy,0,-10.8084,-6.61,-3.95,-9.62910377773902
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C09229645_decoy,CASP3,Decoy,0,-7.99252,-7.24,-1.53,-7.00835170546077
CC(=O)OC[C@H]1[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](Sc2ccc(Cl)cc2)O[C@H]1COC(C)=O,C09761102_decoy,CASP3,Decoy,0,-7.32847,-6.55,-1.49,-7.410150083117768
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)OCCCn1c(=O)[nH]c2ccccc21,C09812886_decoy,CASP3,Decoy,0,-7.02334,-6.68,-1.1,-5.436303238264077
CCOC(=O)c1ccc(N(Cc2cccnc2)C(=S)NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1,C09886702_decoy,CASP3,Decoy,0,-9.19895,-6.51,-3.91,-8.689963046143188
CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CNC(=O)c3ccc(OC)c(OC)c3)c2C)cc1,C10318493_decoy,CASP3,Decoy,0,-6.69709,-6.49,-2.29,-6.344593406094258
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)CCCN(C)S(=O)(=O)c2cccs2)c1C,C11032967_decoy,CASP3,Decoy,0,-9.17315,-5.24,-2.33,-6.391045586911817
CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)c1C,C11050179_decoy,CASP3,Decoy,0,-8.70012,-7.25,-1.62,-7.257592159174335
CCOc1nn(CC)cc1-c1nnc(SCC(=O)NCc2ccccc2Cl)n1CCOC,C12875267_decoy,CASP3,Decoy,0,-8.80168,-5.4,-4.59,-7.545167018698015
COc1ccc(/C=C/C(=O)NC(=S)N2CCNC(=O)[C@H]2CC(=O)OCCC(C)C)cc1OC,C14774965_decoy,CASP3,Decoy,0,-8.7731,-6.39,-1.85,-8.884940199516091
CCCCn1c(=O)[nH]c(=O)c2c1nc(CCC(=O)Oc1ccc(C(=O)OC)cc1)n2CC(C)C,C14872223_decoy,CASP3,Decoy,0,-8.5645,-7.19,-1.92,-8.688805789156728
CCC(CC)C(=O)Nc1nnc(SCc2cc(=O)c(OC(=O)COc3ccc(F)cc3)co2)s1,C16047896_decoy,CASP3,Decoy,0,-7.80068,-6.2,-1.2,-5.512344325728906
COCCCN(CC(=O)N(Cc1cccn1C)C1CC1)S(=O)(=O)c1ccc(NC(C)=O)cc1,C16463332_decoy,CASP3,Decoy,0,-7.4314,-7.01,-1.6,-7.689287265027505
CCNc1nnc(SCC(=O)Nc2sc(C(=O)OCC)c(C)c2C(=O)OCC)s1,C18662944_decoy,CASP3,Decoy,0,-10.667,-6.47,-0.58,-8.763110826737437
CCCCCCc1nc(SCC(=O)NC[C@H]2CCCO2)c2c(=O)n(C)c(=O)n(CCC)c2n1,C21138847_decoy,CASP3,Decoy,0,-8.41019,-5.47,-1.99,-6.4799102226853575
COc1cc(-c2nnc(COC(=O)CCNC(=O)c3ccc(C(C)(C)C)cc3)o2)cc(OC)c1OC,C21684558_decoy,CASP3,Decoy,0,-7.76382,-7.87,-2.6,-6.130498356333429
C=CCn1c(SCC(=O)NCCOc2ccc(OCC)cc2)nnc1[C@@H]1CCS(=O)(=O)C1,C21999785_decoy,CASP3,Decoy,0,-8.90751,-6.19,-1.35,-7.721705090238504
CCn1c(CN2CCCCCC2=O)nnc1SC[C@@H](O)COCc1ccc(OC)c(OC)c1,C22133910_decoy,CASP3,Decoy,0,-10.1821,-6.44,-2.32,-9.81110393904675
CCOC(=O)/C(C#N)=C/Nc1ccccc1NS(=O)(=O)c1ccc(OCC)c(OCC)c1,C23330456_decoy,CASP3,Decoy,0,-7.85566,-7.5,-2.0,-6.994678365158948
CCOc1ccc(-c2nnc(SC(F)F)n2CCC(=O)OCC(=O)/C(C#N)=C(\C)N)cc1,C23864812_decoy,CASP3,Decoy,0,-9.73565,-6.85,-1.56,-6.960521286474556
CCOc1ccccc1OCCCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1,C24177193_decoy,CASP3,Decoy,0,-8.01312,-6.48,-1.82,-6.042221547631367
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CC[NH+](C)C)cc1OC,C16806671_decoy,CASP3,Decoy,0,-8.76352,-6.64,-2.28,-7.962052107790569
CCOC(=O)Cc1nnc(SCC(=O)c2ccc([C@@H](C)NC(C)=O)cc2)n1Cc1ccco1,C24508705_decoy,CASP3,Decoy,0,-7.67025,-7.41,-1.41,-6.452446904393718
CC(=O)OC[C@@H]1O[C@H](OC(=O)c2ccccc2)[C@@H](OS(C)(=O)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C25691513_decoy,CASP3,Decoy,0,-7.48075,-5.08,-3.12,-6.271939698195862
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@@H]2c2ccc(C)o2)c1C,C33515727_decoy,CASP3,Decoy,0,-8.66672,-6.91,-2.41,-8.44935933570893
CCCCC(=O)N(CCN1CCOCC1)CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1,C16649872_decoy,CASP3,Decoy,0,-8.84283,-7.13,-3.47,-7.868230587912413
CCCCOc1ccc([C@H]2C(C(=O)c3c(C)nc4ccccn34)=C([O-])C(=O)N2CCC[NH+](C)C)cc1OC,C33814110_decoy,CASP3,Decoy,0,-7.84612,-6.67,-3.57,-6.588410324273407
COc1cccc(C(=O)N(CCN2CCOCC2)C[C@@H]2CN(C[C@@H](O)COC(C)C)CCO2)c1,C34691653_decoy,CASP3,Decoy,0,-9.52788,-6.15,-1.45,-7.556111894810785
CCOCCCN(Cc1nc(C(=O)OC)co1)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C,C33873317_decoy,CASP3,Decoy,0,-7.12879,-6.12,-2.44,-5.56954431495152
COCCNC(=O)Cc1csc(NC(=O)CN(CCOC)C(=O)c2ccc(Cl)cc2)n1,C35416235_decoy,CASP3,Decoy,0,-9.136,-5.13,-1.95,-7.185912857349081
CCCN(Cc1cccn1Cc1ccc(C(=O)NCCCN2CCOCC2)o1)C(=O)c1ccco1,C16533817_decoy,CASP3,Decoy,0,-9.29446,-7.07,-1.36,-7.313808998769248
CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)CC(C)C)=CO[C@H](OC(=O)CC(C)C)[C@H]2[C@@]1(O)CCl,C35465184_decoy,CASP3,Decoy,0,-8.52265,-7.18,-2.12,-7.150193968794653
CC(=O)O[C@H]1C[C@]2(O)C(COC(=O)CC(C)C)=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@]1(O)CCl,C35465187_decoy,CASP3,Decoy,0,-7.87644,-6.55,-2.88,-7.05939655940532
C=CCOc1ccc([C@@H]2C(C(=O)c3nc4c(C)cccn4c3C)=C([O-])C(=O)N2CCC[NH+](C)C)cc1OCC,C35484085_decoy,CASP3,Decoy,0,-8.38035,-6.7,-3.25,-7.174872466206731
CC(C)(C)CC(=O)N(CCCN1CCOCC1)CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1,C16652440_decoy,CASP3,Decoy,0,-8.62362,-6.31,-3.16,-6.421683122079076
CCONC(=O)c1csc(CN(CCc2ccc(OC)c(OC)c2)Cc2ccc3c(c2)OCO3)n1,C35807813_decoy,CASP3,Decoy,0,-7.87703,-7.02,-3.18,-7.049432964566762
COCCN(C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1OC)C(=O)COC,C35918125_decoy,CASP3,Decoy,0,-7.70501,-6.06,-2.77,-6.9103543276738
CCOc1cc(C(=O)NCC(=O)O[C@@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)cc(OCC)c1OCC,C09612609_decoy,CASP3,Decoy,0,-7.29003,-6.68,-1.82,-6.78981063453719
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C39944755_decoy,CASP3,Decoy,0,-6.54869,-6.02,-2.65,-5.677903124898494
CCCn1c(SCC(=O)Nc2sc(C(=O)OCC)c(C)c2C(=O)OC)nnc1C1CC1,C39973500_decoy,CASP3,Decoy,0,-9.32972,-7.07,-2.04,-9.562352061598157
COc1ccc(C(=O)NCCCN(Cc2cccnc2)C(=O)OC(C)(C)C)c(OC)c1OC,C40146937_decoy,CASP3,Decoy,0,-7.07756,-6.54,-3.24,-5.741965086565481
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)OC(=O)CCCCCNC1=NS(=O)(=O)c2ccccc21,C40159084_decoy,CASP3,Decoy,0,-8.03462,-6.84,-1.37,-6.64052095113999
CCC[C@@H](c1nnnn1C1CCCC1)N(CCCO)Cc1cc2cc(OCC)ccc2[nH]c1=O,C13501057_decoy,CASP3,Decoy,0,-8.71841,-6.56,-0.96,-7.102155195530999
CCOC(=O)c1sc(NC(=O)COC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)cc1C,C58458446_decoy,CASP3,Decoy,0,-8.86398,-6.36,-1.24,-6.796382556236969
CCN(CC)c1ccc(/C=N/Nc2nc(SCC(=O)c3ccc(OC)c(OC)c3)n[nH]2)cc1,C59005557_decoy,CASP3,Decoy,0,-9.30111,-6.7,-1.66,-5.9133755822604135
C=CCn1cc(/C=N/NC(=O)CSc2nnc(CNc3ccc(Cl)cc3)n2CC=C)cn1,C59830027_decoy,CASP3,Decoy,0,-9.56504,-6.49,-2.34,-6.807389998886692
COCCOC(=O)CCc1cc2c(C)cc(=O)oc2c2c1OCN(CCc1ccc(OC)c(OC)c1)C2,C41667060_decoy,CASP3,Decoy,0,-8.4923,-8.27,-1.56,-7.674053384445817
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CCC[NH+](CC)CC)[C@@H]2c2ccco2)C(C)=N1,C20193222_decoy,CASP3,Decoy,0,-8.7318,-5.9,-2.21,-6.581448488964834
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)[C@@H]2C(C)=NC(C(=O)OC)=C2C)[C@H]1c1ccccc1OC,C20133789_decoy,CASP3,Decoy,0,-7.9571,-6.94,-3.49,-6.923309107933979
CCCCN(CC)C(=O)c1cn(CCC)nc1S(=O)(=O)N1CCN(c2ccccc2OCC)CC1,C67337010_decoy,CASP3,Decoy,0,-7.48246,-7.02,-2.22,-6.740167860424527
CCOC(=O)CCS(=O)(=O)c1ccc(Cc2ccc(S(=O)(=O)CCC(=O)OCC)cc2)cc1,C06546114_decoy,CASP3,Decoy,0,-7.68524,-5.74,-3.22,-6.418070317560489
Cc1cccc(CS(=O)(=O)NCCCCCc2nnc(S(=O)(=O)Cc3ccccc3)o2)c1,C09028786_decoy,CASP3,Decoy,0,-8.83979,-8.43,-2.13,-7.368985313919688
CCOc1ccc([C@@H](C(=O)NC(C)(C)CC)N(CCOC)C(=O)Cn2nnc3ccccc32)cc1,C13024428_decoy,CASP3,Decoy,0,-7.82773,-6.88,-3.01,-7.522811912504662
CCCCCCOc1ccc(C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCCOC)cc1Br,C14640620_decoy,CASP3,Decoy,0,-9.16848,-5.75,-2.03,-6.800534965712759
CCCCCCOc1ccc(C(=O)N2CCNC(=O)[C@H]2CC(=O)OCCOC)cc1Br,C14640623_decoy,CASP3,Decoy,0,-8.47885,-6.52,-1.72,-7.134186648395147
CCOC(=O)[C@@](NS(=O)(=O)c1ccc(C)cc1)(C(F)(F)F)P(=O)(OCC)OCC,C02569224_decoy,CASP3,Decoy,0,-5.94402,-5.97,-2.58,-7.1703213552959095
COCCCNC(=O)c1coc(CN(CCCOC)C(=O)c2ccc(Br)cc2)n1,C16456730_decoy,CASP3,Decoy,0,-7.3994,-5.12,-3.4,-6.08672518227755
CCOCCCNC(=O)c1coc(CN(CCCOCC)C(=O)C(c2ccccc2)c2ccccc2)n1,C16456759_decoy,CASP3,Decoy,0,-8.17761,-6.15,-3.61,-7.070261816511198
CCCCCc1ccc(C(=O)N(Cc2nc(C(=O)NC[C@@H]3CCCO3)co2)C[C@@H]2CCCO2)cc1,C16457624_decoy,CASP3,Decoy,0,-9.16021,-6.35,-1.63,-7.230481128719097
Cc1noc(C)c1CSc1ncccc1C(=O)OCC(=O)NCCc1ccc(OC(F)F)cc1,C19354661_decoy,CASP3,Decoy,0,-6.92556,-7.1,-4.19,-5.901784083674599
CCOC(=O)CCCNC(=O)COC(=O)[C@H]1CCC(=O)N(c2ccc(C)cc2)[C@H]1c1cccs1,C24155975_decoy,CASP3,Decoy,0,-9.33615,-5.95,-3.84,-9.492655218080138
COCCn1c(SC[C@@H](O)COCc2ccc(OC)c(OC)c2)nnc1-c1ccccc1,C24838045_decoy,CASP3,Decoy,0,-8.61597,-5.66,-3.87,-7.675145820700324
CCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1sccc1C)C(=O)CCC(=O)OCC,C33716758_decoy,CASP3,Decoy,0,-10.2816,-6.16,-2.87,-7.6571920304193615
COCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)N(C)C,C33765594_decoy,CASP3,Decoy,0,-6.31623,-5.12,-3.55,-5.697777511257532
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)S(=O)(=O)CC,C34763072_decoy,CASP3,Decoy,0,-9.4396,-5.93,-3.26,-7.634775196258539
CCS(=O)(=O)N(CCCOC)CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1,C34763090_decoy,CASP3,Decoy,0,-9.97703,-6.14,-3.54,-8.257866787143241
CCCS(=O)(=O)N(CCOC)CC(=O)N(Cc1ccc(Cl)cc1)C1CCN(C(=O)CC(C)C)CC1,C34909732_decoy,CASP3,Decoy,0,-9.1354,-6.24,-5.38,-6.7304067219132335
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CC[NH+](C)C)cc1OC,C35025617_decoy,CASP3,Decoy,0,-8.03823,-6.29,-1.93,-7.074172483942666
CCCCC[C@H]1SC[C@@H](C(=O)NCCc2ccccn2)N1C(=O)c1cc(OC)c(OC)c(OC)c1,C35193197_decoy,CASP3,Decoy,0,-8.1575,-5.77,-4.4,-7.129101686232841
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)S(C)(=O)=O,C35202336_decoy,CASP3,Decoy,0,-8.98195,-6.22,-2.91,-8.571220652196951
COCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(OC)c(OC)c1)C(=O)C1CC1,C35350662_decoy,CASP3,Decoy,0,-8.09675,-6.57,-3.46,-7.861441812611845
COCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(N(C)C)cc1)C(=O)N(C)C,C35350722_decoy,CASP3,Decoy,0,-7.23987,-5.88,-4.81,-6.073530239550317
COCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccco1)C(=O)Cc1cccs1,C35354579_decoy,CASP3,Decoy,0,-9.6445,-5.4,-2.82,-7.533420256731336
CCCCS(=O)(=O)N(CCCN1CCOCC1)CC(=O)N(Cc1ccccc1)Cc1ccc(C)o1,C35356274_decoy,CASP3,Decoy,0,-7.88653,-5.41,-3.27,-6.8113480964917565
CCS(=O)(=O)N(CCCOC)CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1,C35384555_decoy,CASP3,Decoy,0,-10.2189,-6.36,-3.93,-7.86218533015551
C=CCN(CC(=O)N(CCOC)Cc1cccn1Cc1ccccc1)C(=O)CCCC(=O)OC,C35393138_decoy,CASP3,Decoy,0,-7.11743,-5.72,-4.24,-5.936426580316738
COCCOCCOCC(=O)N(Cc1c[nH]c2ccc(F)cc12)C[C@H]1COc2ccccc2O1,C35453749_decoy,CASP3,Decoy,0,-7.60791,-5.67,-2.76,-6.097359074645083
CCCN(Cc1cccn1Cc1ccc(C(=O)N(CCC#N)Cc2cccnc2)o1)C(=O)CC,C35454957_decoy,CASP3,Decoy,0,-7.95282,-6.32,-3.86,-7.845865226735834
CCCN(Cc1cccn1Cc1ccc(C(=O)NCCCN2CCOCC2)o1)C(=O)CC(C)C,C16533940_decoy,CASP3,Decoy,0,-8.87365,-6.55,-3.72,-7.762461662005616
C=CCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCC[NH+](C)C)cc1OCC,C35566580_decoy,CASP3,Decoy,0,-9.21231,-6.53,-1.67,-7.21007312163608
CCOc1cc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCC[NH+](C)C)ccc1OCCC(C)C,C35566586_decoy,CASP3,Decoy,0,-9.57713,-5.73,-2.1,-7.009176322705698
CCCCCOc1ccc([C@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCCn2cc[nH+]c2)cc1,C35567789_decoy,CASP3,Decoy,0,-8.01561,-6.37,-3.75,-6.766821655735692
CCS(=O)(=O)N(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(OC)c(OC)c1)C1CC1,C35760875_decoy,CASP3,Decoy,0,-7.30018,-5.94,-3.81,-6.055911693476128
CCOCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1)C(=O)c1ccccc1F,C33851346_decoy,CASP3,Decoy,0,-7.96326,-6.97,-2.7,-6.610096537597367
COCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)o1)C(=O)C1CCCC1,C35809026_decoy,CASP3,Decoy,0,-9.35583,-5.98,-4.14,-7.1811522472589
CCC(=O)N(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)o1)C[C@@H]1CCCO1,C35809027_decoy,CASP3,Decoy,0,-8.14101,-6.35,-4.2,-7.1166941671472665
COc1ccc(CCN(Cc2ccc(C)o2)C(=O)CN(C[C@H]2CCCO2)C(=O)c2ccc(C)cc2)cc1OC,C35809032_decoy,CASP3,Decoy,0,-8.68216,-7.4,-4.68,-7.164881043130088
COc1ccc(CCN(Cc2ccc(C)o2)C(=O)CN(C[C@H]2CCCO2)C(=O)c2cccs2)cc1OC,C35809036_decoy,CASP3,Decoy,0,-10.2696,-6.58,-4.31,-7.298569042777288
COCCOCCOCC(=O)N(Cc1cn(-c2ccccc2)nn1)Cc1ccc(F)cc1Cl,C35836675_decoy,CASP3,Decoy,0,-7.15834,-5.6,-3.94,-6.120439846619859
C=CCOC[C@@H](O)CN1CCO[C@H](CN(CCN2CCOCC2)C(=O)c2ccc(F)cc2)C1,C35866279_decoy,CASP3,Decoy,0,-7.83347,-6.92,-2.32,-7.257583583413722
O=C(c1ccccc1)N(CCN1CCOCC1)C[C@@H]1CN(C[C@H](O)COCC(F)(F)C(F)F)CCO1,C35866327_decoy,CASP3,Decoy,0,-8.13422,-6.42,-3.42,-6.882904519487944
CCOC(=O)c1[nH]c(C)c(C(=O)[C@H](C)N(CCOC)C(=O)c2ccc(OC)cc2OC)c1C,C35869122_decoy,CASP3,Decoy,0,-6.73348,-5.43,-2.14,-6.77157417224421
CCNC(=S)N(Cc1cnc(S(=O)(=O)Cc2ccccc2F)n1C[C@H]1CCCO1)C[C@@H]1CCCO1,C36032287_decoy,CASP3,Decoy,0,-9.42177,-6.62,-2.7,-7.558262523209236
CCCCC[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(Cc1ccco1)C(=O)COC,C36505587_decoy,CASP3,Decoy,0,-7.75741,-5.76,-5.14,-7.016639121914946
CCOC(=O)CCS(=O)(=O)c1ccc(-c2ccc(S(=O)(=O)CCC(=O)OCC)cc2)cc1,C06546116_decoy,CASP3,Decoy,0,-8.06542,-6.61,-2.37,-8.511917868742858
COC[C@@H](C)n1c(C)cc(C(=O)COC(=O)[C@H](NC(=O)c2cc(OC)cc(OC)c2)C(C)C)c1C,C39191033_decoy,CASP3,Decoy,0,-7.50382,-5.87,-2.8,-6.164469672290517
CCOCCCn1c(SCC(=O)C2=C(C(=O)OCC)C(C)=N[C@H]2C)nc2ccccc2c1=O,C39612323_decoy,CASP3,Decoy,0,-7.23601,-6.5,-3.15,-6.4795240030251895
COCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccc(Cl)cc2)c(OC)c1,C39795716_decoy,CASP3,Decoy,0,-7.42661,-6.95,-1.24,-7.530569192196379
COCCN(CCC(=O)N(CCC#N)Cc1cccnc1)c1nc(Cc2ccc(C)cc2)ns1,C40372325_decoy,CASP3,Decoy,0,-9.48064,-5.38,-2.99,-6.786401541080073
CSc1nc(C)c(CCC(=O)NCCCN(Cc2cccnc2)C(=O)OC(C)(C)C)c(C)n1,C59403808_decoy,CASP3,Decoy,0,-7.72745,-7.06,-3.38,-6.647779682878418
CCN(CC)C(=O)Cn1cc(C(=O)C(=O)N(CCOC)CCOC)c2ccccc21,C04271922_decoy,CASP3,Decoy,0,-6.0798,-6.34,-1.77,-6.078951442386757
CCOc1ccc(/C=C/C(=O)OCC(=O)c2cc(C)n([C@@H](C)COC)c2C)cc1OC,C04495407_decoy,CASP3,Decoy,0,-7.75746,-6.37,-1.57,-7.779007028977442
CCOc1cc(/C=N/n2cnnc2)ccc1OCCOCCOc1ccc(C)cc1,C02888139_decoy,CASP3,Decoy,0,-6.63672,-5.68,-1.97,-7.2693701176906735
CCOC(=O)CCC(=O)N(CC(=O)N(Cc1ccco1)Cc1cccn1C)C(C)C,C04955715_decoy,CASP3,Decoy,0,-7.44174,-6.88,-2.5,-7.875266614259774
COCCCn1c(C)cc(C(=O)COC(=O)c2ccc(OC)c(OC)c2OC)c1C,C05631399_decoy,CASP3,Decoy,0,-7.16004,-6.11,-2.64,-5.955668558927814
COCCCn1c(C)cc(C(=O)COC(=O)c2cc(OC)c(OC)cc2OC)c1C,C05835224_decoy,CASP3,Decoy,0,-6.95424,-6.06,-1.82,-5.277170976619389
CCOC(=O)C(OCC)(OCC)[C@H](c1ccccc1)[C@H](C#N)S(=O)(=O)c1ccccc1,C08445503_decoy,CASP3,Decoy,0,-5.77197,-5.1,-3.42,-6.336547172927253
CCCOP(=O)(OCCC)OCCCCOP(=O)(OCCC)OCCC,C04705687_decoy,CASP3,Decoy,0,-6.33718,-4.57,-1.73,-6.265846128853727
CCOC(=O)c1c(OCCOC(=O)c2cccc(C(F)(F)F)c2)noc1/N=C/N(C)C,C08762712_decoy,CASP3,Decoy,0,-6.95619,-7.21,-3.38,-7.037507441532708
CCOc1ccc(N(CCC#N)C(=O)COC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cc1,C20884483_decoy,CASP3,Decoy,0,-9.04104,-5.08,-3.48,-6.154401436991121
CCOP(=O)(CN(C)[C@H](c1ccccc1)P(=O)(OCC)OCC)OCC,C22205032_decoy,CASP3,Decoy,0,-5.10765,-4.5,-3.59,-4.866930352616526
COc1cc(C(=O)OCC(=O)N(CCC#N)CCC#N)cc(Cl)c1OCC(C)C,C23889359_decoy,CASP3,Decoy,0,-8.43441,-6.21,-1.42,-8.300200011400193
CCOc1cc(C#N)ccc1OCC(=O)N(Cc1ccc(OC(F)F)c(OCC)c1)C1CC1,C24512021_decoy,CASP3,Decoy,0,-7.40757,-6.1,-4.01,-6.715302105638058
COC[C@@H](C)n1c(C)cc(C(=O)COC(=O)CCc2ccc(OC)c(OC)c2)c1C,C28865711_decoy,CASP3,Decoy,0,-7.25329,-5.24,-2.54,-6.086861290485331
CCCc1noc(CSc2nnc(-c3ccc(OC)c(OC)c3)n2CCCOC)n1,C29606267_decoy,CASP3,Decoy,0,-7.82003,-5.4,-2.12,-5.879849709433985
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)C1CC1,C33383293_decoy,CASP3,Decoy,0,-8.22483,-6.68,-4.95,-6.668064145493882
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)CCl,C33657433_decoy,CASP3,Decoy,0,-8.98498,-5.52,-2.04,-6.239242671674467
COCCCN(CC(=O)N(CCOC)Cc1cccn1C)C(=O)c1cc(Cl)cc(Cl)c1,C33731830_decoy,CASP3,Decoy,0,-6.69213,-6.03,-1.47,-7.129203746723887
C=CCN(CC(=O)N(Cc1ccco1)C[C@H]1CCCO1)C(=O)c1ccc(OCCCC)cc1,C33794547_decoy,CASP3,Decoy,0,-7.32187,-7.05,-3.2,-7.30012530042965
CCCCC(=O)N(CCN1CCOCC1)CC(=O)N(Cc1ccc(F)cc1)Cc1ccc(C)o1,C16649984_decoy,CASP3,Decoy,0,-8.16029,-6.19,-3.06,-6.363927194151359
COCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)C(=O)c1cccc(F)c1,C35314248_decoy,CASP3,Decoy,0,-9.99245,-7.44,-5.54,-9.902114094575303
CCOCCCN(Cc1nc(C(=O)OC)co1)S(=O)(=O)/C=C/c1ccccc1,C35335446_decoy,CASP3,Decoy,0,-7.60523,-5.71,-1.83,-6.041546726892421
CCCCN(Cc1cccn1C)C(=O)CN(C(=O)CCC(=O)OCC)[C@H](C)CC,C35336020_decoy,CASP3,Decoy,0,-6.30851,-6.28,-2.97,-5.689448889276515
CC[C@@H](C)N(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccco1)C(=O)[C@@H](C)Cl,C35354540_decoy,CASP3,Decoy,0,-9.0403,-5.42,-4.19,-8.24093548716208
CC[C@@H](C)N(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccco1)C(=O)[C@H](C)Cl,C35354545_decoy,CASP3,Decoy,0,-8.06945,-6.76,-2.35,-7.205819729396329
CCCCOc1ccc(C(=O)N(CC(=O)N(Cc2ccco2)C[C@H]2CCCO2)C2CC2)cc1,C35356843_decoy,CASP3,Decoy,0,-7.93258,-5.73,-3.31,-6.145325653783629
COCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1sccc1C)C(C)=O,C35383361_decoy,CASP3,Decoy,0,-8.41646,-6.4,-2.74,-7.049978529771524
CCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)COC,C35394369_decoy,CASP3,Decoy,0,-7.59754,-5.39,-1.95,-6.946447509217258
COCCCN(CC(=O)N(Cc1ccccc1)Cc1cccn1Cc1ccccc1)C(=O)c1cccnc1,C35395193_decoy,CASP3,Decoy,0,-8.58838,-6.76,-1.84,-7.773355230410862
CCCCN(Cc1cccn1C)C(=O)CN(CCOC)C(=O)c1cc(OC)cc(OC)c1,C35745223_decoy,CASP3,Decoy,0,-7.39881,-5.04,-2.91,-5.891580178861121
COCCCN(CC(=O)N(Cc1ccco1)Cc1cccn1C)C(=O)c1ccc(C(F)(F)F)cc1,C35745616_decoy,CASP3,Decoy,0,-7.93726,-7.29,-2.76,-7.600090866784154
CCCCS(=O)(=O)N(CC(=O)N(Cc1ccc(F)cc1)Cc1ccco1)C[C@@H]1CCCO1,C35767887_decoy,CASP3,Decoy,0,-8.48325,-6.91,-1.52,-6.626790990112949
COCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C(=O)Cc1cccs1,C35771073_decoy,CASP3,Decoy,0,-9.91855,-6.13,-1.96,-8.498298837721144
COc1ccc(CCN(Cc2cccs2)C(=O)CN(C[C@@H]2CCCO2)C(=O)C2CCC2)cc1OC,C35796310_decoy,CASP3,Decoy,0,-8.99718,-6.64,-3.08,-6.668972215501929
CCCC(=O)N(CCOC)CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1,C35797625_decoy,CASP3,Decoy,0,-8.57544,-5.46,-2.75,-7.74890420930703
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)C(=O)C1CCC1,C35799044_decoy,CASP3,Decoy,0,-10.6128,-5.58,-3.77,-7.814005749476203
CCOCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)[C@@H](C)Cl,C35799078_decoy,CASP3,Decoy,0,-9.27101,-6.36,-2.98,-7.618270731834922
CCOCCCN(C(=O)CC(C)C)[C@H](C)C(=O)c1c(C)c(C(=O)OC)n(CC)c1C,C36025690_decoy,CASP3,Decoy,0,-7.93663,-6.18,-1.49,-8.871475571481485
C=CCN(Cc1cnc(S(=O)(=O)Cc2ccccc2)n1CCOC)C(=O)CC(C)(C)C,C36030365_decoy,CASP3,Decoy,0,-7.40203,-5.91,-2.98,-6.235321180447976
COCCCN(Cc1csc(COc2c(OC)cccc2OC)n1)C(=O)CC(C)C,C36114989_decoy,CASP3,Decoy,0,-8.36619,-5.23,-1.45,-5.859835051703555
COC[C@H](C)n1c(C)cc(C(=O)COC(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)c1C,C39588619_decoy,CASP3,Decoy,0,-7.49567,-5.99,-1.11,-6.030583670577695
COCCn1c(Cc2ccc(OC)cc2)nnc1SCCOc1c(C=O)cccc1OC,C39755449_decoy,CASP3,Decoy,0,-7.0043,-6.14,-2.28,-6.015831566421325
C=CCc1ccc(OCCCCn2c(CN(C)C(=O)c3cccnc3)nc3ccccc32)c(OC)c1,C40181186_decoy,CASP3,Decoy,0,-7.30543,-7.0,-1.71,-6.64693533145623
C=CCO[C@@H]1[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@@H](Sc2ccccc2)[C@H]1OC(C)=O,C44075540_decoy,CASP3,Decoy,0,-8.35701,-6.22,-1.99,-6.490285786032141
CCCCCCN(CCN1CCOCC1)C(=O)c1cc(S(=O)(=O)N(CC)CC)cn1C,C48310609_decoy,CASP3,Decoy,0,-8.21877,-6.25,-3.02,-7.059214394998088
CCCN(CC(=O)N(Cc1ccco1)Cc1cccn1C)C(=O)CCC(=O)OCC,C04782515_decoy,CASP3,Decoy,0,-7.19346,-6.09,-1.51,-6.066759775880754
CCOCCCN(Cc1nc(C(=O)OCC)cs1)C(=O)c1ccc([N+](=O)[O-])cc1,C04380696_decoy,CASP3,Decoy,0,-6.64504,-6.7,-4.12,-6.31370564788755
CCCN(Cc1cnc(S(=O)(=O)CCOC)n1Cc1ccccc1)C[C@H]1CCCO1,C55091182_decoy,CASP3,Decoy,0,-9.08281,-5.34,-2.37,-7.796405063463585
CCn1c(C)cc(C(=O)COC(=O)/C=C/C(=O)OCC(=O)c2cc(C)n(CC)c2C)c1C,C32827058_decoy,CASP3,Decoy,0,-7.27736,-6.65,-3.15,-7.376829636377419
CCCCN(CC(F)(F)F)C(=O)c1cc(OC)c(OCCOC)cc1[N+](=O)[O-],C59252518_decoy,CASP3,Decoy,0,-5.35871,-4.44,-2.26,-5.211648446823525
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)c1nnn[n-]1,C04204389_decoy,CASP3,Decoy,0,-7.09565,-5.55,-2.56,-6.7578338075142375
C[C@](O)(/C=C/[C@@H]1CC=CC(=O)O1)[C@@H](C[C@H](O)/C=C/C=C/C=C/CO)OP(=O)([O-])[O-],C04213388_decoy,CASP3,Decoy,0,-9.24119,-7.21,-3.09,-7.299450165902849
CCCCOc1ccc([C@H](CCC(=O)N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@H]3C(=O)[O-])C(=O)[O-])cc1,C12296181_decoy,CASP3,Decoy,0,-7.37078,-6.72,-3.15,-7.711739518783416
CCCCN(C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1CCO)[C@H](C)CC,C13045600_decoy,CASP3,Decoy,0,-7.49414,-6.55,-3.86,-6.575676851000303
CCCn1c(C)cc(C(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2CCCOC)c1C,C13048009_decoy,CASP3,Decoy,0,-8.27404,-6.66,-2.44,-6.829736258950861
CCCCC[C@@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13052263_decoy,CASP3,Decoy,0,-8.09617,-6.35,-1.32,-6.581515209565951
CCCCC[C@H](C)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1C[C@@H](C)O,C13052264_decoy,CASP3,Decoy,0,-7.78086,-4.77,-0.32,-6.35566357702265
CCOc1ccc(-c2nnc(SCc3ccc(C(=O)OC)o3)n2CCC(=O)[O-])cc1,C13193961_decoy,CASP3,Decoy,0,-9.38589,-6.73,-1.65,-6.5802454865688444
CCOc1ccc(-c2nnc(SCC(=O)c3cc(C)n(Cc4ccco4)c3C)n2CC(=O)[O-])cc1,C13195281_decoy,CASP3,Decoy,0,-8.06284,-7.71,-2.69,-7.181633730348172
CCCNC(=O)CN(C)C(=O)CSc1nnc(-c2ccc(C)cc2)n1CCC(=O)[O-],C13197563_decoy,CASP3,Decoy,0,-7.88768,-6.67,-0.92,-10.336377245303929
CCCc1nnc(SCC(=O)c2cc(C)n(-c3ccc(OC(F)(F)F)cc3)c2C)n1CC(=O)[O-],C13203277_decoy,CASP3,Decoy,0,-6.53383,-7.13,-2.72,-6.178584234319929
CC(C)Cn1c(SCC(=O)NCCCOC(C)C)nc2cc(C(=O)[O-])ccc2c1=O,C13231889_decoy,CASP3,Decoy,0,-9.25153,-6.74,-3.46,-8.051011253819983
CCOC(CCCNS(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC)OCC,C13251233_decoy,CASP3,Decoy,0,-8.69955,-6.18,-2.03,-7.043549859684667
COCCCNC(=O)CN(C)S(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC,C13252230_decoy,CASP3,Decoy,0,-8.19037,-4.87,-2.4,-5.990893116695767
C[C@](O)(/C=C/[C@@H]1CC=CC(=O)O1)[C@@H](C[C@@H](O)/C=C/C=C/C=C/CO)OP(=O)([O-])[O-],C13761330_decoy,CASP3,Decoy,0,-9.79675,-7.24,-0.9,-8.720329323574822
C[C@@](O)(/C=C/[C@H]1CC=CC(=O)O1)[C@@H](C[C@@H](O)/C=C/C=C/C=C/CO)OP(=O)([O-])[O-],C13761331_decoy,CASP3,Decoy,0,-8.57453,-6.99,-0.71,-6.411992026415232
CCO[P@@](=O)([O-])c1ccccc1NCCNc1ccccc1[P@](=O)([O-])OCC,C13809828_decoy,CASP3,Decoy,0,-4.76194,-6.4,-1.6,-5.5199422111059615
C=C1CC[C@@H]2[C@](C)(COC(=O)CCC(=O)[O-])[C@@H](OC(=O)CCC(=O)[O-])CC[C@]2(C)[C@H]1/C=C/C1=CCOC1=O,C15955476_decoy,CASP3,Decoy,0,-8.34585,-8.19,-3.26,-10.40766206057424
CCO[P@](=O)([O-])c1ccc(OCCOCCOc2ccc([P@](=O)([O-])OCC)cc2)cc1,C13810550_decoy,CASP3,Decoy,0,-5.11128,-5.62,-4.28,-5.03057692941634
CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2OCC)C(C(=O)OCC)=C([O-])N1,C20057915_decoy,CASP3,Decoy,0,-7.11449,-6.66,-1.84,-6.624117410805281
CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OCC)C(C(=O)OCC)=C([O-])N1,C20057916_decoy,CASP3,Decoy,0,-6.44404,-6.16,-3.91,-5.951952846908126
COCCOc1cc([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])c(C(=O)[O-])cc1OC,C22411115_decoy,CASP3,Decoy,0,-6.39024,-5.3,-1.66,-5.805386243026181
O=C([O-])CC1(CC(=O)NCCCCCCNC(=O)CC2(CC(=O)[O-])CCCC2)CCCC1,C26893702_decoy,CASP3,Decoy,0,-7.54698,-5.47,-3.52,-6.629728979957298
CC(=O)CC[C@H]1c2coc3c4c(cc(c23)O[C@@]1(C)CCC=C(C)C)C(=O)N([C@@H](CCC(=O)[O-])C(=O)[O-])C4,C31164481_decoy,CASP3,Decoy,0,-8.21027,-7.43,-2.62,-7.91701034460426
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCn2ccnc2)cc1OCC,C33532937_decoy,CASP3,Decoy,0,-8.27465,-5.82,-2.16,-8.36595710710543
C=CCCOc1ccc(-c2nnc(CCC(=O)NC[C@H]3CCCO3)c([O-])n2)cc1OC,C34767486_decoy,CASP3,Decoy,0,-8.58227,-6.95,-1.26,-5.81141703655907
CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OCC)[C@@H](C(=O)OCC)C([O-])=N1,C09110611_decoy,CASP3,Decoy,0,-7.5437,-5.25,-2.12,-6.781835861811389
COCCN1C(=O)C([O-])=C(C(=O)c2ccc(OCC(C)C)cc2C)[C@H]1c1ccc(OC)c(OC)c1,C09019150_decoy,CASP3,Decoy,0,-8.16814,-6.96,-4.38,-7.894514755441754
C[C@](O)(/C=C/[C@H]1CC=CC(=O)O1)[C@@H](C[C@@H](O)/C=C\C=C/C=C/CO)OP(=O)([O-])[O-],C38269494_decoy,CASP3,Decoy,0,-8.95975,-6.96,-1.41,-6.583990426552565
CCCCOc1ccc([C@H]2C(C(=O)C3CC3)=C([O-])C(=O)N2c2ccc(CC(=O)[O-])cc2)cc1OC,C13277905_decoy,CASP3,Decoy,0,-7.52331,-6.03,-2.23,-5.911238047304366
CCCCOc1cc([C@@H]2C(C(=O)C3CC3)=C([O-])C(=O)N2c2ccc(CC(=O)[O-])cc2)ccc1OC,C13277956_decoy,CASP3,Decoy,0,-7.83769,-8.06,-2.66,-9.095673700051847
CCCCOc1cc([C@H]2C(C(=O)C3CC3)=C([O-])C(=O)N2c2ccc(CC(=O)[O-])cc2)ccc1OC,C13277955_decoy,CASP3,Decoy,0,-7.72699,-6.91,-3.94,-7.654810752516456
COC(=O)C1=C(C)[C@H](C(=O)OC)S[C@@H]1NC(=O)CSc1nc(C)c(CCC(=O)[O-])c([O-])n1,C39667870_decoy,CASP3,Decoy,0,-8.59594,-7.26,-1.66,-9.448265923848576
COC(=O)C1=C(C)[C@@H](C(=O)OC)S[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703844_decoy,CASP3,Decoy,0,-7.45821,-5.69,-2.72,-6.649243059870519
CCOC(=O)[C@H]1C=C(CC)S[C@@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703882_decoy,CASP3,Decoy,0,-9.38447,-5.76,-1.29,-7.032656036740687
CCOC(=O)[C@H]1C(CC)=C(C)S[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39703902_decoy,CASP3,Decoy,0,-8.50474,-7.36,-3.71,-7.728125695536839
CCOC(=O)[C@@H]1C(c2ccco2)=CS[C@H]1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C39704386_decoy,CASP3,Decoy,0,-8.40661,-6.69,-1.86,-5.903074818502873
C=CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc(OCC=C)cc3)[C@H]2c2cccnc2)nc1C,C39834460_decoy,CASP3,Decoy,0,-9.69888,-6.16,-1.3,-7.356008397177447
C=CCOc1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCO)cc1OCC,C40046527_decoy,CASP3,Decoy,0,-7.60722,-6.6,-1.64,-6.942394299879097
C=CCOc1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2CCCO)cc1OCC,C40046528_decoy,CASP3,Decoy,0,-7.66426,-7.08,-2.17,-7.025011071957683
C=CCOc1cccc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2CCOCCO)c1,C40075499_decoy,CASP3,Decoy,0,-8.20802,-6.67,-0.75,-7.834253239359696
CCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(C)c3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40085147_decoy,CASP3,Decoy,0,-7.76515,-6.49,-3.09,-7.202454059753785
COCCOc1ccc(-c2nnc(CCC(=O)NC[C@@H]3CCCO3)c([O-])n2)cc1OC,C40426167_decoy,CASP3,Decoy,0,-7.20811,-7.4,-1.21,-6.265180580273158
C=C1CC[C@H]2[C@](C)(CC[C@@H](OC(=O)CCC(=O)[O-])[C@@]2(C)COC(=O)CCC(=O)[O-])[C@@H]1/C=C/C1=CCOC1=O,C43742899_decoy,CASP3,Decoy,0,-8.45173,-7.96,-2.35,-9.556423690208904
O=C(NCCCOCC1CC1)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1,C45592309_decoy,CASP3,Decoy,0,-6.75161,-6.19,-1.47,-5.719336416431437
COC(=O)c1sc(NC(=O)CSc2nc(C)c(CCC(=O)[O-])c([O-])n2)c(C(=O)OC)c1C,C13448044_decoy,CASP3,Decoy,0,-8.1412,-8.07,-2.41,-10.356429665193096
CCOC(=O)c1cc(C(C)C)sc1NC(=O)CSc1nnc(CCC(=O)[O-])c([O-])n1,C13093082_decoy,CASP3,Decoy,0,-8.79304,-7.37,-2.36,-7.498895012404833
COC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3ccc(OC)cc3)n2CCC(=O)[O-])c1C,C13178594_decoy,CASP3,Decoy,0,-8.95555,-7.64,-3.61,-8.31426722838172
CCOC(=O)C(=NNc1ccc(S(=O)(=O)[N-]c2nc(C)cc(C)n2)cc1)C(=O)OCC,C59449570_decoy,CASP3,Decoy,0,-7.90247,-7.28,-1.05,-8.849357481746601
CC(=O)OC[C@@H]1O[C@H](SCc2cc(C(=O)[O-])oc2C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C59499383_decoy,CASP3,Decoy,0,-8.21214,-7.54,-3.78,-7.702019609752291
CC(C)OP(=O)(OCCOCCOP(=O)(OC(C)C)OC(C)C)OC(C)C,C04705705_decoy,CASP3,Decoy,0,-5.51217,-4.93,-4.48,-6.25419927220054
CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)N(CC)Cc2ccc(OC)c(OC)c2)c1C,C09336765_decoy,CASP3,Decoy,0,-8.43055,-6.33,-2.59,-8.27733247145124
CC(=O)OC[C@@]1(C)O[C@@H](OC(C)=O)[C@@](C)(OC(C)=O)[C@](C)(OC(C)=O)[C@]1(C)OC(C)=O,C09915865_decoy,CASP3,Decoy,0,-5.64907,-5.65,-1.44,-6.1569449689918585
CN(c1ccc(OCC(=O)OCC(=O)NCc2ccco2)cc1)S(=O)(=O)c1cccs1,C10382643_decoy,CASP3,Decoy,0,-8.82452,-6.25,-2.24,-7.140480705436621
COc1ccc(C(=O)NCC(=O)OCC(=O)c2cc(C)n(C[C@@H]3CCCO3)c2C)cc1OC,C10594747_decoy,CASP3,Decoy,0,-6.59282,-7.42,-0.94,-5.611781191670328
CC(=O)OC[C@@H]1O[C@@H](Sc2ncc3cnccn23)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C05013168_decoy,CASP3,Decoy,0,-6.69066,-6.71,-1.99,-6.341936623409985
COCCCn1cc(C(=O)c2cc(F)ccc2OCC(=O)NCCOC)cc(C#N)c1=O,C14019382_decoy,CASP3,Decoy,0,-7.72496,-6.67,-4.44,-6.533467678762211
CCOC(=O)CCCNC(=O)COC(=O)c1cc(-c2ccccc2)nc2c1cnn2CC,C14362755_decoy,CASP3,Decoy,0,-8.66831,-7.36,-2.48,-7.286902411254101
CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16032569_decoy,CASP3,Decoy,0,-6.82686,-6.48,-3.3,-6.5532522070612025
CC(=O)OC[C@H]1O[C@@H](SC2=NC(=O)CS2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C16958823_decoy,CASP3,Decoy,0,-7.73995,-6.65,-1.43,-7.944659055495959
COCCOC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCCOC)[C@@H]1c1ccc(N(C)C)cc1,C20428516_decoy,CASP3,Decoy,0,-8.05918,-5.21,-1.89,-7.5075004553685245
CC(=O)O[C@@H]1[C@H]2OC(C)(C)OC[C@H]2O[C@H]1COP(=O)(OCCC#N)OCCC#N,C22047103_decoy,CASP3,Decoy,0,-6.14021,-6.58,-2.47,-6.429940828338744
CC(=O)OC[C@@H]1O[C@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22065126_decoy,CASP3,Decoy,0,-5.7115,-6.19,-1.38,-6.326637283416827
CC(=O)OC[C@H]1O[C@H](Sc2ccccc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22065853_decoy,CASP3,Decoy,0,-7.45148,-6.98,-4.4,-7.366615349140468
COC(=O)Cc1c(C(=O)OC)sc(NC(=O)CSc2ncnc3ccsc23)c1C(=O)OC,C24713377_decoy,CASP3,Decoy,0,-8.60589,-6.43,-1.21,-8.33168524009115
CCn1c(SC[C@@H](O)COCc2ccc(OC)c(OC)c2)nnc1N1CCOCC1,C24832018_decoy,CASP3,Decoy,0,-8.78567,-5.68,-1.99,-6.364175512302879
CCn1c(SC[C@H](O)COCc2ccc(OC)c(OC)c2)nnc1N1CCOCC1,C24832021_decoy,CASP3,Decoy,0,-8.57355,-6.84,-2.34,-7.373427275416564
CCOC(CNC(=O)c1sc2ncn(CC(=O)N(CC)CC)c(=O)c2c1C)OCC,C27534447_decoy,CASP3,Decoy,0,-7.96053,-6.2,-2.24,-6.336199781073904
C=CCn1c(SCC(=O)NCc2cc(OC)c(OC)c(OC)c2)nnc1-c1ccco1,C29550075_decoy,CASP3,Decoy,0,-7.35432,-5.92,-3.47,-5.7972320261600485
CCCCOC(=O)CN1C(=O)S/C(=C\c2ccc(SCCO)c([N+](=O)[O-])c2)C1=O,C32124682_decoy,CASP3,Decoy,0,-6.56566,-6.38,-1.91,-5.6891683990340765
CC[C@H](C)N(CC(=O)N(CCOC)Cc1cccn1C)C(=O)c1cccc([N+](=O)[O-])c1,C33375822_decoy,CASP3,Decoy,0,-6.29983,-5.66,-5.19,-6.316549159734645
COCCCN(CC(=O)N(CCOC)Cc1cccn1C)C(=O)Nc1ccc(C#N)cc1,C33725071_decoy,CASP3,Decoy,0,-7.72787,-4.87,-1.18,-7.06193887392752
O=C(c1cccc(F)c1)N(CCN1CCOCC1)C[C@@H]1CN(C[C@H](O)COCc2ccco2)CCO1,C34691647_decoy,CASP3,Decoy,0,-10.348,-7.85,-4.04,-8.278890059951486
COCCCN(CC(=O)N(CCOC)Cc1cccn1C)C(=O)c1ccc2c(c1)OCO2,C34856533_decoy,CASP3,Decoy,0,-7.21043,-6.23,-2.56,-6.922710764330129
CCOCCCNC(=O)c1coc(CN(CCCOCC)C(=O)c2ccc(OC)cc2)n1,C35328526_decoy,CASP3,Decoy,0,-8.3851,-5.52,-2.79,-6.910666299567005
CC[C@@H](C)N(CC(=O)N(Cc1ccco1)C[C@@H]1CCCO1)C(=O)c1cc(OC)c(OC)c(OC)c1,C35394076_decoy,CASP3,Decoy,0,-7.70494,-5.96,-1.93,-8.36835441957681
COc1cc([C@@H]2C(C(=O)c3sc(C)nc3C)=C([O-])C(=O)N2CCCn2cc[nH+]c2)ccc1OCC(C)C,C35567879_decoy,CASP3,Decoy,0,-8.22429,-6.48,-3.34,-7.408433769903307
CCOC(=O)C(=O)c1cn([C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c2ccccc12,C08683200_decoy,CASP3,Decoy,0,-6.89315,-6.45,-1.0,-6.564921000084282
CCOc1ccc(CCNC(=O)c2cnc3sc(N(CC)CC)nn3c2=O)cc1OCC,C08604179_decoy,CASP3,Decoy,0,-8.73082,-5.94,-3.28,-6.292342110980878
CCOC(=O)C1=C(C(=O)COC(=O)CNC(=O)c2ccc(OCC)cc2)C(C)=N[C@H]1C,C39991114_decoy,CASP3,Decoy,0,-7.82217,-6.9,-1.35,-8.299774925099197
COCCN(CCOC)c1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-],C40611144_decoy,CASP3,Decoy,0,-7.67567,-6.21,-2.48,-6.217266253239553
CC(=O)O[C@H]1[C@@H]2OC(C)(C)OC[C@@H]2O[C@@H]1COP(=O)(OCCC#N)OCCC#N,C44154876_decoy,CASP3,Decoy,0,-5.90216,-7.41,-2.54,-6.486415191390988
CC(=O)OC[C@H]1O[C@@H](Sc2ccccc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O,C44171905_decoy,CASP3,Decoy,0,-5.72098,-6.03,-2.25,-5.481299120560898
CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(C)cc(=O)oc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C44699739_decoy,CASP3,Decoy,0,-6.03435,-7.38,-2.14,-6.235458574811643
COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2ccc(OC)c(OC)c2)cc1OC,C45620143_decoy,CASP3,Decoy,0,-5.66467,-6.16,-1.66,-5.927912111903065
CCCCOc1ccc(C(=O)N2CCN(c3nnc(SCC(=O)NCCOC)s3)CC2)cc1,C49370093_decoy,CASP3,Decoy,0,-9.64595,-6.37,-1.91,-6.900769959148537
CCN(CC)C(=O)Cn1cc(C(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21,C56923775_decoy,CASP3,Decoy,0,-8.73823,-7.01,-3.67,-6.759544546408882
CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)O[C@@H](C)C2)sc(C(=O)OCCOC)c1C,C16443401_decoy,CASP3,Decoy,0,-8.65009,-5.48,-1.16,-7.040553299654008
CCOC(=O)c1ccc(N2CCN(C(=O)c3cc(OCC)c(OCC)c(OCC)c3)CC2)nc1,C30437752_decoy,CASP3,Decoy,0,-8.87602,-6.56,-1.53,-6.841711873784958
CCOc1ccc(OCCNC(=O)COC(=O)c2csc(-c3cnn(C)c3)n2)cc1,C59419923_decoy,CASP3,Decoy,0,-7.58126,-6.68,-1.8,-6.294484126682593
CCOC(Cn1cc(C(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)nn1)OCC,C60295606_decoy,CASP3,Decoy,0,-7.6068,-6.87,-2.77,-6.230873725468001
COC(=O)CN(CC(=O)OC)CC1=[N+]([O-])[C@@H]2CCCC[C@H]2[N+]([O-])=C1CN(CC(=O)OC)CC(=O)OC,C13757197_decoy,CASP3,Decoy,0,-7.95768,-5.87,-2.87,-7.031410434070078
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(CC=C)cc3OC)c(OC)c2)/C(=O)N=C2SC(CC)=NN2/1,C08952401_decoy,CASP3,Decoy,0,-9.15959,-8.11,-2.78,-7.022119081552028
CCOC(=O)C1=C(C(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)C(C)=N[C@H]1C,C39943549_decoy,CASP3,Decoy,0,-7.70168,-6.76,-2.61,-6.46493848725041
CCOC(=O)C1=C(C)C(C(=O)COC(=O)CNS(=O)(=O)c2ccc(C)cc2)=N[C@H]1C,C39943909_decoy,CASP3,Decoy,0,-7.20605,-6.54,-1.53,-6.912280644957212
CCOC(=O)C1=C(C)C(C(=O)COC(=O)CNS(=O)(=O)/C=C/c2ccccc2)=N[C@H]1C,C39948181_decoy,CASP3,Decoy,0,-7.00609,-7.28,-0.82,-5.8575381114568446
[H]/N=C1C(=C/c2ccc(OCCOc3ccc(CC=C)cc3OC)c(OCC)c2)/C(=O)N=C2SC(C)=NN2/1,C27549817_decoy,CASP3,Decoy,0,-8.98209,-7.1,-1.22,-6.658678258018483
CCOC(=O)C1=NC(C)=C(CN(C[C@H]2CCCO2)C(=O)c2cc(OC)c(OC)c(OC)c2)[C@H]1C,C63696903_decoy,CASP3,Decoy,0,-7.81906,-7.28,-0.68,-7.378146447422542
CCOC(=O)[C@@H]1N=C(C)C(CCC(=O)N2CCC[C@H](C(=O)NCCc3c(C)nn(CC)c3C)C2)=C1C,C64507854_decoy,CASP3,Decoy,0,-8.1762,-7.56,-2.33,-7.14399572690057
CCOC(=O)[C@H]1N=C(C)C(CCC(=O)N2CCC[C@@H](C(=O)NCCc3c(C)nn(CC)c3C)C2)=C1C,C64507857_decoy,CASP3,Decoy,0,-9.98129,-7.55,-1.96,-7.47784003945917
COCCOC(=O)C1C(C)=NC2=C(C(=O)C[C@H](c3ccc(Cl)cc3)C2)[C@@H]1c1cc(OC)ccc1OC,C04067674_decoy,CASP3,Decoy,0,-8.84498,-5.91,-2.32,-7.42600917740119
COc1cc(/C=N/n2cnnc2)cc(I)c1OCCOc1ccc(C(C)(C)C)cc1,C02962848_decoy,CASP3,Decoy,0,-6.98328,-5.96,-1.17,-6.509608400018999
C=CCN(c1ccc(Cl)cc1)S(=O)(=O)c1cccc(C(=O)OCC(=O)N2CCc3ccccc32)c1,C03361267_decoy,CASP3,Decoy,0,-8.52037,-7.23,-2.33,-7.302515606476772
COc1cc([C@@H]2C3=C(C[C@H](c4ccc(Cl)cc4)CC3=O)N=C(C)C2C(=O)OC(C)C)ccc1OC(C)=O,C00861485_decoy,CASP3,Decoy,0,-8.77714,-5.72,-2.28,-6.740435380191087
COc1ccc(-c2nnc3s/c(=C/c4ccc(OCc5ccc(C)cc5)c(OC)c4)c(=O)n23)cc1OC,C09189113_decoy,CASP3,Decoy,0,-9.66642,-7.27,-3.15,-6.280112816453568
N#C[C@@H](C(=O)OC1CCCCC1)c1nc2ccccc2nc1N1CCN(c2cccc(C(F)(F)F)c2)CC1,C08980304_decoy,CASP3,Decoy,0,-8.19003,-6.87,-0.68,-6.524929439205539
CCc1cccc2sc(N(C[C@@H]3CCCO3)C(=O)[C@H]3CCCN(S(=O)(=O)c4cccs4)C3)nc12,C10764440_decoy,CASP3,Decoy,0,-9.71335,-6.79,-1.9,-7.291312463229128
CCCCN(CC)S(=O)(=O)c1ccc(C(=O)N(C[C@@H]2CCCO2)c2nc3c(C)cccc3s2)cc1,C10888499_decoy,CASP3,Decoy,0,-9.94507,-6.46,-2.19,-7.202514444466436
COc1ccc(/C=C2\CCC[C@@H]3C2=NN(C(=O)c2ccccc2)[C@H]3c2ccc(OC)c(OC)c2)cc1OC,C13301276_decoy,CASP3,Decoy,0,-8.83038,-5.8,-2.03,-7.355485348235307
COC(=O)c1ccc([C@@H]2C3=C(C[C@H](c4ccc(OC)c(OC)c4)CC3=O)N=C(C)C2C(=O)OC(C)C)cc1,C06015475_decoy,CASP3,Decoy,0,-8.311,-7.87,-2.62,-7.092297305492179
COCCn1c(SCn2nnc3ccccc3c2=O)nc2scc(-c3ccccc3Cl)c2c1=O,C14083977_decoy,CASP3,Decoy,0,-8.49236,-7.83,-1.73,-6.92094294644333
CCOC(=O)[C@H]1C(=O)C2=C(C[C@H]1c1cccs1)N(c1ccccc1)C(=O)C[C@@H]2c1cccc([N+](=O)[O-])c1,C14944122_decoy,CASP3,Decoy,0,-7.53527,-6.57,-2.89,-6.402388370617799
Cc1nc2ccccc2nc1-c1nnc(CCCCc2nnc(-c3nc4ccccc4nc3C)s2)s1,C16265666_decoy,CASP3,Decoy,0,-9.64227,-6.79,-3.34,-7.939194965574495
CC[C@H](C)N(CC(=O)N1CCc2sccc2[C@@H]1c1ccc(C)cc1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C16501231_decoy,CASP3,Decoy,0,-9.66856,-5.92,-1.99,-8.802424756906236
CCCCCOc1ccc([C@@H]2c3c(oc4ccccc4c3=O)C(=O)N2c2nnc(C(C)C)s2)cc1OC,C03643780_decoy,CASP3,Decoy,0,-6.49777,-6.85,-3.65,-6.353134368095578
CCOC(=O)[C@H]1CCCN(c2nc(-c3cccs3)ccc2C(=O)N2CCN(c3ccc(C)cc3)CC2)C1,C19112388_decoy,CASP3,Decoy,0,-8.41289,-5.72,-2.41,-6.96098181853771
CCOc1ccc(OCc2nnc(SCC(=O)N3[C@@H](C)CCC[C@@H]3C)n2-c2ccc(Cl)cc2)cc1,C03309387_decoy,CASP3,Decoy,0,-7.14571,-7.16,-2.13,-5.750500582740337
CCOC(=O)c1sc2c(c1C)c(=O)n(-c1ccc(Cl)cc1)c(=O)n2CC(=O)c1ccc(Cl)cc1,C27531328_decoy,CASP3,Decoy,0,-8.74788,-6.22,-3.84,-6.894065224304784
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cn(C)c4ccccc34)c(=O)n2[C@@H]1c1ccc(OC)c(OC)c1,C32189097_decoy,CASP3,Decoy,0,-8.30244,-7.64,-4.72,-7.035817780193997
COCCN(CC(=O)N1CCn2cccc2[C@H]1c1ccc(C(C)C)cc1)C(=O)COc1ccc(Cl)cc1,C33491258_decoy,CASP3,Decoy,0,-7.77482,-6.77,-1.62,-6.662266253579571
COc1ccccc1N1CCN(C(=O)CSc2nnc(-c3ccc(C)cc3)n2-c2ccc(C)cc2)CC1,C35128760_decoy,CASP3,Decoy,0,-7.35089,-7.01,-1.63,-5.672381599742987
CCOC(=O)[C@H]1CCCN(C(=O)CCCSc2nnc(Cc3ccccc3)n2-c2cccc(Cl)c2)C1,C35139129_decoy,CASP3,Decoy,0,-9.01267,-7.16,-1.7,-7.372280027741024
CCCCCC(=O)N1CCN(C(=O)CSc2nnc(-c3ccco3)n2-c2cccc(Cl)c2)C[C@H]1C,C35141193_decoy,CASP3,Decoy,0,-8.60147,-5.85,-3.58,-6.783912436349249
C[C@@H]1CN(C(=O)CCCSc2nnc(-c3ccccc3)n2-c2ccccc2)CCN1C(=O)C1CCCCC1,C35174996_decoy,CASP3,Decoy,0,-7.80831,-7.84,-2.4,-6.535124758326795
CCCCN(CC(=O)N(Cc1cccn1Cc1ccccc1)C1CCCCC1)C(=O)c1ccc2c(c1)OCO2,C35349550_decoy,CASP3,Decoy,0,-9.15162,-8.8,-2.12,-8.513559251310049
CCOc1cc([C@@H]2c3c(oc4ccc(C)cc4c3=O)C(=O)N2CCCOC)ccc1OCc1ccccc1,C35487570_decoy,CASP3,Decoy,0,-9.32773,-6.03,-4.35,-6.5426495728571465
CC(C)(C)c1ccc2c(c1)N(Cc1ccc(C(=O)N3CCN(C/C=C/c4ccccc4)CC3)o1)C(=O)CO2,C35829627_decoy,CASP3,Decoy,0,-8.78502,-8.68,-1.26,-8.597651108993656
COC(=O)c1cccc(COc2cccn3c(=O)c(-c4cc(C)n(-c5ccccc5Cl)n4)c(C)nc23)c1,C35924588_decoy,CASP3,Decoy,0,-8.38052,-8.74,-3.32,-7.8777244951949825
CCc1nn(-c2ccc(OC)cc2)c(Oc2ccc(F)cc2F)c1CN(C[C@@H]1CCCO1)C(=O)C1CCC1,C35972410_decoy,CASP3,Decoy,0,-9.44734,-6.32,-3.22,-6.629470177031273
CCN(CC)C(=O)c1coc(COc2ccc3c(c2)[C@H](c2cccc(C)c2)N(C(=O)C2CCCC2)CC3)n1,C37606907_decoy,CASP3,Decoy,0,-8.344,-6.98,-1.47,-9.09720514427574
CCc1cc2c(cc1CC)[C@@H](Cc1cc(OC)c(OC)c(OC)c1)N(C(=O)c1cccc([N+](=O)[O-])c1)CC2,C39289603_decoy,CASP3,Decoy,0,-8.0031,-7.58,-4.52,-7.598265691349205
CCCCCCOc1ccc([C@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2cc(C)ccn2)cc1OC,C39840822_decoy,CASP3,Decoy,0,-7.26075,-6.66,-5.44,-5.195080737673324
CCCC[C@@H](CC)CN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CCCC)c2N2CCOCC2)SC1=S,C39990295_decoy,CASP3,Decoy,0,-9.94506,-6.33,-2.07,-8.256671227493412
CCCCCCOc1ccc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C(C)C)s2)cc1,C40014499_decoy,CASP3,Decoy,0,-8.15543,-7.73,-3.65,-6.944626931211102
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc4c(c3)C[C@@H](C)O4)c(=O)n2[C@H]1c1cccc(OC(C)=O)c1,C40016503_decoy,CASP3,Decoy,0,-8.64977,-8.71,-3.11,-8.474056037664264
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc4c(c3)C[C@H](C)O4)c(=O)n2[C@@H]1c1ccc(OC)c(OC)c1,C40016664_decoy,CASP3,Decoy,0,-7.95092,-6.04,-1.49,-5.77437923040869
COCCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc4c(c3)C[C@H](C)O4)c(=O)n2[C@H]1c1ccc(OC)cc1,C40016793_decoy,CASP3,Decoy,0,-8.2895,-6.72,-1.88,-6.145126746263175
CCOc1ccc([C@@H]2c3c(oc4cc(C)cc(C)c4c3=O)C(=O)N2c2nnc(CC(C)C)s2)cc1OC,C40057840_decoy,CASP3,Decoy,0,-8.45017,-6.86,-3.36,-6.4409452524933535
CCCCCOc1ccc([C@H]2c3c(oc4c(C)c(C)ccc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C40063723_decoy,CASP3,Decoy,0,-7.24017,-6.36,-4.81,-5.464728097345034
CCCCOc1ccc([C@H]2c3c(oc4c(C)c(C)ccc4c3=O)C(=O)N2c2nnc(CC)s2)cc1OC,C40064741_decoy,CASP3,Decoy,0,-7.80933,-7.26,-1.99,-6.438132435040255
CCCCOc1ccc(/C=N/N=C2\S[C@@H](Cc3ccccc3Cl)C(=O)N2Cc2ccco2)cc1OC,C40147863_decoy,CASP3,Decoy,0,-9.36784,-6.57,-1.62,-8.224341105191641
COc1ccc(OC)c(N2C[C@H](c3nc4ccccc4n3CCCCOc3cccc(C)c3C)CC2=O)c1,C40253648_decoy,CASP3,Decoy,0,-8.44467,-7.62,-1.95,-7.697617274713173
CCOC(=O)c1cnc(N2CCCC2)nc1CSc1nnc(-c2ccc(Br)cc2)n1CC,C41661234_decoy,CASP3,Decoy,0,-9.4111,-7.46,-3.33,-7.9352121029534946
C=CCn1c(COc2ccc(Cl)cc2)nnc1Sc1nc(-c2cccs2)nc2c(C)nn(C)c12,C41684163_decoy,CASP3,Decoy,0,-10.8286,-6.7,-2.29,-8.195192143570209
Cc1cc(C(=O)COC(=O)c2ccccc2Sc2ccccc2C#N)c(C)n1-c1ccc2c(c1)OCO2,C02634638_decoy,CASP3,Decoy,0,-8.6994,-7.06,-2.06,-6.694381927124969
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc(C)n(C[C@@H]4CCCO4)c3C)c(=O)n2[C@H]1c1cccs1,C59109290_decoy,CASP3,Decoy,0,-9.52042,-5.98,-0.64,-8.073801607623448
CCCCc1ccc(N2C(=O)/C(=C\c3ccc(-c4ccc(C(=O)OCC)cc4)o3)C(=O)N(C)C2=S)cc1,C59594426_decoy,CASP3,Decoy,0,-8.58952,-7.21,-2.05,-6.338516937853884
CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](ON(c4ccc(Cl)cc4)[C@@H]3c3ccc(N(C)C)cc3)C2=O)cc1,C06144458_decoy,CASP3,Decoy,0,-8.36241,-5.13,-0.35,-5.542661441979157
CCOc1cc(C2=NC(=O)C3=C4CCCC[C@H]4SC3=N2)ccc1OCCOCCOc1ccccc1C,C63411551_decoy,CASP3,Decoy,0,-10.3312,-7.37,-2.5,-9.367051909948234
CCOC(=O)C1=NC(C)=C(CN(Cc2ccc(Cl)cc2)S(=O)(=O)c2cccc3nsnc23)[C@H]1C,C64976393_decoy,CASP3,Decoy,0,-8.92447,-6.83,-5.01,-6.622993834108915
O=C(Cn1cnnn1)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nncs3)CS[C@@H]12,C03830475_decoy,CASP3,Decoy,0,-7.907,-5.46,-1.72,-5.581220002023757
O=C([O-])CSCC(=O)N[C@H]1CCN2C(=O)[C@@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@H]2C1,C03839811_decoy,CASP3,Decoy,0,-7.27189,-6.99,-3.28,-5.579311944254763
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(COC(C)=O)CS[C@@H]12)c1csc(N)n1,C03830438_decoy,CASP3,Decoy,0,-8.21402,-5.73,-2.08,-6.9875519373377175
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)Cn3cc(Br)c(C)n3)[C@H]2SC1,C09431532_decoy,CASP3,Decoy,0,-8.38228,-5.76,-1.54,-5.767115810570944
CCn1nccc1C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnc(C)s3)CS[C@@H]12,C02730711_decoy,CASP3,Decoy,0,-8.7964,-7.53,-1.48,-8.816780972053884
O=C(Cn1cnnn1)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3nnc(O)s3)CS[C@H]12,C10494670_decoy,CASP3,Decoy,0,-9.59462,-8.39,-1.64,-9.721339717377106
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)c3nn(C)c(C)c3[N+](=O)[O-])[C@H]2SC1,C13640381_decoy,CASP3,Decoy,0,-6.8311,-7.4,-1.35,-5.74752157087819
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)c4c(C)nn(C)c4C)[C@@H]3SC2)s1,C02782829_decoy,CASP3,Decoy,0,-8.66361,-6.64,-1.75,-7.231448111786433
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)c4cnn(C)c4)[C@@H]3SC2)s1,C02784103_decoy,CASP3,Decoy,0,-8.46461,-5.69,-2.63,-6.486539896436529
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)c4cnn(C)c4)[C@H]3SC2)s1,C02784104_decoy,CASP3,Decoy,0,-9.3945,-5.71,-0.44,-6.5710862918939
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@@H](NC(=O)c4cnn(C)c4)[C@@H]3SC2)s1,C02784105_decoy,CASP3,Decoy,0,-7.63383,-5.9,-3.15,-5.724083502068137
O=C(CSC1=NN=C(c2ccccc2)C1)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CO)CS[C@H]12,C15223829_decoy,CASP3,Decoy,0,-7.85927,-7.67,-1.57,-6.877558724250694
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,C16029727_decoy,CASP3,Decoy,0,-9.4862,-5.91,-1.17,-7.86462710831416
O=C([O-])[C@H](Cc1c[nH]cn1)NC(=O)[C@H]1OC2(CCCCC2)O[C@H]1[C@@H](O)[C@@H]1COC2(CCCCC2)O1,C16383494_decoy,CASP3,Decoy,0,-8.40907,-7.82,-1.28,-6.845165189483189
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)c3c(C)nn(C(F)F)c3C)[C@H]2SC1,C19640124_decoy,CASP3,Decoy,0,-8.19642,-6.06,-1.44,-6.208586552752036
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(N3C(=O)C[C@@H](SC[C@H]([NH3+])C(=O)[O-])C3=O)cc2)n1,C16900782_decoy,CASP3,Decoy,0,-8.03671,-7.53,-1.76,-7.03712628674464
COc1cc(-c2n[nH]c3c2[C@@]2(C(=O)N(CC(=O)[O-])c4ccccc42)C(C#N)=C(N)O3)cc(OC)c1OC,C08925928_decoy,CASP3,Decoy,0,-6.82256,-7.8,-2.35,-7.540295521906385
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)c3c(Br)c(C)nn3C)[C@@H]2SC1,C20602282_decoy,CASP3,Decoy,0,-8.49355,-6.47,-2.1,-6.23872429577074
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCn3nc([N+](=O)[O-])cc3C)[C@@H]2SC1,C20613999_decoy,CASP3,Decoy,0,-7.14745,-7.52,-1.32,-11.810171518774938
NS(=O)(=O)c1ccc(S(=O)(=O)[N-]c2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1,C27025426_decoy,CASP3,Decoy,0,-8.32664,-6.13,-0.87,-7.5533692072013245
O=C(Cc1ccc(O)c(O)c1)OCC1=C(C(=O)[O-])N2C(=O)/C(=C/c3ccccn3)[C@H]2S(=O)(=O)C1,C27988463_decoy,CASP3,Decoy,0,-8.34177,-8.32,-1.64,-8.312849464053482
CC(C)(O[C@@H]1O[C@@H](COC(=O)CC(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1,C31160240_decoy,CASP3,Decoy,0,-6.80601,-7.97,-1.67,-6.380954416252721
CC(C)(O[C@H]1O[C@H](COC(=O)CC(=O)[O-])[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1,C31160251_decoy,CASP3,Decoy,0,-7.25494,-8.74,-0.17,-8.816871975474799
COC(=O)c1c(C)oc(C)c1S(=O)(=O)[N-]c1c(C)cccc1C(=O)N1CCC(O)CC1,C32926270_decoy,CASP3,Decoy,0,-7.61609,-6.64,-3.09,-7.393018328093907
O=C([O-])C[C@]1(C(=O)[O-])[NH2+][C@@H](c2cccc(C(F)(F)F)c2)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21,C33736117_decoy,CASP3,Decoy,0,-6.04627,-8.31,-2.62,-6.469879657653725
Cc1ccccc1N1C(=O)[C@H]2[C@@H](c3ccc(N(C)C)cc3)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C1=O,C34255568_decoy,CASP3,Decoy,0,-7.48955,-5.77,-1.88,-6.454243220542876
CC(=O)Oc1ccc([C@@H]2[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)C(=O)[C@H]32)cc1,C34255659_decoy,CASP3,Decoy,0,-7.92263,-5.99,-3.25,-6.003674206145985
COc1cc([C@@H]2[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C(=O)N(c4ccc(C)c(Cl)c4)C(=O)[C@H]32)ccc1O,C34377972_decoy,CASP3,Decoy,0,-8.54089,-7.85,-1.15,-7.168089569017335
COC(=O)c1ccc([C@H]2N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]3C(=O)NC(=O)[C@@H]23)cc1,C34849082_decoy,CASP3,Decoy,0,-6.34445,-7.4,-2.41,-5.852490466380952
C[C@]12CC/C(=N/OCC(=O)N3CCC[C@H]3C(=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,C35361943_decoy,CASP3,Decoy,0,-8.64875,-8.03,-0.93,-6.445091772973595
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)[C@@H](C)n3ncc(Cl)c3C)[C@H]2SC1,C35678697_decoy,CASP3,Decoy,0,-8.50342,-5.98,-1.57,-6.107115356285953
CN(C)C(=O)CN1CC[NH+]([C@H](C(=O)[O-])c2cn(CC(=O)[O-])c3cc(Br)ccc23)CC1,C36364879_decoy,CASP3,Decoy,0,-7.03135,-6.13,-1.79,-6.349503927233823
Cc1nnc(SCC2=C(C(=O)[O-])N3C(=O)[C@H](NC(=O)Cn4ncc(Cl)c4C)[C@@H]3SC2)s1,C02732740_decoy,CASP3,Decoy,0,-7.74403,-7.24,-1.79,-6.471204665045762
CO/N=C(\C(=O)N[C@H]1C(=O)N2C(C(=O)[O-])=C(CSc3cnns3)CS[C@H]12)c1csc(N)n1,C34001975_decoy,CASP3,Decoy,0,-12.113,-5.61,-1.14,-8.021488529313324
NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(c2ccc(C(=O)NCC(=O)[O-])cc2[N+](=O)[O-])CC1,C13461532_decoy,CASP3,Decoy,0,-7.13194,-6.9,-0.96,-5.63378283854767
O=C(NCC(=O)N(C1CC1)[C@H]1CCS(=O)(=O)C1)N[C@@H](CC(=O)N1CCOCC1)C(=O)[O-],C13244197_decoy,CASP3,Decoy,0,-8.44554,-7.07,-1.58,-7.7684925778722755
O=C(NCC(=O)N(C1CC1)[C@H]1CCS(=O)(=O)C1)N[C@H](CC(=O)N1CCOCC1)C(=O)[O-],C13244195_decoy,CASP3,Decoy,0,-7.95209,-7.76,-0.69,-7.079524241092283
CN1CCN(C(=O)CN2CC[NH+]([C@H](C(=O)[O-])c3c(C(=O)[O-])n(C)c4ccccc34)CC2)CC1,C40288218_decoy,CASP3,Decoy,0,-6.90002,-7.45,-2.54,-6.053579126612847
CN1CCN(C(=O)CN2CC[NH+]([C@@H](C(=O)[O-])c3c(C(=O)[O-])n(C)c4ccccc34)CC2)CC1,C40288219_decoy,CASP3,Decoy,0,-7.54965,-7.71,-1.33,-6.072136398925566
N#Cc1ccccc1[C@@H]1N[C@](Cc2ccc([N+](=O)[O-])cc2)(C(=O)[O-])[C@@H]2C(=O)N(CCO)C(=O)[C@H]21,C33893263_decoy,CASP3,Decoy,0,-5.88509,-5.35,-1.37,-5.08496509013988
CC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](c4cccc(C(F)(F)F)c4)[NH2+][C@@](CC(=O)[O-])(C(=O)[O-])[C@@H]3C2=O)cc1,C43210613_decoy,CASP3,Decoy,0,-8.51675,-6.14,-1.44,-7.436759630722062
C#CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1ccccc1C#N,C33518010_decoy,CASP3,Decoy,0,-5.53609,-5.6,-3.4,-4.697231353805452
Cc1ccccc1[C@H]1[NH2+][C@](CC(=O)[O-])(C(=O)[O-])[C@@H]2C(=O)N(CCc3ccccn3)C(=O)[C@@H]12,C43218408_decoy,CASP3,Decoy,0,-6.13555,-5.81,-2.17,-5.471557395615914
CC(=O)Oc1ccc([C@H]2N[C@](Cc3c[nH]c4ccccc34)(C(=O)[O-])[C@@H]3C(=O)NC(=O)[C@@H]23)cc1,C43218729_decoy,CASP3,Decoy,0,-6.53271,-7.18,-1.84,-6.044018292812651
CC(=O)Oc1ccc([C@@H]2N[C@](Cc3ccc([N+](=O)[O-])cc3)(C(=O)[O-])[C@@H]3C(=O)NC(=O)[C@H]32)cc1,C33869035_decoy,CASP3,Decoy,0,-7.22888,-7.98,-2.77,-8.477851353136732
CC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](c4ccccn4)N[C@@](Cc4ccc([N+](=O)[O-])cc4)(C(=O)[O-])[C@@H]3C2=O)cc1,C33870622_decoy,CASP3,Decoy,0,-6.38806,-9.1,-1.88,-6.732436147560163
C[C@@]12CC/C(=N/OCC(=O)N3CCC[C@H]3C(=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,C43741756_decoy,CASP3,Decoy,0,-10.2075,-8.95,-0.87,-8.387712824652246
C[C@H](CS)C(=O)N1C[C@@H](Sc2ccccc2)C[C@H]1C(=O)O[C@H]1O[C@@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]1O,C44136672_decoy,CASP3,Decoy,0,-7.65854,-5.76,-1.16,-6.372383711981359
C[C@H](CS)C(=O)N1C[C@@H](Sc2ccccc2)C[C@H]1C(=O)O[C@H]1O[C@H](C(=O)[O-])[C@H](O)[C@@H](O)[C@@H]1O,C44136675_decoy,CASP3,Decoy,0,-7.01622,-6.29,-1.33,-6.318602089378564
NS(=O)(=O)c1ccc(CN(C(=O)/C=C/C(=O)[O-])[C@@H]2CC(=O)N(c3cccc(Cl)c3)C2=O)cc1,C59489299_decoy,CASP3,Decoy,0,-9.13594,-6.75,-3.16,-7.851136741526167
CCOC(=O)Cc1csc(NC(=O)CSc2nnnn2-c2ccc(OC)c(OC)c2)n1,C06547385_decoy,CASP3,Decoy,0,-8.93949,-6.66,-1.79,-6.871665583050361
CCOC(=O)C[C@H](NC(=O)Cn1nnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(OC)cc1,C08590703_decoy,CASP3,Decoy,0,-6.41774,-6.38,-1.23,-5.185049621682663
CCOCCCN1C(=O)/C(=C/c2c(NCCOCCO)nc3c(C)cccn3c2=O)SC1=S,C08767593_decoy,CASP3,Decoy,0,-9.57957,-5.48,-2.85,-6.86285305153285
COCCCN1C(=O)/C(=C/c2c(NCCOCCO)nc3ccc(C)cn3c2=O)SC1=S,C08858363_decoy,CASP3,Decoy,0,-9.34319,-5.83,-4.04,-8.308246365136151
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCCCn2ccnc2)S(=O)(=O)c2ccc(Cl)cc2)cc1,C09006207_decoy,CASP3,Decoy,0,-8.63021,-6.88,-1.78,-7.08016829781299
CC(C)c1ccc(S(=O)(=O)[C@H](CNC(=O)C(=O)NCCCn2ccnc2)c2ccco2)cc1,C09006216_decoy,CASP3,Decoy,0,-8.81156,-7.37,-1.92,-6.976499241339761
COc1cc(/C=C/C(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)ccc1OC(F)F,C09247019_decoy,CASP3,Decoy,0,-7.24613,-6.63,-1.5,-5.703408267129855
O=C(CCCn1c(SCC(=O)NCc2ccco2)nc2ccccc2c1=O)NC[C@H]1CCCO1,C09473025_decoy,CASP3,Decoy,0,-8.64582,-6.65,-2.67,-5.8699501629503406
COCCOc1ccc(C(F)(F)F)cc1NC(=O)COC(=O)c1ccc(-n2cnnn2)cc1,C03328689_decoy,CASP3,Decoy,0,-6.83495,-6.0,-3.07,-5.266505646970177
COc1ccc(C(=O)NN2C[C@H](C(=O)O[C@H](CCCl)C(=O)c3ccc(F)cc3)CC2=O)cc1OC,C09591423_decoy,CASP3,Decoy,0,-9.10052,-7.02,-1.49,-6.860335794814258
CCCCn1c(CNC(=O)c2ccc(OC)cc2)nnc1SCC(=O)Nc1nnc(C)s1,C09611028_decoy,CASP3,Decoy,0,-9.52841,-8.22,-1.81,-11.192979995534362
CC[C@@H](C)OC(=O)C[C@H]1C(=O)NCCN1C(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1,C09783403_decoy,CASP3,Decoy,0,-7.8279,-6.57,-1.82,-6.874337970211998
CCCc1cc(CN(C)C(=O)C[C@]2(c3ccccc3OC)CC(=O)N(CCCOC)C2=O)n[nH]1,C12240895_decoy,CASP3,Decoy,0,-8.07207,-6.38,-2.04,-7.009797272943485
Cc1c(CCOC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)sc[n+]1CCCCS(=O)(=O)[O-],C03167430_decoy,CASP3,Decoy,0,-7.62987,-6.44,-1.31,-8.642722996080298
Cc1ccc(/C=C/S(=O)(=O)NCC(=O)OCC(=O)N[C@H](c2ccccc2)c2nccn2C)cc1,C12886622_decoy,CASP3,Decoy,0,-7.06886,-7.46,-2.11,-5.832145624004405
COc1ccc([C@H](CC(=O)OC(C)C)NC(=O)CCc2c(C)nc3nc(SC)nn3c2C)cc1,C14394808_decoy,CASP3,Decoy,0,-8.5683,-6.93,-1.46,-6.808743163777691
Cc1ccc(/C=C/S(=O)(=O)NCC(=O)OCC(=O)NCCc2ccc3c(c2)OCCO3)cc1,C14789818_decoy,CASP3,Decoy,0,-7.90617,-7.04,-2.94,-5.593720494009396
CC(=O)Oc1cc(OC(C)=O)c2c(c1)O[C@@H](c1ccc(OC(C)=O)c(OC(C)=O)c1)[C@@H](OC(C)=O)C2=O,C15019951_decoy,CASP3,Decoy,0,-8.96818,-6.3,-2.03,-7.2015313329793145
CCCN(Cc1cccn1Cc1ccc(C(=O)N2CCN(C(=O)OCC)CC2)o1)C(=O)COC,C16534037_decoy,CASP3,Decoy,0,-8.19872,-6.51,-3.17,-6.3003634147526855
CCOc1ccc(C2=N/C(=C\c3cc(OC)c(OCC(N)=O)c(OC)c3)C(=O)O2)cc1OCC,C18919582_decoy,CASP3,Decoy,0,-10.9771,-6.62,-2.72,-7.910114113042261
COc1cc2cc(CN(CCCN3CCOCC3)C(=S)NC[C@@H]3CCCO3)c(=O)[nH]c2cc1OC,C19941023_decoy,CASP3,Decoy,0,-8.98125,-6.67,-2.28,-8.840805744577695
COCCn1nnnc1[C@@H](c1cc2cc(OC)ccc2[nH]c1=O)N(Cc1ccco1)Cc1cccs1,C19973288_decoy,CASP3,Decoy,0,-8.64041,-6.11,-1.36,-7.354560790827457
CC[NH+](CC)CCCN1C(=O)C([O-])=C(C(=O)c2c(C)[nH]c(C(=O)OC)c2C)[C@@H]1c1cccnc1,C20149912_decoy,CASP3,Decoy,0,-7.85881,-6.58,-3.91,-7.976256684238131
C=CCn1c(SCC(=O)Nc2sc(C(=O)N(C)C)c(C)c2C(=O)OCC)nnc1C1CC1,C21163541_decoy,CASP3,Decoy,0,-9.26763,-7.14,-1.42,-7.379198464695651
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)NCC(=O)Nc2c(C)cccc2C)c1C,C21331365_decoy,CASP3,Decoy,0,-8.43038,-6.7,-1.73,-6.50946743539249
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NCCCCCc1nc(-c2cccs2)no1,C21640025_decoy,CASP3,Decoy,0,-10.559,-7.14,-3.68,-6.876700152681012
CCOC(=O)c1cc2n(n1)C[C@](C)(C(=O)NCCCOC)N(c1ccc(OC)c(OC)c1)C2=O,C21879342_decoy,CASP3,Decoy,0,-8.03499,-6.61,-1.83,-7.747920262767258
COC(=O)[C@H]1O[C@H](O[C@@H]2C[C@H](c3cccnc3)N(C)C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C22060503_decoy,CASP3,Decoy,0,-6.05625,-6.76,-2.81,-6.584663873110699
CC(=O)OC[C@H]1O[C@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,C22065129_decoy,CASP3,Decoy,0,-6.09289,-6.3,-2.17,-6.332275274422274
COCCN(CC(=O)Nc1nc(CC(=O)NCCc2ccccn2)cs1)C(=O)c1ccc(C)cc1,C33429502_decoy,CASP3,Decoy,0,-8.84581,-7.5,-1.76,-7.069646591996504
COc1ccc(CCN(C)C(=O)CCN(C[C@@H]2CCCO2)C(=O)c2cnc(C)cn2)cc1OC,C33607151_decoy,CASP3,Decoy,0,-9.52907,-6.67,-3.72,-8.660000372630993
CCCCC[C@@H]1SC[C@@H](C(=O)NCCN2CCOCC2)N1C(=O)c1cc(OC)c(OC)c(OC)c1,C35193194_decoy,CASP3,Decoy,0,-8.63407,-5.14,-1.65,-6.731449016857519
CC[C@H](C)N(CC(=O)N(Cc1ccco1)C[C@H]1CCCO1)C(=O)c1cc(OC)c(OC)c(OC)c1,C35394083_decoy,CASP3,Decoy,0,-8.35081,-6.79,-1.69,-8.368212930079496
CCOCCCN(CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(=O)c1cnccn1,C35819502_decoy,CASP3,Decoy,0,-6.92526,-5.27,-1.46,-5.890361642276658
CC(C)C(=O)N(CCN1CCOCC1)Cc1cnc(S(=O)(=O)Cc2ccc(F)cc2)n1C[C@H]1CCCO1,C36030803_decoy,CASP3,Decoy,0,-9.60555,-7.89,-3.16,-9.367449828080426
CCCCNC(=O)[C@H](c1ccc(OC)c(OC)c1)N(Cc1ccc(C)o1)C(=O)[C@@H]1CCC(=O)N1,C36601197_decoy,CASP3,Decoy,0,-8.31653,-6.56,-3.6,-7.329165425570292
CCOCCCNC(=O)[C@@H](c1ccc(Cl)cc1)N(Cc1ccc2c(c1)OCO2)C(=O)CNC(C)=O,C09720351_decoy,CASP3,Decoy,0,-9.15911,-5.74,-3.13,-7.112157849301452
CCOc1ccc([C@H]2C(C(=O)c3c(C)[nH]c(C(=O)OC)c3C)=C([O-])C(=O)N2CC[NH+](C)C)cc1OC,C33813332_decoy,CASP3,Decoy,0,-8.20686,-5.07,-2.93,-6.684299807321781
CCOc1c([C@@H](CC=O)NC=O)ccc(S(=O)(=O)Oc2ccccc2)c1S(=O)(=O)c1ccccc1,C39498279_decoy,CASP3,Decoy,0,-6.3983,-6.98,-4.59,-7.705502428327528
CCOc1ccc([C@@H](CC=O)NC=O)c(S(=O)(=O)C(C)C)c1S(=O)(=O)Oc1ccccc1,C39498870_decoy,CASP3,Decoy,0,-7.35766,-5.62,-3.41,-6.440287979899064
C=CCn1c(CC(=O)Nc2cccc(SC)c2)nnc1SCC(=O)Nc1nnc(CC)s1,C39744132_decoy,CASP3,Decoy,0,-10.3047,-7.67,-2.57,-8.99338912243609
CCn1c(S[C@H](C)C(=O)/N=C2/NCCS2)nnc1[C@@H](CCSC)NC(=O)c1ccc(OC)cc1,C39757047_decoy,CASP3,Decoy,0,-11.2562,-5.74,-1.66,-7.832632957760238
CC(=O)N[C@@H]1[C@@H](OC(=O)c2cccc([N+](=O)[O-])c2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O,C39842059_decoy,CASP3,Decoy,0,-5.9941,-6.55,-3.09,-5.918711157171219
CC(=O)N[C@@H]1[C@@H](OC(=O)c2cccc([N+](=O)[O-])c2)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O,C39842061_decoy,CASP3,Decoy,0,-4.93605,-7.13,-2.51,-5.742245037662044
C[C@@]1(NC(=O)OCCCCCCOC(=O)N[C@]2(C)CCS(=O)(=O)C2)CCS(=O)(=O)C1,C40167950_decoy,CASP3,Decoy,0,-8.33739,-6.44,-2.68,-7.067344721242515
CC[C@@H](c1nnnn1CCOC)N(Cc1ccccc1)Cc1cc2ccc(OC)cc2[nH]c1=O,C57641216_decoy,CASP3,Decoy,0,-7.44349,-6.43,-2.32,-7.21147959198465
CCOC(=O)Cn1nnnc1[C@@H](CC)N(Cc1ccco1)Cc1cc2cc(C)ccc2[nH]c1=O,C13495627_decoy,CASP3,Decoy,0,-8.41495,-7.01,-0.68,-7.468583591357039
COCCn1nnnc1[C@@H](C(C)C)N(Cc1cccs1)Cc1cc2ccc(OC)cc2[nH]c1=O,C13498774_decoy,CASP3,Decoy,0,-10.0391,-7.07,-3.02,-8.465459029572115
CCOC(=O)C1=C(C)[C@@H](C(=O)C2=C([O-])C(=O)N(CC[NH+](CC)CC)[C@@H]2c2ccccn2)C(C)=N1,C20193272_decoy,CASP3,Decoy,0,-8.60833,-6.4,-1.75,-7.334624350108543
CCOC(=O)C1=C(C(=O)COC(=O)CCCN2C(=O)c3cccc4cccc(c34)C2=O)C(C)=N[C@@H]1C,C39948331_decoy,CASP3,Decoy,0,-7.57394,-7.48,-2.01,-6.144465134582021
Cc1ccc(C(=O)C[C@]2(O)C(=O)N(CC(N)=O)c3ccccc32)o1,C04545555_decoy,CASP3,Decoy,0,-6.97428,-6.07,-1.43,-6.209038940182347
COc1cc(N2C(=O)C=C(C)[C@]2(O)CC#N)c(OC)cc1N,C01763272_decoy,CASP3,Decoy,0,-5.87177,-5.26,-2.16,-5.273302766435981
Cc1nn(C)c(C)c1NC(=O)CSc1nnc(N)s1,C05462561_decoy,CASP3,Decoy,0,-5.64563,-5.56,-0.54,-5.102807594311655
NC(=O)NC(=O)CSc1nc(C2CC2)n(-c2ccccc2)n1,C06549588_decoy,CASP3,Decoy,0,-7.85838,-5.59,-1.04,-6.01861685659381
COC(=O)c1c(NC(=O)C(=O)NC[C@H](C)O)sc(C)c1C,C09304914_decoy,CASP3,Decoy,0,-7.4019,-5.06,-0.17,-5.6689552785754085
Cc1noc(C)c1CC(=O)NNC(=O)c1cc(Cl)c[nH]1,C09548497_decoy,CASP3,Decoy,0,-7.1131,-5.7,-2.09,-6.761482511085378
Nc1ccc(S(=O)(=O)Nc2nnc([C@H]3CCCO3)s2)cc1,C11851283_decoy,CASP3,Decoy,0,-6.54971,-6.14,-0.38,-4.517908582111485
C=CCNC(=O)N1CC[C@H]2CC(=O)N(CC(N)=O)CC[C@H]2C1,C15673024_decoy,CASP3,Decoy,0,-6.80517,-6.8,-1.17,-7.857199865899931
CNC(=O)C1CCN(C(=O)Cc2ccc(S(N)(=O)=O)s2)CC1,C32918321_decoy,CASP3,Decoy,0,-9.01504,-5.2,-3.35,-4.703445354863537
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NCCSC(C)(C)C,C33330747_decoy,CASP3,Decoy,0,-7.21209,-5.91,-1.0,-4.772914572098897
C=CCn1c(S[C@@H](C)C(=O)NC(N)=O)nnc1C1CC1,C36800611_decoy,CASP3,Decoy,0,-8.21629,-6.43,-0.99,-7.785039544627585
CN(CCC(N)=S)C(=O)CN1C(=O)NC2(CCCC2)C1=O,C37144692_decoy,CASP3,Decoy,0,-9.52447,-5.86,-1.21,-7.902409897254247
N#Cc1ccccc1S(=O)(=O)NCCCS(N)(=O)=O,C40385477_decoy,CASP3,Decoy,0,-8.87975,-6.64,-1.06,-11.479745613905363
Cc1nc(C)c([C@@H](C)NS(=O)(=O)c2cn(C)nc2N)s1,C40517918_decoy,CASP3,Decoy,0,-6.84466,-5.73,-1.06,-6.392815880362453
Cc1n[nH]c(C)c1S(=O)(=O)NCc1cc2ccccc2[nH]c1=O,C41157591_decoy,CASP3,Decoy,0,-6.1502,-6.91,-0.99,-5.711885773361605
C[C@@H](CN(C)C(=O)c1cccc(S(C)(=O)=O)c1)/C(N)=N/O,C42458871_decoy,CASP3,Decoy,0,-7.07971,-6.04,-1.67,-5.57194426940984
CC1CCN(S(=O)(=O)N(CC/C(N)=N/O)C2CC2)CC1,C42548082_decoy,CASP3,Decoy,0,-6.9126,-6.38,-1.51,-7.123451208846754
CNC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCCc2c1cnn2C,C44178047_decoy,CASP3,Decoy,0,-7.67675,-5.8,-1.53,-6.782433745208951
NS(=O)(=O)c1ccc(CCNC(=O)c2ccon2)s1,C44586629_decoy,CASP3,Decoy,0,-8.61692,-5.54,-1.03,-7.88645202419079
COc1cc(N)ccc1S(=O)(=O)NCc1cc(C)on1,C44687824_decoy,CASP3,Decoy,0,-6.10172,-5.4,-0.85,-4.641158227523855
O=C(NCC1CCCC1)NNC(=O)[C@H]1CCS(=O)(=O)C1,C47014632_decoy,CASP3,Decoy,0,-7.80168,-4.96,-2.09,-5.3973476985989794
Cc1ccc(S(=O)(=O)Nc2cnn(CC(N)=O)c2)cc1,C47251594_decoy,CASP3,Decoy,0,-7.88101,-7.61,-1.55,-8.50669321043933
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)NC1CC1,C49151046_decoy,CASP3,Decoy,0,-6.22656,-6.61,-1.43,-6.7348200062912245
Cc1c(C(F)(F)F)n[nH]c1NC(=O)[C@H](C)NS(C)(=O)=O,C49494003_decoy,CASP3,Decoy,0,-6.55001,-6.77,-1.23,-6.134489017976805
CCC[NH+]1CCC(NC(=O)N2C[C@H](O)C[C@H]2C(=O)[O-])CC1,C49560768_decoy,CASP3,Decoy,0,-6.85598,-4.42,-0.28,-5.661822540697928
Cc1cc(N)ccc1S(=O)(=O)N[C@H](C)c1nncn1C,C50416862_decoy,CASP3,Decoy,0,-5.85287,-6.03,-1.9,-5.527738194257007
CNC(=O)[C@@H](C)NS(=O)(=O)c1cc(Br)cnc1NC,C50674456_decoy,CASP3,Decoy,0,-6.46237,-6.28,-1.18,-5.089733294627054
O=C(NCC(=O)N1CCC[C@H](C(=O)NC2CC2)C1)NC1CC1,C50728634_decoy,CASP3,Decoy,0,-6.9539,-5.85,-0.32,-7.493462965194282
CCCc1c(C(=O)N2CCO[C@H](C(N)=O)C2)[nH]c(C)c1C(C)=O,C50844249_decoy,CASP3,Decoy,0,-9.03548,-5.64,-0.95,-7.2953410203526845
Cc1sc(NC(=O)C2CC2)c(C(=O)N2CCO[C@H](C(N)=O)C2)c1C,C50847052_decoy,CASP3,Decoy,0,-7.76391,-6.65,-2.26,-6.140477555929455
CCc1c(C(=O)CN2CCO[C@@H](C(N)=O)C2)[nH]c(C)c1C(C)=O,C51102269_decoy,CASP3,Decoy,0,-8.47659,-5.75,-0.9,-6.226228492805182
Nc1nnc(CNC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)s1,C20202593_decoy,CASP3,Decoy,0,-7.1746,-5.22,-0.4,-5.422921104073798
CN(CC(N)=O)C(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3,C47109740_decoy,CASP3,Decoy,0,-9.57091,-7.12,-2.52,-7.396898089725599
C[C@H](OC(=O)Cn1cc(N)ccc1=O)C(=O)NC(C)(C)C,C61092479_decoy,CASP3,Decoy,0,-5.23965,-5.44,-1.29,-4.590661056677325
Cn1cccc1C(=O)NNC(=O)CNC(=O)c1ccccc1F,C61527754_decoy,CASP3,Decoy,0,-6.06355,-5.57,-0.8,-4.447869825734764
CC(C)N(C)S(=O)(=O)N(C)c1ccc(/C(N)=N/O)cc1,C61952729_decoy,CASP3,Decoy,0,-6.72402,-6.73,-1.19,-6.889315614424563
C[C@@H]1C(=O)N2CCCc3cc(NC(=O)C(=O)NCC4(CO)CC4)cc1c32,C49524524_decoy,CASP3,Decoy,0,-7.91792,-7.32,-1.01,-5.782061982967891
C[C@H](O)CNC1=NS(=O)(=O)c2cc(N(C)C)ccc2N1,C62325167_decoy,CASP3,Decoy,0,-7.67273,-7.2,-0.71,-11.273010503542428
C[C@H](CC#N)N(C)S(=O)(=O)c1cc(Br)cnc1NN,C63096619_decoy,CASP3,Decoy,0,-6.47751,-4.2,-1.72,-5.115021401473621
C[C@H]1C[C@H]1C(=O)NCC(=O)NNC(=O)C1=NC=C(Br)C1,C64079276_decoy,CASP3,Decoy,0,-6.05337,-4.93,-1.43,-4.560782576001207
O=C(NNC(=O)c1ccc(N2CCCCC2=O)cc1)NC1CC1,C64429297_decoy,CASP3,Decoy,0,-6.32239,-6.1,-1.83,-5.983043110521905
CCNC(=O)NNC(=O)Cn1cccc(C(F)(F)F)c1=O,C65190115_decoy,CASP3,Decoy,0,-5.7093,-5.4,-1.07,-5.2893752000206
Cc1cc(C)c(CNC(=O)N[C@H](C)CN2CCCC2=O)c(=O)[nH]1,C65534178_decoy,CASP3,Decoy,0,-7.94072,-6.95,-0.94,-6.391613829802343
Cn1ncc2c1CCC[C@H]2NC(=O)N1CCC[C@@H](CCC(N)=O)C1,C66120913_decoy,CASP3,Decoy,0,-8.61288,-6.41,-1.68,-6.550313881229031
NNC(=O)Cn1nnc(CSc2ccc(Cl)cc2)n1,C66328072_decoy,CASP3,Decoy,0,-7.00151,-5.14,-0.38,-4.781194744759931
CC(C)C(=O)N1CCC[C@H](C(=O)N[C@@H]2CCCN(CC(N)=O)C2)C1,C66449047_decoy,CASP3,Decoy,0,-8.75848,-6.16,-1.23,-7.032293911210592
NC(=O)CN1CCC[C@@H](NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1,C66451767_decoy,CASP3,Decoy,0,-9.2247,-5.84,0.04,-6.694728738569178
NC(=O)C1CCC(NC(=O)c2csc(-c3cnccn3)n2)CC1,C66634856_decoy,CASP3,Decoy,0,-9.46407,-5.63,-0.16,-6.2565457266854
CC(C)c1cc(C(=O)NCc2n[nH]c(=S)n2C2CC2)n[nH]1,C66638297_decoy,CASP3,Decoy,0,-8.74126,-6.69,-1.52,-5.918262512709901
CCc1[nH]ncc1C(=O)NCc1n[nH]c(=S)n1C(C)C,C67071633_decoy,CASP3,Decoy,0,-6.29318,-5.87,-1.31,-5.477365274713641
CCOC(=O)c1cnc(SCC(=O)NCc2ccc3c(c2)OCO3)nc1N,C04128037_decoy,CASP3,Decoy,0,-6.45978,-5.83,-1.58,-4.793996264994616
O=C(CNS(=O)(=O)c1cccc2nsnc12)NNC(=O)c1ccc(Cl)cc1,C03180714_decoy,CASP3,Decoy,0,-7.2324,-5.46,-1.22,-5.8185695271337945
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2oc3ccccc3c2C)no1,C06929035_decoy,CASP3,Decoy,0,-7.81731,-8.1,-1.62,-10.427378735755063
CC[C@@]1(c2ccc(C)cc2)NC(=O)N(CC(=O)NC(=O)NCCCOC)C1=O,C08315459_decoy,CASP3,Decoy,0,-7.64078,-6.99,-2.09,-6.83971334939594
Cn1c(N)c(C(=O)CSc2nnc(Nc3ccccc3F)s2)c(=O)n(C)c1=O,C03351730_decoy,CASP3,Decoy,0,-7.48956,-7.04,-1.38,-4.881610121092558
C[C@H](Sc1nnnn1C[C@H]1CCCO1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C09949725_decoy,CASP3,Decoy,0,-9.28599,-7.07,-1.11,-7.533295037797216
Cc1cccc(-c2nnc(SCC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)o2)c1,C10026980_decoy,CASP3,Decoy,0,-6.06985,-6.61,-0.65,-6.044243587858028
C[C@H](Sc1nnc(-c2ccncc2)n1C)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C13120106_decoy,CASP3,Decoy,0,-8.93062,-7.76,-2.66,-7.448611723853935
CCOC(=O)c1c(NC(=O)CSc2nc(C)cc(N)n2)oc(C)c1C(C)=O,C12549345_decoy,CASP3,Decoy,0,-6.93299,-5.98,-2.43,-6.868577402256118
COc1ccc(C(=O)NC(=S)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1,C13630160_decoy,CASP3,Decoy,0,-7.74219,-4.67,-0.77,-5.207586644391649
N/C(=N/NC(=S)N1CCN(c2ccccc2)CC1)c1cncc(N2CCOCC2)n1,C15227957_decoy,CASP3,Decoy,0,-7.98218,-8.22,-2.77,-7.715281374633424
CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C,C15793240_decoy,CASP3,Decoy,0,-7.86113,-5.38,-1.4,-6.548377285994429
COc1ccc(NCc2nnc(SCc3nnc(C(C)(C)C)o3)n2N)cc1,C20838246_decoy,CASP3,Decoy,0,-10.0177,-7.0,-0.76,-6.013737094884107
Nc1c(C(=O)CSc2nnc3ccc(C(F)(F)F)cn23)c(=O)[nH]c(=O)n1C1CC1,C24146851_decoy,CASP3,Decoy,0,-6.50831,-6.67,-0.34,-5.628643366563111
COc1ccc(S(=O)(=O)Nc2ccccc2-n2ncc(C#N)c2N)cc1OC,C24578422_decoy,CASP3,Decoy,0,-7.0206,-5.94,-1.3,-6.138844270997395
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2[nH]c(C)c(C(=O)OC)c2C)C1=O,C24925280_decoy,CASP3,Decoy,0,-7.24395,-6.54,-0.91,-7.051523308727765
N#CC1(NC(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)CCCCC1,C25956140_decoy,CASP3,Decoy,0,-9.29293,-5.67,-1.29,-7.339783618380071
CCn1cc(NC(=O)c2ccc(COc3ccc(C(C)=O)cc3)o2)c(C(N)=O)n1,C28238949_decoy,CASP3,Decoy,0,-7.53597,-6.89,-0.52,-5.525424332227958
CCCCn1c(N)c(N(CC)C(=O)c2ccc3c(c2)OCCCO3)c(=O)[nH]c1=O,C32531592_decoy,CASP3,Decoy,0,-8.15618,-6.19,-1.82,-6.346017399832233
CS(=O)(=O)N1CCN(c2ccc(NC(=O)CSc3nnc(N)s3)cc2)CC1,C32693207_decoy,CASP3,Decoy,0,-9.09565,-6.78,-2.23,-7.274635919020204
COc1cc2cc(C(=O)N[C@H](C)C(=O)Nc3nccs3)[nH]c2c(OC)c1OC,C36576418_decoy,CASP3,Decoy,0,-9.78924,-6.48,-1.67,-7.626978871643112
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1,C12921037_decoy,CASP3,Decoy,0,-6.76183,-8.29,-2.27,-6.228979844251357
CCCNc1ncnc2c1cnn2CCNC(=O)C(=O)c1c[nH]c2ccccc12,C38483839_decoy,CASP3,Decoy,0,-7.02785,-6.66,-1.31,-6.156630640809629
CCOC(=O)CSc1nnc(N)n1[C@H](C)C(=O)Nc1sc(C)c(C)c1C#N,C40174536_decoy,CASP3,Decoy,0,-6.48767,-6.41,-1.6,-7.1735633123199065
Cc1cc(C(=O)NCCCNC(=O)[C@@]2(C)Oc3ccc(Cl)cc3NC2=O)nn1C,C41549420_decoy,CASP3,Decoy,0,-7.59613,-6.6,-1.27,-6.393268715802678
COc1ccc(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)cc1OC,C45455692_decoy,CASP3,Decoy,0,-7.44635,-6.68,-3.41,-6.633922968009975
CC(C)Oc1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cn1,C46825151_decoy,CASP3,Decoy,0,-7.90853,-6.22,-1.34,-5.795617113661886
O=C(NNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1)C(=O)NC1CC1,C09889840_decoy,CASP3,Decoy,0,-6.59956,-8.13,-2.4,-6.311370933050771
COc1cc(OC)c(CNC(=O)CSc2ncc(C#N)c(N)n2)c(OC)c1,C53549208_decoy,CASP3,Decoy,0,-7.16801,-5.54,-1.63,-7.062318939124684
Cn1c(CCC(N)=O)nnc1SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1,C09608369_decoy,CASP3,Decoy,0,-10.3297,-8.07,-1.31,-8.216677897994858
CCCCn1c(N)c(N(CC(C)C)C(=O)[C@H]2CC(=O)N(C3CC3)C2)c(=O)[nH]c1=O,C57578295_decoy,CASP3,Decoy,0,-6.66486,-5.3,-1.28,-5.158784410334618
Cn1cc(/C=N/Nc2nc(SCC(=O)Nc3ccc(F)cc3F)n[nH]2)cn1,C59310804_decoy,CASP3,Decoy,0,-7.83537,-5.58,-0.8,-5.073410594458696
COc1cc([C@H]2NN(C)C(C(C)=O)=NN2c2ccccc2)ccc1OCC(N)=O,C59714491_decoy,CASP3,Decoy,0,-9.37518,-6.32,-2.37,-7.3392140389852125
C(=N/Nc1nc(SCc2nnc(C3CCC3)o2)n[nH]1)\c1c[nH]c2ccccc12,C59878935_decoy,CASP3,Decoy,0,-8.51765,-6.8,-0.27,-5.897823270843114
CCOC(=O)c1sc(NC(=O)CSc2nnc(C3CC3)n2N)c(C#N)c1C,C59912201_decoy,CASP3,Decoy,0,-8.63756,-7.33,-0.8,-8.776809602810697
CCCN1N[C@@H](C(=O)NNC(=O)C2=NN=C(c3ccccc3)C2)c2ccccc2C1=O,C39943149_decoy,CASP3,Decoy,0,-7.39977,-7.81,-3.18,-5.041182034620111
CC(=O)NCc1ccc(-c2csc(NC(=O)CNC(=O)OC(C)(C)C)n2)o1,C63465679_decoy,CASP3,Decoy,0,-8.34686,-6.36,-0.41,-5.3472869963763
CCCn1c(=O)n(CCC(=O)NNC(=O)NC[C@@H]2CCCO2)c2ccccc21,C65146851_decoy,CASP3,Decoy,0,-7.69923,-6.65,-2.71,-5.499505283551677
CCNC(=O)NNC(=O)CN(Cc1ccco1)S(=O)(=O)c1ccc(C)cc1,C65190977_decoy,CASP3,Decoy,0,-7.0781,-5.45,-1.62,-5.956983479649722
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=O)NCC1CC1,C65192872_decoy,CASP3,Decoy,0,-6.24489,-6.33,-1.24,-5.446824841590843
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NCC(=O)Nc2cn[nH]c2)c1,C65310443_decoy,CASP3,Decoy,0,-5.98353,-6.31,-2.01,-5.691515748310505
COc1nc(C)ccc1CNC(=O)NC[C@@H](O)COc1ccc2c(c1)OCO2,C66204000_decoy,CASP3,Decoy,0,-7.08623,-7.59,-0.76,-7.090437312862643
NS(=O)(=O)c1ccc(NCCCS(=O)(=O)c2ccccc2)c([N+](=O)[O-])c1,C66373267_decoy,CASP3,Decoy,0,-7.35812,-7.49,-2.24,-8.673007176131403
COCCNC(=O)NC(=O)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1,C66566675_decoy,CASP3,Decoy,0,-9.18069,-5.55,-2.5,-6.719350868146223
COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)NCCc1ccccn1,C66583643_decoy,CASP3,Decoy,0,-6.63629,-8.0,-2.45,-6.786552177485506
CCNC(=O)Cn1ccc(NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)n1,C67344589_decoy,CASP3,Decoy,0,-8.01456,-6.41,-1.5,-6.490621056110344
CCn1nc(C)c(CNC(=O)NCC(=O)Nc2ccc(-n3cccn3)cc2)c1C,C67419746_decoy,CASP3,Decoy,0,-7.19573,-7.36,-1.15,-6.091626544200588
CC(C)(C)OC(=O)N(CCNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)C1CC1,C67421878_decoy,CASP3,Decoy,0,-6.85284,-6.15,-1.29,-6.202348992792786
O=C(NCCCc1nnc2n1CCCCC2)NNC(=O)[C@@H]1Cc2ccccc2O1,C67462054_decoy,CASP3,Decoy,0,-7.42842,-6.6,-1.12,-7.556733540288053
CCn1nc(C)c(CNC(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c1C,C67468289_decoy,CASP3,Decoy,0,-7.98679,-7.78,-1.56,-6.609439927686725
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)[C@H]1/C=N/CC[NH+]1CCN(C(=O)Cc2ccc(Cl)cc2)CC1,C08694284_decoy,CASP3,Decoy,0,-6.92284,-6.91,-1.87,-4.9122573939677
COc1c2c(cc3c1[C@@H](c1c(O)n(-c4ccccc4)c(=S)n(-c4ccccc4)c1=O)[NH+](C)CC3)OCO2,C02100559_decoy,CASP3,Decoy,0,-8.09713,-6.41,-2.4,-5.929419196453028
O=C(c1ccccn1)[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@@H]2CSC[NH+]2[C@@]12C(=O)Nc1ccc(F)cc12,C09123931_decoy,CASP3,Decoy,0,-6.96602,-6.41,-1.99,-7.769921908528757
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1c3ccccc3C=C[NH+]1[C@@H]2C(=O)c1ccco1,C09209790_decoy,CASP3,Decoy,0,-6.81514,-7.24,-1.73,-5.667589439798426
O=C(c1cccnc1)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@H]2CSC[NH+]2[C@@]12C(=O)Nc1ccccc12,C09329519_decoy,CASP3,Decoy,0,-7.04037,-6.51,-4.58,-6.33820719935087
CC[NH+]1CCN(c2nc3ccc(C)cn3c(=O)c2/C=C2\SC(=S)N(CCCOC)C2=O)CC1,C09380085_decoy,CASP3,Decoy,0,-8.1814,-7.23,-2.0,-5.52771795773019
C[NH+](C)CCCN(C(=O)c1cccc(N2C(=O)CCC2=O)c1)c1nc2cc3c(cc2s1)OCCO3,C10068243_decoy,CASP3,Decoy,0,-7.87558,-6.78,-2.15,-6.560831307507758
CCOC(=O)c1ccc(-n2c(C)c(C)n3c4c(=O)n(CC[NH+]5CCCCC5)c(=O)n(C)c4nc23)cc1,C10104988_decoy,CASP3,Decoy,0,-6.85004,-6.46,-3.43,-7.301058809314429
COc1cccc2sc(N(CC[NH+](C)C)C(=O)[C@H]3CCCN(S(=O)(=O)c4cccs4)C3)nc12,C10751677_decoy,CASP3,Decoy,0,-9.24517,-7.56,-5.07,-7.923540192255128
CCc1cc(C(=O)N2CCc3c(C(=O)OC)c(OCC[NH+]4CCCCC4)cc(=O)n3CC2)no1,C12165732_decoy,CASP3,Decoy,0,-8.03712,-7.46,-1.91,-9.462205006438236
CCn1c(-c2ccccc2F)nc2cc(NC(C)=O)cc(C(=O)N3CCN(c4cccc[nH+]4)CC3)c21,C12242595_decoy,CASP3,Decoy,0,-8.94414,-6.44,-2.75,-8.286458924158557
O=C(c1ccco1)N1CC[NH+]([C@@H](c2coc3ccc(Cl)cc3c2=O)c2nnnn2C2CCCC2)CC1,C12635790_decoy,CASP3,Decoy,0,-7.56903,-6.58,-2.89,-5.929642894743159
Cc1cccc2cc([C@@H](c3nnnn3C3CCCC3)[NH+]3CCN(c4ccc(F)cc4)CC3)c(=O)[nH]c12,C06443624_decoy,CASP3,Decoy,0,-8.70819,-8.9,-1.69,-6.791527648053465
Cc1cccc2cc([C@H](c3nnnn3C3CCCC3)[NH+]3CCN(c4ccccc4)CC3)c(=O)[nH]c12,C06443778_decoy,CASP3,Decoy,0,-7.17994,-7.67,-0.76,-6.179929405028337
CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(C(=O)Nc4c2ccc(Cl)c4C)[NH+]2CCC[C@@H]32)cc1,C09235735_decoy,CASP3,Decoy,0,-8.01712,-6.72,-2.95,-5.863425020374382
COC(=O)c1c(OCC[NH+]2CCCCC2)cc(=O)n2c1CCN(C(=O)c1cc(C)n(C)n1)CC2,C14879783_decoy,CASP3,Decoy,0,-6.96507,-6.69,-2.46,-5.388230809952624
Cc1csc(Sc2ccc(C(=O)OCC(=O)N3CCN(c4cccc[nH+]4)CC3)cc2[N+](=O)[O-])n1,C16251772_decoy,CASP3,Decoy,0,-4.73486,-8.0,-1.93,-5.026973432271536
CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@H]4CCC[NH+]4[C@@]4(C(=O)Nc5c4ccc(Cl)c5C)[C@@H]3C2=O)cc1,C09087172_decoy,CASP3,Decoy,0,-7.71245,-6.62,-2.85,-5.837090534867318
O=C1C[C@H]([NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)C(=O)N1c1ccc(OC(F)(F)Cl)cc1,C19624880_decoy,CASP3,Decoy,0,-9.14228,-7.27,-1.24,-8.18810732144371
CN(C(=O)CCc1nc(C[NH+]2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)no1)C1CCCCC1,C20562457_decoy,CASP3,Decoy,0,-7.69766,-7.21,-1.83,-5.807840657875213
CC1=NN(CC[NH+]2CCN(C(c3ccccc3)c3ccccc3)CC2)c2nc3c(c(=O)n(C)c(=O)n3C)n2C1,C20816767_decoy,CASP3,Decoy,0,-7.46639,-7.59,-1.06,-6.656756067102668
CC[NH+]1CCN(CCCn2c(=O)c3c(nc4n(-c5cccc(C)c5C)c(C)c(C)n34)n(C)c2=O)CC1,C22821154_decoy,CASP3,Decoy,0,-7.38177,-7.68,-3.12,-5.86690941033797
CC[NH+]1CCN(CCCn2c(=O)c3c(nc4n(-c5ccc(OC)cc5)c(C)cn34)n(C)c2=O)CC1,C22821400_decoy,CASP3,Decoy,0,-7.56837,-7.03,-2.79,-5.591380222639836
CCN1CC[NH+](C[C@@H](C)Cn2c(=O)c3c(nc4n(-c5cccc(Cl)c5)c(C)cn34)n(C)c2=O)CC1,C22821592_decoy,CASP3,Decoy,0,-8.48028,-7.8,-2.3,-6.491699991807139
Cc1cccc(-c2nnc3ccc(N4CCC(C(=O)N5CCN(c6cccc[nH+]6)CC5)CC4)nn23)c1,C33260235_decoy,CASP3,Decoy,0,-8.1671,-7.18,-2.55,-6.234988461423285
CN(C)C(=O)CSc1nc(N2CC[NH+](CC(=O)N(C)C)CC2)c2c3c(sc2n1)COC(C)(C)C3,C34750180_decoy,CASP3,Decoy,0,-8.93467,-5.39,-1.95,-5.993113218579222
Cc1ccc(C(=O)N2CCc3nc(N4CCC(C)CC4)nc(N4CC[NH+](C)CC4)c3C2)cc1[N+](=O)[O-],C34756414_decoy,CASP3,Decoy,0,-6.49866,-5.79,-3.08,-4.531522986001233
CC(C)Nc1scc(-c2ccc(OC(F)F)cc2)[n+]1/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2,C35544384_decoy,CASP3,Decoy,0,-7.51952,-5.9,-2.48,-6.39473171415541
Cc1ccccc1N1CC[NH+](Cc2cc(=O)[nH]c(N3CCN(C(=O)c4ccccc4F)CC3)n2)CC1,C35564707_decoy,CASP3,Decoy,0,-8.08103,-7.33,-1.98,-6.687537264526795
Cc1ccc(-c2ccc(N3CCCN(C(=O)CN(CC[NH+](C)C)C(=O)c4cccs4)CC3)nn2)cc1,C35706098_decoy,CASP3,Decoy,0,-7.3451,-6.05,-1.21,-5.838587291125695
COc1cc(OC)c([C@H]2C[C@H](c3ccc(I)cc3)[NH+]=C3N=NNN32)cc1OC,C02916564_decoy,CASP3,Decoy,0,-6.46878,-5.35,-0.86,-4.671723808603332
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)N3CCN(c4cccc[nH+]4)CC3)CC2)cc1,C38733065_decoy,CASP3,Decoy,0,-8.73343,-7.5,-2.96,-6.5145665184605495
O=C(O[C@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1,C38775107_decoy,CASP3,Decoy,0,-8.45341,-8.58,-2.25,-8.308143728914583
COc1cc2c(cc1OC)=[NH+]C(=O)[C@@H](CN(Cc1ccco1)S(=O)(=O)c1ccc(C)cc1)C=2,C39324887_decoy,CASP3,Decoy,0,-8.15718,-6.94,-4.15,-7.888248672910023
COC(=O)c1ccccc1S(=O)(=O)N(C[C@@H]1CCCO1)C[C@@H]1C=c2cc3c(cc2=[NH+]C1=O)OCCO3,C39324983_decoy,CASP3,Decoy,0,-7.56532,-5.84,-1.84,-5.965533724751622
COC(=O)c1ccccc1S(=O)(=O)N(C[C@H]1CCCO1)C[C@@H]1C=c2cc3c(cc2=[NH+]C1=O)OCCO3,C39324985_decoy,CASP3,Decoy,0,-8.03226,-7.82,-2.14,-7.703993400169883
CCOC(=O)[C@H]1CCCN(c2nc(-c3cccs3)ccc2C(=O)N2CCC(N3CC[NH+](CC)CC3)CC2)C1,C23360672_decoy,CASP3,Decoy,0,-10.7088,-7.32,-2.11,-8.7033475629446
Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)Nc3cccc(Br)c3)c(N3CC[NH+](C)CC3)nc12,C39994327_decoy,CASP3,Decoy,0,-8.42865,-7.0,-1.89,-6.055406936227439
O=C(C1CCN(c2ccc(-c3ccc4c(c3)OCO4)nn2)CC1)N1CCN(c2cccc[nH+]2)CC1,C40919641_decoy,CASP3,Decoy,0,-9.8205,-6.71,-1.94,-5.6404357263161895
CC1(C)Cc2cccc(OCC(=O)N3CCN(c4ccc(-c5noc(C6CC6)n5)c[nH+]4)CC3)c2O1,C44096058_decoy,CASP3,Decoy,0,-8.93717,-8.93,-0.69,-6.825918365408825
CS(=O)(=O)C1=NN2C(=[NH2+])/C(=C\c3ccc(SCc4ccc(Cl)cc4)o3)C(=O)N=C2S1,C20324743_decoy,CASP3,Decoy,0,-8.98614,-6.56,-1.88,-7.295839218565552
O=C1C[C@H](N2CC[NH+]([C@H]3CC(=O)N(c4ccc(Cl)cc4)C3=O)CC2)C(=O)N1c1ccc(Cl)cc1,C22804742_decoy,CASP3,Decoy,0,-8.44928,-6.62,-2.57,-5.527279057486558
COc1cc(OC)cc(N2C(=O)C[C@@H](N3CCN(c4cc[nH+]c5cc(Cl)ccc45)CC3)C2=O)c1,C12418289_decoy,CASP3,Decoy,0,-8.78612,-6.77,-0.95,-6.286540873242664
CC(=O)C1=C(C)C(C(=O)CSc2nnc(C3=c4ccccc4=[NH+]C3)n2C[C@H]2CCCO2)=N[C@@H]1C,C63122415_decoy,CASP3,Decoy,0,-7.97556,-7.5,-1.21,-5.574040495191392
CCOc1ccccc1[C@@H]1[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(CCN3CCOCC3)CC(=O)N12,C63140611_decoy,CASP3,Decoy,0,-8.56165,-6.69,-1.49,-7.440204107321729
O=C(CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O)N1CCC[C@@H](c2nc3ccccc3s2)C1,C63161068_decoy,CASP3,Decoy,0,-8.54019,-7.7,-2.17,-6.977380270540284
COc1ccc2c(c1)=C1CCN3C(=O)CN(Cc4cc(OC)c(OC)c(OC)c4)C(=O)[C@]3(C)[C@@H]1[NH+]=2,C63362392_decoy,CASP3,Decoy,0,-6.42454,-6.17,-1.95,-6.002608807206569
C[C@H](C(=O)N1CCN(C(=O)c2ccco2)CC1)C1CCN(C(=O)[C@H]2C=c3cc(Cl)ccc3=[NH+]2)CC1,C63739625_decoy,CASP3,Decoy,0,-6.29828,-7.55,-1.67,-5.059234437584082
COc1ccc2c(c1)=C(CCN1C(=O)[C@H]3N=N[C@@H](c4ccco4)[C@H]3[C@H]1c1ccc([N+](=O)[O-])cc1)C[NH+]=2,C63824860_decoy,CASP3,Decoy,0,-7.23672,-7.08,-4.16,-6.379778948553016
O=C1CN(C(=O)c2nn(Cc3ccccc3)c3c2CN(C[C@H]2C=c4ccccc4=[NH+]2)CC3)CCN1,C63993662_decoy,CASP3,Decoy,0,-7.52426,-7.01,-2.38,-6.489842056798494
CC(=O)O[C@@H]1C[C@@]2(C)C(=O)CC[C@H]2[C@H]2CCc3cc(O)ccc3[C@@H]21,C03902447_decoy,CASP3,Decoy,0,-6.53697,-7.58,-4.14,-5.856335579875523
O=C(NC1CCCC1)[C@H]1[C@@H](C(=O)N2CCCC2)[C@H]2C=C[C@@H]1C2,C04169759_decoy,CASP3,Decoy,0,-6.89493,-6.89,-0.22,-8.349351743297618
O=C(N/N=C1\C[C@H]2CC[C@@H]1C2)c1ccc(Br)o1,C00256244_decoy,CASP3,Decoy,0,-6.88944,-5.0,-0.44,-4.252455219950176
CC(=O)N1c2ccccc2[C@@]2(O)N=C(c3ccccc3)S[C@H]12,C00496195_decoy,CASP3,Decoy,0,-6.13005,-7.14,-1.37,-5.233867336776836
CC(=O)N1c2ccccc2[C@@]2(O)N=C(Cc3ccccc3)S[C@@H]12,C05383071_decoy,CASP3,Decoy,0,-6.35028,-7.19,-1.34,-5.331871268665767
Cc1coc2c1C(=O)C(=O)c1c-2ccc2c1CCC[C@@]2(C)CO,C02031811_decoy,CASP3,Decoy,0,-5.17625,-7.67,-2.35,-3.929663041416559
CC(C)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl,C05841833_decoy,CASP3,Decoy,0,-6.16226,-6.12,-1.35,-5.505112470570606
O=S1(=O)N=C(Nc2ccc3c4c(cccc24)CC3)c2ccccc21,C00314074_decoy,CASP3,Decoy,0,-6.01855,-8.11,-1.1,-5.537617862909443
C[C@@H]1[C@H](C)CCC[C@H]1NC(=O)c1nn(C)cc1Br,C06522995_decoy,CASP3,Decoy,0,-7.35421,-4.46,-5.24,-4.134754241095441
Cc1ccc(NC(=O)[C@]23CC[C@](C)(C(=O)C2=O)C3(C)C)c(C)c1,C06701906_decoy,CASP3,Decoy,0,-5.89261,-5.73,-0.92,-4.532592076208546
CC(C)CNC(=O)c1c2c(nn1C)-c1ccccc1SC2,C06738727_decoy,CASP3,Decoy,0,-6.84561,-6.69,-1.98,-6.430396113475942
Cc1ccc(C2=CCN(c3cn[nH]c(=O)c3Cl)CC2)cc1,C09748781_decoy,CASP3,Decoy,0,-8.30252,-6.55,-0.2,-7.342745938297638
Cc1nc(N/N=C\c2ccc(Br)o2)sc1C,C12126782_decoy,CASP3,Decoy,0,-7.73333,-4.54,-0.82,-5.313551071939376
O=C1N=C(Nc2cccc(Cl)c2)N2Cc3ccccc3C[C@@H]12,C14201615_decoy,CASP3,Decoy,0,-7.09999,-6.17,-0.7,-5.535331083309171
Cc1noc2c1[C@H](c1ccsc1)C1=C(CC(C)(C)CC1=O)N2,C20734248_decoy,CASP3,Decoy,0,-7.1917,-5.35,-6.12,-4.29563590984222
C[C@]12CCC(=O)N1[C@@H](C(=O)NC13CC4CC(CC(C4)C1)C3)CS2,C23679898_decoy,CASP3,Decoy,0,-6.66508,-5.78,-2.24,-4.960917864159231
[H]/N=C1/O[C@@H](C(Cl)(Cl)Cl)N(c2cccc(F)c2)C1=O,C05554573_decoy,CASP3,Decoy,0,-6.33486,-6.5,-1.07,-6.020034610301806
Cc1cc(O[C@H](C)c2n[nH]c(=S)n2C)cc(C)c1Cl,C02522233_decoy,CASP3,Decoy,0,-7.38009,-6.55,-3.47,-6.432318072038235
CC(=O)c1cc(Cl)cc(CN2C[C@H](C)O[C@@H](C)C2)c1O,C37322621_decoy,CASP3,Decoy,0,-8.02784,-5.79,-0.63,-5.240849192967321
O=S(=O)(/N=c1/cccc[nH]1)c1ccc(F)cc1Br,C37574479_decoy,CASP3,Decoy,0,-5.35885,-5.25,-0.44,-3.384498271469424
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccccc2C#CCO)C1,C37577991_decoy,CASP3,Decoy,0,-6.96999,-5.87,-3.7,-5.109859712171208
O=C(N/N=C/[C@H]1CC=CCC1)c1ccc(Br)o1,C04646851_decoy,CASP3,Decoy,0,-5.82376,-4.54,-1.09,-4.163648440408801
O=C(N[C@H]1CCCc2ccccc21)c1ccc2nsnc2c1,C36709753_decoy,CASP3,Decoy,0,-8.86209,-5.68,-0.75,-4.822417864127696
[H]Oc1ccc2ccccc2c1C1=N[C@H](c2ccccc2)C(C)=[N+]1[O-],C39943721_decoy,CASP3,Decoy,0,-6.11763,-6.84,-1.57,-3.4216918716671327
O=S1(=O)C[C@@H]2NC(=S)N(c3ccc4ccccc4c3)[C@H]2C1,C40166813_decoy,CASP3,Decoy,0,-7.88474,-6.49,-1.63,-5.60603343512194
Cc1cccc(NC(=O)c2cc3sccc3n2C(C)C)n1,C40805946_decoy,CASP3,Decoy,0,-7.97615,-6.08,0.02,-7.135526974933008
Brc1cnc2sc3c(NC4CC4)ncnc3c2c1,C41472730_decoy,CASP3,Decoy,0,-6.7252,-4.94,-2.28,-3.953003744527046
CC1(C)[C@H]2CC[C@]1(C)[C@H](NS(=O)(=O)N1CCCCC1)C2,C42666160_decoy,CASP3,Decoy,0,-6.86675,-5.47,-1.05,-5.684384934325958
O=c1c2c3c(sc2[nH]c(=S)n1C[C@H]1CCCCO1)CCC3,C42824029_decoy,CASP3,Decoy,0,-7.1366,-5.3,-0.99,-5.000111465709517
Cc1nn(C)c(C)c1C(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1,C44232054_decoy,CASP3,Decoy,0,-5.83972,-5.16,-2.26,-4.645441701296582
O=C(N[C@H]1CCS(=O)(=O)C1)C12C[C@@H]3C[C@@H](CC(Cl)(C3)C1)C2,C44873621_decoy,CASP3,Decoy,0,-7.91315,-6.78,-0.8,-6.548430202576732
O=C(NC1CCC2(CC1)OCCO2)C1=C(Cl)CCCC1,C46190551_decoy,CASP3,Decoy,0,-6.70012,-6.3,-0.95,-4.521690814580666
O=C(c1cc[nH]n1)N1CCCc2cc(Br)ccc21,C48811064_decoy,CASP3,Decoy,0,-5.96343,-4.75,-1.64,-4.260528112933416
CC(C)[C@H]1CC[C@H](C)C[C@H]1NC(=O)[C@@H]1CCS(=O)(=O)C1,C48943863_decoy,CASP3,Decoy,0,-7.4178,-5.94,-1.93,-6.551242981570226
O=S1(=O)C[C@H](Nc2nc3c(s2)CCC3)c2ccccc21,C49543847_decoy,CASP3,Decoy,0,-8.30987,-6.82,-1.13,-5.091841106704355
[H]/N=C1/S[C@H]2CCCC2=C1c1nc2cc(Br)cnc2[n-]1,C43460844_decoy,CASP3,Decoy,0,-9.01796,-5.4,-1.49,-4.802088689699808
[H]/N=C1\S[C@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(Cl)c1C,C05490063_decoy,CASP3,Decoy,0,-7.88697,-5.47,-2.25,-4.9418177418786335
Cc1cc2c(c(=S)[nH]1)C(=O)O/C2=C\c1cn(C)c2ccccc12,C40380715_decoy,CASP3,Decoy,0,-8.4369,-6.45,-0.66,-5.306081473018394
CCN1C(=O)[C@@H]2[C@@H]3C[C@H]4[C@H](O[C@@]1(C#Cc1ccccc1)[C@@H]42)[C@@H]3O,C53995060_decoy,CASP3,Decoy,0,,-4.85,,
O=C([O-])c1cc2c([nH+]c1N1CCc3sccc3C1)CCC2,C54533005_decoy,CASP3,Decoy,0,-7.35345,-7.16,-0.28,-7.198054163157963
c1cnc(-n2cccn2)c(N[C@@H]2CCCc3sccc32)c1,C61327605_decoy,CASP3,Decoy,0,-6.64307,-5.43,-0.72,-6.130281382170047
O=S(=O)(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@@H](O)C1,C61706834_decoy,CASP3,Decoy,0,-7.09479,-4.85,-1.32,-4.591520394955058
Cc1c(C)c(C)c(S(=O)(=O)N2CC[C@@H](O)C2)c(C)c1C,C61706963_decoy,CASP3,Decoy,0,-5.59039,-6.21,-1.54,-5.010908227485575
CC1CCC(C#N)(NC(=O)c2ccc(Br)cn2)CC1,C61862882_decoy,CASP3,Decoy,0,-6.23842,-5.4,-1.56,-4.109543797956757
O=C1CS[C@H](c2ccc(Cl)cc2Cl)[C@@H]2C=NN=C2N1,C20730560_decoy,CASP3,Decoy,0,-7.70834,-6.29,-0.12,-5.923734382986463
O=C1CC(O)=c2sc3nc4c(c(C(F)(F)F)c3c2=N1)CCC4,C08417852_decoy,CASP3,Decoy,0,-7.29759,-6.56,-0.49,-5.945454447487836
OC1=Nc2c(ncn2-c2ccc(Cl)cc2)[C@@H](c2ccsc2)C1,C36360352_decoy,CASP3,Decoy,0,-8.48242,-6.13,-1.41,-7.866449929377063
CC1=C2[C@H](N=N1)N=C(O)CS[C@H]2c1ccc(F)c(F)c1F,C63807904_decoy,CASP3,Decoy,0,-7.68219,-7.78,-1.23,-6.148144092129404
CNc1snc(C)c1C(=O)N1CC2C[C@@H]3CC1C[C@H](C2)C3,C65924930_decoy,CASP3,Decoy,0,-7.85308,-5.76,-2.19,-4.986984675085079
Cc1nc([C@H](C)Nc2ncc(Br)cn2)cs1,C67372541_decoy,CASP3,Decoy,0,-7.32278,-4.26,-3.35,-4.685437897172018
Nc1nc2c(nc(Br)n2[C@@H]2O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H]2O)c(=O)[nH]1,C03871276_decoy,CASP3,Decoy,0,-5.36181,-5.47,0.07,-5.780494545076041
CC(=O)Nc1ccn([C@@H]2O[C@@H](C)[C@@H](NC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c(=O)n1,C05103608_decoy,CASP3,Decoy,0,-5.72965,-6.19,-1.04,-6.291401847068429
COC(=O)[C@H](c1c(O)oc(C)cc1=O)[C@H](C(=O)OC)c1c(O)oc(C)cc1=O,C06484156_decoy,CASP3,Decoy,0,-6.37185,-6.1,-1.99,-6.298245350904211
Cc1ccc(C(=O)NCC(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1C,C02655005_decoy,CASP3,Decoy,0,-5.77214,-7.74,-1.16,-4.790967662034475
CN1C(=O)C(=CNNc2nc3c(c(=O)n(C)c(=O)n3C)n2C)C(=O)N(C)C1=S,C08838307_decoy,CASP3,Decoy,0,-6.15136,-6.47,-2.17,-4.736948254400266
CC(C)[C@H](NS(=O)(=O)[C@@H]1CS(=O)(=O)C[C@H]1O)c1nnc(S(C)(=O)=O)o1,C08971538_decoy,CASP3,Decoy,0,-8.36981,-7.57,-0.42,-12.590094143317131
O=S1(=O)C[C@@H](O)[C@H](S(=O)(=O)NCc2nnc(S(=O)(=O)Cc3cccc(Cl)c3)o2)C1,C08972692_decoy,CASP3,Decoy,0,-8.5204,-8.0,-2.14,-6.467440162512704
CNC(=O)c1c(NC(=O)CN2C(=O)CCC2=O)sc2c1CCN(C(=O)OC)C2,C09325411_decoy,CASP3,Decoy,0,-6.72232,-7.02,-1.75,-5.958198711028001
O=C(NCCCn1ccnc1)C(=O)NC[C@H]1OCCCN1S(=O)(=O)c1cccs1,C09518935_decoy,CASP3,Decoy,0,-8.03465,-5.47,-2.49,-5.977799028278182
Cc1cc(C)n2nc(SCC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)nc2n1,C09712750_decoy,CASP3,Decoy,0,-6.82797,-7.64,-0.71,-4.845534088582271
NC(=O)C1CCN(C(=O)C(=O)Nc2c3c(nn2-c2cccc(Cl)c2)CS(=O)(=O)C3)CC1,C10033910_decoy,CASP3,Decoy,0,-8.53836,-6.34,-3.63,-6.669994521349565
C[C@@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C,C10272088_decoy,CASP3,Decoy,0,-6.40319,-6.16,-0.57,-5.315883896238834
C[C@@H](Sc1nnnn1Cc1ccco1)C(=O)c1c(N)n(C)c(=O)n(C)c1=O,C11677556_decoy,CASP3,Decoy,0,-7.11344,-5.63,-2.53,-5.631957591105778
COC(=O)N1CCc2c(sc(NC(=O)c3ccc(N4C(=O)CCC4=O)cc3)c2C(N)=O)C1,C12361161_decoy,CASP3,Decoy,0,-8.01909,-6.31,-1.58,-5.808284244268254
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1/C=C/C(=O)O[C@H](C)C(=O)NC(N)=O,C12543028_decoy,CASP3,Decoy,0,-8.35075,-5.65,-0.98,-6.4723430517813325
O=C(Cn1cncn1)N/N=C/c1ccc(OC(=O)/C=C2\SC(=O)NC2=O)cc1,C13016635_decoy,CASP3,Decoy,0,-8.47489,-6.73,-2.59,-6.809557385985928
Cc1cc(=O)oc2cc(O[P@](=O)([O-])OC3[C@@H](O)[C@@H](O)C(O)[C@@H](O)[C@H]3O)ccc12,C15205386_decoy,CASP3,Decoy,0,-9.59468,-7.74,-1.54,-6.606184874601762
CC(C)Cn1c(N)c(C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(=O)n(C)c1=O,C16056241_decoy,CASP3,Decoy,0,-6.86317,-7.31,-0.63,-5.524279199310298
CCn1cc(-c2nnc(SCC3=C(C(=O)[O-])N4C(=O)[C@@H]([NH3+])[C@@H]4SC3)n2CC)cn1,C02784706_decoy,CASP3,Decoy,0,-5.7991,-6.94,-2.23,-4.905097325749922
O=C(Nc1c2c(nn1-c1ccc(Cl)cc1)CS(=O)(=O)C2)C(=O)N1CCN(CCO)CC1,C20779932_decoy,CASP3,Decoy,0,-8.12851,-8.45,-2.88,-7.802571069710193
Cc1nnc(CN2CCN(C(=O)CSc3nnc(C(C)(C)C)n3N)CC2)o1,C20842124_decoy,CASP3,Decoy,0,-8.29164,-6.03,-1.68,-5.092732855853828
Nc1nc(NC2CC2)c2ncn([C@H]3C=C[C@@H](CO[C@@H]4O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@@H]4O)C3)c2n1,C22046179_decoy,CASP3,Decoy,0,-6.32991,-7.01,-1.29,-5.792131864419407
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1,C22411776_decoy,CASP3,Decoy,0,-8.26369,-8.2,-2.92,-6.381095887316519
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)O[C@@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1,C25066720_decoy,CASP3,Decoy,0,-9.36779,-7.0,-0.79,-7.978568822792282
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1,C28810599_decoy,CASP3,Decoy,0,-7.73396,-6.18,-1.08,-6.705990027315868
C[C@]1(O)[C@@](C)(O)[C@@](C)(C[P@@](=O)([O-])O)O[C@@]1(C)n1cnc2c(=O)[nH]cnc21,C29786385_decoy,CASP3,Decoy,0,-8.12044,-5.71,-0.35,-6.31087242132659
COC(=O)c1c(NC(=O)CN2CCN(S(C)(=O)=O)CC2)sc(C(N)=O)c1C,C17091444_decoy,CASP3,Decoy,0,-10.1902,-6.27,-3.54,-6.519822696243004
O=[N+]([O-])c1cc2c(cc1/C=N/[n+]1c(-c3ccc(O)cc3[O-])csc1NC[C@@H]1CCCO1)OCO2,C36652177_decoy,CASP3,Decoy,0,-7.74006,-6.76,-0.45,-6.4759042265470566
Cc1cc(C)cc(C(=O)NCC(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1,C05944175_decoy,CASP3,Decoy,0,-5.72122,-7.44,-0.86,-5.213993739621261
CCOC(=O)N1CCc2c(sc(NC(=O)CN(C)S(C)(=O)=O)c2C(N)=O)C1,C38805765_decoy,CASP3,Decoy,0,-8.05131,-5.51,-2.01,-5.3260408944388535
CCCCCC(=O)[C@@](C)(c1nn2c(N)nnc2nc1[O-])[C@@H]1Nn2c(N)nnc2NC1=O,C39944239_decoy,CASP3,Decoy,0,-7.87703,-8.45,-3.09,-10.612107745102024
O=S1(=O)CC[C@@H](S(=O)(=O)NCCNS(=O)(=O)[C@@H]2CCS(=O)(=O)C2)C1,C40166389_decoy,CASP3,Decoy,0,-8.13463,-6.01,-2.53,-8.92139139766699
CCn1nc(C)c(CNC(=O)c2nc(CC(=O)Nc3cc(C)on3)no2)c1C,C40287096_decoy,CASP3,Decoy,0,-8.04149,-5.95,-1.66,-5.88738307466462
[H]/N=c1/c(=C/c2ccc(O)c(OCC)c2)c(=O)nc2s/c(=C/C(=O)N3CCOCC3)[nH]n1-2,C41085359_decoy,CASP3,Decoy,0,-7.36574,-6.38,-1.42,-5.1887760897988535
COc1nn(C)cc1C(=O)N1CCC(CNC(=O)C(=O)Nc2ccon2)CC1,C43942246_decoy,CASP3,Decoy,0,-7.26072,-6.43,-2.19,-6.383131837860756
Cc1cc(NC(=O)C(=O)NCC2CCN(C(=O)c3cccn(C)c3=O)CC2)no1,C43942615_decoy,CASP3,Decoy,0,-6.70633,-8.59,-2.42,-6.978678846284523
COc1nn(C)cc1C(=O)N1CCN(CCNC(=O)c2ccc[nH]c2=O)CC1,C44455044_decoy,CASP3,Decoy,0,-7.17562,-5.63,-2.18,-5.606606732595014
CCN1CCN(CC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)C(=O)C1=O,C46913532_decoy,CASP3,Decoy,0,-6.03223,-5.85,-0.32,-4.511808810418039
COCCNC(=O)CSc1nnc(NC(=O)CN(C)S(C)(=O)=O)s1,C48984855_decoy,CASP3,Decoy,0,-8.51592,-4.77,-1.06,-6.239502811181012
O=C(NCc1ccco1)C(=O)NC[C@@H]1OCCN1C(=O)c1ccc2c(c1)OCO2,C04337273_decoy,CASP3,Decoy,0,-7.1287,-6.5,-1.55,-6.4374084973063495
CCc1nnc(CN2CCN(C(=O)CSc3nnc(-c4ccc([N+](=O)[O-])cc4)n3N)CC2)o1,C59791038_decoy,CASP3,Decoy,0,-6.69836,-7.23,-1.3,-5.944483369145654
Cc1nn(C)c(C)c1/C=N/Nc1nc(SCc2nnc(C3CCC3)o2)n[nH]1,C59879643_decoy,CASP3,Decoy,0,-9.20118,-6.06,-1.83,-7.177812406351281
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,CASP3,Decoy,0,-6.54377,-7.96,-3.36,-6.080884087763502
O=C(NCc1cccnc1-n1cccn1)C(=O)Nc1cccc(-n2cnnc2)c1,C62088394_decoy,CASP3,Decoy,0,-6.53102,-7.61,-0.57,-5.198944667542233
Cc1n[nH]c(C)c1S(=O)(=O)NCCN(C)S(=O)(=O)c1c(C)noc1C,C62550185_decoy,CASP3,Decoy,0,-6.9944,-6.56,-1.32,-5.66349112237326
COc1c2c(cc3c1[C@H](CN/C=C1/C(=O)NC(=O)N(C)C1=O)N(C)CC3)OCO2,C20113588_decoy,CASP3,Decoy,0,-7.29031,-7.62,-1.05,-5.588288700449817
O=C(N[C@@H]1N=C(CCC(=O)N2CCN(c3ncccn3)CC2)CS1)c1ccc[nH]c1=O,C64409253_decoy,CASP3,Decoy,0,-7.90477,-6.35,-0.86,-6.20329823964941
CNC(=O)C1CCN(c2nc3ncn(CC(=O)NC[C@H]4CCCO4)c(=O)c3s2)CC1,C65101058_decoy,CASP3,Decoy,0,-7.67089,-6.27,-1.63,-5.086110002339004
CC[C@@]1(c2ccccc2)C(=O)N([C@@H]2O[C@@H](C(=O)[O-])[C@@H](O)[C@@H](O)[C@H]2O)C(=O)N=C1[O-],C65748422_decoy,CASP3,Decoy,0,-6.16228,-6.58,-1.16,-5.131494474610941
Cn1cc(-c2ncc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)s2)cn1,C66370728_decoy,CASP3,Decoy,0,-8.31975,-6.16,-1.1,-5.612803851189932
CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N[C@@H]2CCS(=O)(=O)C2)C1=O,C06651816_decoy,CASP3,Decoy,0,-6.98501,-7.13,-0.4,-5.93935806657892
Cc1ccc(C(=O)NNC(=O)CCc2c(C)nc3ncnn3c2C)cc1,C08304711_decoy,CASP3,Decoy,0,-6.84825,-6.58,-1.69,-5.267474149181532
COC(=O)NC(=O)c1c(NC(=O)c2ccno2)sc2c1CCCC2,C09704401_decoy,CASP3,Decoy,0,-7.32604,-6.39,-0.62,-5.606056190718595
O=C(NCc1nnnn1C1CCCCC1)C(=O)c1c[nH]c2ccccc12,C10594287_decoy,CASP3,Decoy,0,-7.14982,-7.61,-1.53,-6.158032162986296
CCNC(=O)NC(=O)[C@H](C)Sc1nnc(N2CCCC2)n1C1CC1,C11377284_decoy,CASP3,Decoy,0,-6.59185,-6.49,-1.36,-5.650837409346125
Cn1c(=O)c2c(ncn2C[C@H](O)CNc2ccccc2Cl)n(C)c1=O,C05728771_decoy,CASP3,Decoy,0,-7.14262,-5.95,-0.86,-5.51989048272267
COc1ccc([C@H]2CC(c3c(O)n(C)c(=S)n(C)c3=O)=NN2)c(OC)c1,C15834664_decoy,CASP3,Decoy,0,-7.67606,-5.75,-1.51,-6.665258777777712
CC1CCN(c2nc([C@@H](C)NC(=O)[C@@H](C)N3CCCC3=O)cc(=O)[nH]2)CC1,C19496977_decoy,CASP3,Decoy,0,-7.01001,-6.26,-0.73,-4.998130269881247
Cc1cccn2cc(C(=O)NCCNC3=NS(=O)(=O)c4ccccc43)nc12,C19718843_decoy,CASP3,Decoy,0,-6.1291,-6.8,-1.91,-5.616074019409966
COC(=O)[C@H]1Cc2nc[nH]c2[C@H](c2ccc(OC)c(OC)c2OC)N1,C20112676_decoy,CASP3,Decoy,0,-6.83344,-4.69,-2.16,-5.7094246165607565
Cc1nn(C/C(N)=N/OC(=O)c2ccnn2C)c(C)c1Br,C20606417_decoy,CASP3,Decoy,0,-7.24172,-6.49,-2.57,-6.187533132765495
CCN1CCN(C(=O)[C@H](C)Sc2nnc(-c3ccoc3C)n2N)CC1,C23006343_decoy,CASP3,Decoy,0,-7.03608,-5.28,-1.68,-5.199344873744721
Cn1ncc(N2CC[C@H](CNC(=O)Cc3n[nH]c4ccccc34)C2)cc1=O,C23337246_decoy,CASP3,Decoy,0,-6.68481,-7.61,-1.54,-5.833911276402932
CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2ccncc2)n1CC,C09494582_decoy,CASP3,Decoy,0,-6.88758,-6.63,-1.69,-5.17207272313684
Cc1cccnc1NC(=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O,C38722811_decoy,CASP3,Decoy,0,-7.59285,-7.44,-3.37,-6.127988399467928
C[C@@H](NC(=O)C1=NN=C(c2cccn2C)C1)C1=CNN(c2ccccn2)[C@H]1C,C39363233_decoy,CASP3,Decoy,0,-6.62192,-7.05,-1.1,-6.676742668549406
Cc1c(C(=O)NC(=S)N[C@@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-],C39841902_decoy,CASP3,Decoy,0,-5.84267,-6.16,-1.12,-5.193646250188929
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NC1CCN(c2ncccn2)CC1,C41453011_decoy,CASP3,Decoy,0,-7.0427,-6.07,-1.95,-6.504715356668554
C[C@@H](Sc1nnnn1C1CCCC1)C(=O)N1CCC[C@@H](C(N)=O)C1,C28146849_decoy,CASP3,Decoy,0,-8.56106,-7.42,-0.63,-6.701353925116349
CC(C)c1nnc(NC(=O)N2CCN(CC(=O)NC3CC3)CC2)s1,C43697170_decoy,CASP3,Decoy,0,-7.66409,-6.51,-2.82,-6.3322663900291785
CS(=O)(=O)c1ccccc1NC(=O)NCCc1nnc2n1CCCCC2,C43928190_decoy,CASP3,Decoy,0,-7.29947,-7.33,-1.2,-5.794025267840711
Cc1cc(C(=O)N2CCC(CNC(=O)C(=O)NC3CCCCC3)CC2)no1,C43942070_decoy,CASP3,Decoy,0,-7.26941,-6.37,-0.97,-5.588367758656191
O=C(NC[C@@H]1COc2ccccc2C1)C(=O)Nc1ccccc1-n1cncn1,C49308990_decoy,CASP3,Decoy,0,-5.79837,-6.96,-1.56,-5.490034070828999
CCOC(=O)c1sc2nc(C)nc(N3CCO[C@@H](C(N)=O)C3)c2c1C,C50956062_decoy,CASP3,Decoy,0,-7.95501,-5.8,-2.32,-6.1689318724663496
O=C(NC1CC1)[C@H]1CCCN(C(=O)NCCc2nnc3n2CCCCC3)C1,C51681321_decoy,CASP3,Decoy,0,-8.23025,-6.95,-0.9,-6.647914894918568
CN1C=N[C@H]([N+](=O)[O-])/C1=[NH+]/Cc1ccc(N2CCC(CO)CC2)cc1,C52446584_decoy,CASP3,Decoy,0,-7.15954,-5.89,-2.2,-5.051536562134761
Cc1c(NC(=O)NCCc2cnn(C)c2)cccc1C(=O)N1CCOCC1,C54507882_decoy,CASP3,Decoy,0,-6.89389,-6.2,-3.98,-5.989930966170823
CNC(=O)Cn1cc(NC(=O)C2(c3ccc4c(c3)OCCO4)CCCC2)cn1,C58537060_decoy,CASP3,Decoy,0,-8.85244,-6.07,-0.8,-6.673710431376154
Cc1nnc([C@@H](C)Sc2n[nH]c(N/N=C/c3ccccc3F)n2)o1,C59879054_decoy,CASP3,Decoy,0,-8.32811,-6.21,-1.18,-5.996278399358066
CN1C(=O)C(=CNNC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N(C)C1=O,C60863197_decoy,CASP3,Decoy,0,-6.73474,-6.56,-2.56,-5.1886865903053
C[C@@H](NC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1)c1ccc(Cl)cc1,C61853966_decoy,CASP3,Decoy,0,-7.44732,-6.13,-2.26,-5.3837431286912505
CC1(C)[C@H]2CC[C@]1(C)[C@@H](NC(=O)C(=O)Nc1ccc(-n3cnnn3)cc1)C2,C62205479_decoy,CASP3,Decoy,0,-6.24276,-6.29,-1.56,-5.084652256096173
C[C@H]1CC=C(c2nc(CC(=O)/N=c3\[nH]nc(-c4ccccn4)[nH]3)cs2)O1,C64111425_decoy,CASP3,Decoy,0,-7.43206,-8.05,-0.87,-5.76921391703894
C[C@@H](S[C@H]1NN=C(C2=NC=CC2)O1)C(=O)N1CC(=O)Nc2ccccc21,C64148017_decoy,CASP3,Decoy,0,-6.58782,-6.72,-0.62,-5.687476769967259
COc1cc(C)c([C@@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1OC,C46614087_decoy,CASP3,Decoy,0,-6.70185,-6.59,-1.89,-6.44493619996395
COCc1nc2n(n1)[C@@H]1NC(=O)C[C@@H](c3ccc(SC)cc3)[C@H]1C(=O)N2,C64435081_decoy,CASP3,Decoy,0,-6.33233,-6.55,-1.16,-5.321496383750412
CNS(=O)(=O)Cc1cccc(CNc2cc(C)nc3ncnn23)c1,C64551134_decoy,CASP3,Decoy,0,-7.37491,-5.72,-1.06,-5.30329026249201
C#CCn1c(O)c(/N=N/C(=O)CNC(=O)c2cccnc2)c2ccccc21,C05789064_decoy,CASP3,Decoy,0,-8.76761,-7.42,-0.59,-8.590315915372173
CC(C)c1ccsc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1,C64742134_decoy,CASP3,Decoy,0,-7.79317,-6.31,-1.93,-6.126569938263646
COC(=O)C1=C[C@H]2CN(C(=O)c3ccccc3-c3ncc[nH]3)CCCN2N1,C65387374_decoy,CASP3,Decoy,0,-7.17977,-7.95,-1.0,-6.922721774471591
CCn1cnnc1Cc1nc2c([nH]1)C[C@@H](c1ccccc1OC)CNC2=O,C65394977_decoy,CASP3,Decoy,0,-6.09684,-6.95,-1.99,-5.68806539023601
C[C@H]1CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC(C)(C)O1,C65607990_decoy,CASP3,Decoy,0,-5.90116,-5.81,-2.14,-5.407606594172817
Cc1ccsc1C(=O)NNC(=O)CCc1c(C)nc2ncnn2c1C,C66557798_decoy,CASP3,Decoy,0,-6.17949,-6.22,-1.23,-5.922944988727359
Cc1occc1C(=O)NC1CCN(C(=O)c2cc(-c3ccco3)[nH]n2)CC1,C66734893_decoy,CASP3,Decoy,0,-7.35653,-6.57,-2.36,-5.547843709104994
Cc1c(C(=O)N[C@@H]2CCC(=O)NC2)nnn1-c1ccc(OC(C)C)cc1,C66834674_decoy,CASP3,Decoy,0,-7.09701,-5.67,-1.09,-5.419795830712234
Cc1c(C(=O)Nc2c[nH]ccc2=O)nnn1-c1ccc(OC(C)C)cc1,C66837210_decoy,CASP3,Decoy,0,-5.88738,-6.32,-1.44,-7.184745582983767
CCn1nc(C)c(CNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)c1C,C67178599_decoy,CASP3,Decoy,0,-7.42582,-6.03,-0.59,-5.807389103529983
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)c1ccc(N2NC(=O)CCC2=O)cc1,C67302794_decoy,CASP3,Decoy,0,-6.07659,-7.62,-2.0,-5.675419269240295
Cc1occc1C(=O)NC1CCN(C(=O)N[C@@H](C)CN2CCCC2=O)CC1,C67358574_decoy,CASP3,Decoy,0,-6.34963,-5.72,-2.88,-4.933922478613424
O=C(Nc1cccc(-n2cnnn2)c1)C(=O)N[C@@H]1CCc2cc(Cl)ccc21,C67430832_decoy,CASP3,Decoy,0,-7.20259,-6.23,-3.24,-6.011718028896508
CCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3c(C)cccn3c2=O)SC1=S,C01446998_decoy,CASP3,Decoy,0,-7.602,-5.51,-3.4,-5.530989177791607
Cc1ccc2nc(COC(=O)/C=C/c3c(C)nn([C@@H]4CCS(=O)(=O)C4)c3Cl)cc(=O)n2c1,C09003966_decoy,CASP3,Decoy,0,-8.25007,-8.05,-1.51,-5.80450517945481
COc1ccc([C@@H]2OCCn3c(-c4ccccc4)c4c(=O)n(C)c(=O)n(C)c4c32)c(OC)c1OC,C09348522_decoy,CASP3,Decoy,0,-7.46148,-5.57,-2.18,-6.218298496339174
Cn1cnc2c1c(=O)n(CC(=O)N(C/C=C/c1ccccc1)c1ccc3c(c1)OCCO3)c(=O)n2C,C09466161_decoy,CASP3,Decoy,0,-8.62876,-7.34,-3.46,-6.957615442683708
COCc1c(Br)c(C)nc(OCC2=NN(C(C)=O)[C@@H](c3ccccc3OC)O2)c1C#N,C09529730_decoy,CASP3,Decoy,0,-7.62246,-6.01,-1.54,-6.038143325776895
COC(=O)c1ccc(N2CCN(C(=O)C[C@@]3(c4ccccc4OC)CC(=O)N(C)C3=O)CC2)cc1,C11785567_decoy,CASP3,Decoy,0,-8.0543,-6.47,-1.67,-7.809652454878126
COc1cc([C@@H]2CC(=O)N(n3c(C)cc(C)c(C#N)c3=O)C3=C2C(=O)CCC3)cc(OC)c1OC,C12446010_decoy,CASP3,Decoy,0,-8.74217,-6.9,-3.44,-7.231625482442876
C[C@H]1CC(=O)[C@@H](CC(=O)N2CCN(S(=O)(=O)c3ccccc3C(F)(F)F)CC2)[C@@H]1C[N+](=O)[O-],C12795011_decoy,CASP3,Decoy,0,-6.73168,-7.43,-3.94,-6.008156468042334
CCOc1cc(C(=O)N2CCN(S(=O)(=O)c3ccc(C)cc3C)CC2)c([N+](=O)[O-])cc1OC,C16600391_decoy,CASP3,Decoy,0,-7.1888,-5.93,-1.15,-5.556112488820184
CC1(C)Cc2cccc(OCC(=O)N3CCN(S(=O)(=O)c4ccccc4[N+](=O)[O-])CC3)c2O1,C20857400_decoy,CASP3,Decoy,0,-6.36949,-8.56,-0.72,-7.124953073915486
O=C([C@H]1CCCN(c2nnc(-n3cccc3)s2)C1)N1CCN(Cc2ccc3c(c2)OCO3)CC1,C15728088_decoy,CASP3,Decoy,0,-8.68806,-6.59,-1.84,-5.500605144545471
COCCCn1c(C)cc(C(=O)CSc2nc(C(C)(C)C)nc3c2c(=O)n(C)c(=O)n3C)c1C,C21470941_decoy,CASP3,Decoy,0,-8.0307,-7.0,-1.0,-5.971767435075965
Cn1c(SCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)nnc1-c1ccc(Cl)cc1,C21761002_decoy,CASP3,Decoy,0,-8.69364,-6.8,-2.29,-5.863663066542071
COc1cc(/C=C2/CN(C)C/C(=C\c3cc(OC)c4c(c3OC)OCO4)C2=O)c(OC)c2c1OCO2,C15106089_decoy,CASP3,Decoy,0,-8.1195,-6.55,-1.76,-7.5974340794665265
Cc1ccc(N2C[C@@H](C(=O)N3CCN(Cc4nnnn4-c4ccc(Cl)cc4)CC3)CC2=O)cc1,C23231959_decoy,CASP3,Decoy,0,-8.15834,-7.66,-1.9,-7.115608424935878
COc1ccc(-n2nnnc2CN2CCN(C(=O)C3c4ccccc4Oc4ccccc43)CC2)cc1,C23233538_decoy,CASP3,Decoy,0,-8.08221,-7.18,-1.55,-6.553435740646129
COc1cc2c(cc1OC)[C@@H]1CN(C(=O)C3CCN(c4nccc(C(F)(F)F)n4)CC3)CC(=O)N1CC2,C23330343_decoy,CASP3,Decoy,0,-8.21986,-6.57,-1.64,-7.972104187701722
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1,C23675296_decoy,CASP3,Decoy,0,-8.7735,-6.87,-2.52,-5.700228387207407
CCCCCn1c(=O)c2ccccc2n2c(SCC(=O)N(C)[C@@H]3CCS(=O)(=O)C3)nnc12,C23884821_decoy,CASP3,Decoy,0,-8.52056,-7.11,-0.93,-8.238700525039969
CCN(C(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1,C24271512_decoy,CASP3,Decoy,0,-9.10407,-6.75,-2.37,-7.100527353266192
O=C(COc1ccccc1[N+](=O)[O-])N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1,C25040262_decoy,CASP3,Decoy,0,-6.76002,-7.23,-1.26,-5.3644635648741685
Cc1cc(CSc2ncccc2C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)no1,C28340151_decoy,CASP3,Decoy,0,-8.02374,-6.5,-3.01,-6.679776307811205
COc1cc(C(=O)N2CCN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CC2)c([N+](=O)[O-])cc1OC,C30916450_decoy,CASP3,Decoy,0,-6.51451,-7.46,-2.46,-6.198831765557017
O=C(CSc1nnnn1C1CCCCC1)N1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1,C12812647_decoy,CASP3,Decoy,0,-7.9224,-8.42,-1.19,-9.683479348865909
CC(=O)N1CCN(C(=O)CSc2nc(Cl)cc(N3CCN(C(=O)C4CCCC4)CC3)n2)CC1,C34879885_decoy,CASP3,Decoy,0,-8.73039,-7.36,-1.09,-7.549562479747992
Cc1cc(/C=C/C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)c(C)n1-c1ccc2c(c1)OCO2,C35279046_decoy,CASP3,Decoy,0,-9.03839,-8.66,-1.77,-6.792356790138864
C=CCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1)C(=O)c1ccc2c(c1)OCO2,C35767091_decoy,CASP3,Decoy,0,-8.10689,-7.32,-2.07,-8.29528714043019
COc1ccc(C(=O)N2[C@H](C(=O)N3CCN(C)CC3)COC23CCN(C(=O)CC(C)(C)C)CC3)cc1,C35986440_decoy,CASP3,Decoy,0,-6.94398,-6.73,-1.96,-6.808093137664371
CCN(CC(=O)N1CCCN(c2ccc(-c3ccccc3)nn2)CC1)C(=O)c1ccc2c(c1)OCO2,C36072730_decoy,CASP3,Decoy,0,-7.90283,-6.66,-2.82,-6.064293823067503
CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N([C@H]4CCS(=O)(=O)C4)C(=O)C(C#N)=C3C)o2)cc1,C36589929_decoy,CASP3,Decoy,0,-7.43622,-9.38,-1.06,-5.880604233125778
CC(C)CN(C[C@H]1CN(C(=O)c2cnc3ccccc3n2)CCO1)C(=O)c1ccc2c(c1)OCO2,C37609805_decoy,CASP3,Decoy,0,-9.1476,-6.14,-1.0,-6.89570590177005
Cc1ccc2occ([C@@H](c3nnnn3C3CCCC3)N3CCN(C(=O)c4ccco4)CC3)c(=O)c2c1,C19219755_decoy,CASP3,Decoy,0,-7.6201,-6.83,-0.86,-5.646867311106875
COc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C(=O)[C@@H]2N=NC4=C2CCCC4)C3)cc1,C39352546_decoy,CASP3,Decoy,0,-7.54275,-6.6,-1.46,-6.474718297113862
CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(CC(C)C)C2=O)CC1,C39716292_decoy,CASP3,Decoy,0,-7.02298,-6.93,-1.46,-6.05776796947884
CCCCn1c(=O)c2ccccc2n2c(SCC(=O)N(C3CC3)[C@H]3CCS(=O)(=O)C3)nnc12,C17718091_decoy,CASP3,Decoy,0,-8.38138,-6.4,-1.47,-8.791016312902105
Cc1cc(-n2c(C)cc(C(=O)OCC(=O)N(C3CCCCC3)[C@@H]3CCS(=O)(=O)C3)c2C)no1,C16695187_decoy,CASP3,Decoy,0,-8.7651,-7.65,-1.71,-6.9101954703235
CCc1cccc2sc(N(Cc3ccccn3)C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)nc12,C36691651_decoy,CASP3,Decoy,0,-7.59535,-7.3,-2.13,-6.40704469969466
CC(=O)N1CCN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(C)cc4C)CC3)cc2[N+](=O)[O-])CC1,C46622199_decoy,CASP3,Decoy,0,-7.78619,-9.13,-1.51,-6.439857201952883
CN(Cc1ccccc1Br)C(=O)Cn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O,C46658854_decoy,CASP3,Decoy,0,-7.01012,-6.74,-1.7,-5.248460833932516
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(Cc1ccc(N2CCCCC2)o1)[C@H]1CCS(=O)(=O)C1,C47131854_decoy,CASP3,Decoy,0,-7.85071,-7.31,-1.27,-7.591324528429244
CCOC(=O)C1CCN(C(=O)c2cc(-c3ccc(C)cc3)nc3c2c(C)nn3[C@H]2CCS(=O)(=O)C2)CC1,C57311761_decoy,CASP3,Decoy,0,-8.31446,-6.99,-1.72,-6.289639018399289
Cc1nc(-c2ccc3ccccc3c2)n(CN2CCN(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)n1,C62588332_decoy,CASP3,Decoy,0,-8.85981,-8.08,-2.09,-8.073882585861133
Cc1noc(C)c1S(=O)(=O)N1CCN([C@H](C)C2=NC(=O)C3=C(c4ccccc4)CSC3=N2)CC1,C39936359_decoy,CASP3,Decoy,0,-8.65532,-7.3,-2.38,-6.655378545159053
COc1cccc(C2=C[C@H](C(=O)N3CCN(S(=O)(=O)c4cc(Cl)ccc4OC)CC3)N=N2)c1,C63561648_decoy,CASP3,Decoy,0,-8.95446,-6.76,-1.38,-6.080506596977552
CCOC(=O)C1=C(C)N=C(C(=O)N2CCC([C@H](C)C(=O)N3CCC4(CC3)OCCO4)CC2)[C@H]1C,C63625528_decoy,CASP3,Decoy,0,-7.12174,-8.01,-2.4,-7.96203918657624
CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2nn(C)c3c2CN(C(=O)c2cccc(OC)c2)CC3)C1,C64565676_decoy,CASP3,Decoy,0,-7.29343,-8.11,-2.0,-7.228256646774424
Cc1cccc(N2CCN(C(=O)C3CCN(S(=O)(=O)[C@H]4C=C[C@@H]([C@@H]5C=CN=N5)O4)CC3)CC2)c1C,C64710783_decoy,CASP3,Decoy,0,-8.77894,-7.31,-1.59,-5.193620107531957
COc1ccccc1-n1ccn2c(SCC(=O)N3CCN(c4ccccc4F)CC3)nnc2c1=O,C46047050_decoy,CASP3,Decoy,0,-8.11915,-7.16,-2.48,-5.940939850821683
CCn1ccc(C(=O)N2CCN(C(=O)c3nc(-c4ccc(N5CCC(C)CC5)cc4)no3)CC2)n1,C64746690_decoy,CASP3,Decoy,0,-8.55011,-7.32,-2.56,-6.049073971153132
CCCn1c(=O)c2c(C(=O)N3CCN(c4ccc(Cl)cc4)CC3)cc(=O)n(CCC)c2n(C)c1=O,C64925908_decoy,CASP3,Decoy,0,-7.75235,-6.61,-4.07,-6.238561618952059
CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C[C@@H]2CCCO2)c1=NC(=O)c1ccncc1,C02496187_decoy,CASP3,Decoy,0,-7.99592,-6.98,-1.48,-7.642365724990707
CC(=O)[C@@]1(C)C(=O)N(S(=O)(=O)c2ccc(C)cc2)C(=O)N1S(=O)(=O)c1ccc(C)cc1,C01703327_decoy,CASP3,Decoy,0,-8.20734,-6.16,-1.51,-5.922332655102155
CC(=O)[C@]1(C)C(=O)N(S(=O)(=O)c2ccc(C)cc2)C(=O)N1S(=O)(=O)c1ccc(C)cc1,C04994366_decoy,CASP3,Decoy,0,-7.52739,-6.86,-3.05,-5.221148664513464
CCOc1ccc(-n2nnnc2S[C@@H](C)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1,C08791493_decoy,CASP3,Decoy,0,-7.10171,-8.42,-1.75,-7.155066622882032
CC(=O)N(c1ccccc1)c1nc(COC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cs1,C08853037_decoy,CASP3,Decoy,0,-7.89106,-7.48,-3.7,-6.473761386436725
CCN(C(=O)[C@@H](C)Sc1nnc(-c2cccnc2)n1Cc1ccco1)[C@H]1CCS(=O)(=O)C1,C09054345_decoy,CASP3,Decoy,0,-9.09262,-6.79,-2.56,-7.346199718733688
Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1,C09220366_decoy,CASP3,Decoy,0,-6.01913,-7.34,-1.62,-5.61867207509111
O=C(Cn1nc(-c2cccs2)oc1=O)N1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1,C09365680_decoy,CASP3,Decoy,0,-7.56716,-7.8,-2.29,-7.0673704485795295
Cc1cc(C(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c(C)n1-c1ccc2c(c1)OCCO2,C09285835_decoy,CASP3,Decoy,0,-8.50283,-7.23,-1.75,-6.229999379100409
Cc1cc(C(=O)CSc2nnc([C@@H]3CCS(=O)(=O)C3)n2C)c(C)n1[C@@H]1CCS(=O)(=O)C1,C09593437_decoy,CASP3,Decoy,0,-9.45045,-7.24,-1.02,-7.698033059412519
COc1ccc(-n2nnc3c(N4CCN(C(=O)c5ccccc5SC)CC4)ncnc32)cc1,C09850460_decoy,CASP3,Decoy,0,-7.41358,-7.56,-0.68,-6.069440270183661
Cc1cc(C(=O)CSc2nnc([C@@H]3COc4ccccc4O3)o2)c(C)n1[C@H]1CCS(=O)(=O)C1,C09952864_decoy,CASP3,Decoy,0,-7.91224,-6.51,-4.2,-5.903157492637551
COC(=O)c1c(OCCc2ccsc2)cc(=O)n2c1CCN(C(=O)Cn1ccc(C)n1)CC2,C12052075_decoy,CASP3,Decoy,0,-9.87544,-6.08,-2.69,-7.342683358352774
COc1ccc(Cn2nnnc2SCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)cc1,C12600953_decoy,CASP3,Decoy,0,-7.58504,-7.32,-1.94,-5.8574341048334615
COc1cc(OC)c(N2C[C@@H](C(=O)O[C@@H](C)C(=O)N3C[C@@H](C)O[C@@H](C)C3)CC2=O)cc1Cl,C12774883_decoy,CASP3,Decoy,0,-8.24755,-7.09,-2.33,-6.927095322760716
C[C@@H](OC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1,C12850640_decoy,CASP3,Decoy,0,-9.29211,-7.26,-3.02,-7.463681148332502
Cc1cc(C(=O)CSc2nnc(C[C@H]3CCS(=O)(=O)C3)o2)c(C)n1[C@H]1CCS(=O)(=O)C1,C12879930_decoy,CASP3,Decoy,0,-8.83731,-6.51,-0.74,-6.992401001354777
Cc1cc(C(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)c(C)n1C[C@H]1CCCO1,C13163472_decoy,CASP3,Decoy,0,-7.50883,-8.19,-1.2,-6.815950438890841
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)CCn1nc(-c2cccs2)oc1=O,C14068646_decoy,CASP3,Decoy,0,-8.69511,-8.12,-0.7,-6.5526262811973215
Cc1cc(C(=O)N2CCc3c(c(C(=O)N4CCCCC4)nn3CCCc3cccnc3)C2)nc(C)n1,C14535002_decoy,CASP3,Decoy,0,-8.22201,-7.63,-1.31,-6.076662025151566
CCn1nc(C(=O)N2CCN(c3ccccc3)CC2)c2c1CCN(C(=O)[C@H]1CC(=O)N(C(C)C)C1)C2,C14535901_decoy,CASP3,Decoy,0,-7.71761,-6.31,-1.49,-7.021923471289034
CN(C[C@@H]1COCCO1)C(=O)[C@H]1CCCN(c2cccc3c2C(=O)N(c2ccc4c(c2)COC4)C3=O)C1,C14972338_decoy,CASP3,Decoy,0,-7.68668,-6.67,-2.22,-5.926920156511145
CCN(C(=O)[C@H](C)Sc1nnc(COc2ccc(OC)cc2)n1C)[C@@H]1CCS(=O)(=O)C1,C16797726_decoy,CASP3,Decoy,0,-7.75686,-6.86,-2.57,-8.212346429148218
N#CCCN(Cc1ccco1)C(=O)CSc1nnc(N2CCOCC2)n1-c1cccc(F)c1,C19354322_decoy,CASP3,Decoy,0,-8.20817,-6.9,-1.83,-8.848400528131428
COc1ccccc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O,C19703396_decoy,CASP3,Decoy,0,-6.61606,-8.31,-2.76,-7.108582832463352
CS(=O)(=O)N(Cc1nnc(SCC(=O)N2CCOCC2)n1-c1ccccc1)c1ccc(F)cc1,C20416260_decoy,CASP3,Decoy,0,-8.33414,-7.88,-3.35,-7.753241302783247
CCOC(=O)C1CCN(C(=O)Cn2cc3c(n2)-c2c(oc(C(=O)N4CCCC4)c2C)CC3)CC1,C20510588_decoy,CASP3,Decoy,0,-8.59801,-7.02,-2.02,-6.434397089399454
Cc1ccc(-n2c(S[C@H](C)C(=O)N(C)[C@H]3CCS(=O)(=O)C3)nnc2N2CCOCC2)cc1,C20977536_decoy,CASP3,Decoy,0,-8.96762,-7.05,-1.71,-7.271030828224963
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1,C21203147_decoy,CASP3,Decoy,0,-6.52627,-6.77,-2.38,-5.300879902480021
O=C(CSc1nnc(C2CCCCC2)o1)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1,C22889769_decoy,CASP3,Decoy,0,-8.39473,-7.58,-3.34,-6.184954634762514
CCOC(=O)Cc1c(C)nc2ncnn2c1N1CCN(C(=O)c2c(F)cc(F)cc2F)CC1,C23440383_decoy,CASP3,Decoy,0,-8.0838,-6.8,-1.49,-7.02698148622648
CC(C)(C)n1nnnc1SCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1,C24503219_decoy,CASP3,Decoy,0,-8.24792,-7.72,-2.77,-5.9946721135432215
COc1cc(C)c(C)cc1S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1N1CCN(c2ncccn2)CC1,C32536824_decoy,CASP3,Decoy,0,-9.44635,-7.52,-2.67,-7.759624191771017
COc1cc(OC)cc(C(=O)N2CCC3(CC2)SCCN3C(=O)c2ccc([N+](=O)[O-])cc2)c1,C35463172_decoy,CASP3,Decoy,0,-7.76164,-7.95,-1.9,-6.549718277936458
CN(c1ccc(F)cc1)S(=O)(=O)N1CCC[C@H](C(=O)N2CCN(c3ncccn3)CC2)C1,C37443813_decoy,CASP3,Decoy,0,-8.52567,-6.65,-0.87,-7.857877964825119
COc1ccc([C@@H](c2nnnn2C2CCCC2)N2CCN(C(=O)c3ccco3)CC2)cc1OC,C13503925_decoy,CASP3,Decoy,0,-7.9291,-6.35,-1.17,-6.20414807924591
C/C=C/C(=O)N1CCN(C(=O)c2cn(CCCOC)cc3c(=O)n(-c4ccccc4)nc2-3)CC1,C38485106_decoy,CASP3,Decoy,0,-6.80859,-5.88,-1.04,-5.66069219906386
Cc1cccc2sc(N(Cc3cccnc3)C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)nc12,C36676031_decoy,CASP3,Decoy,0,-6.69416,-6.62,-2.11,-5.45181900645726
COC1=CC(=O)N2CCN(C(=O)[C@@H]3C=C(C4CC4)N=N3)CC[C@@H]2[C@H]1C(=O)N(C)Cc1ccsc1,C39358409_decoy,CASP3,Decoy,0,-8.77356,-6.22,-2.18,-6.814447321992228
CCOC(=O)C1=C(C(=O)COC(=O)[C@H]2Cc3ccccc3CN2S(C)(=O)=O)C(C)=N[C@H]1C,C39560512_decoy,CASP3,Decoy,0,-8.58239,-7.33,-2.09,-6.93002048417171
CCOC(=O)C1=C(C)N=C(C(=O)C(=O)N2CCN(C(=O)c3ccco3)CC2)[C@@H]1c1ccc(F)cc1,C39705037_decoy,CASP3,Decoy,0,-7.16161,-8.02,-2.11,-6.669670072170356
Cc1noc(C)c1S(=O)(=O)N1CCN(CC(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)CC1,C14022254_decoy,CASP3,Decoy,0,-8.939,-6.26,-2.39,-6.074894052157561
Cc1ccnn1-c1cc(N2CCC(C(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)CC2)ncn1,C40853898_decoy,CASP3,Decoy,0,-9.35162,-7.77,-1.14,-9.628883157326277
N#CC1(c2ccc(-c3c(F)cc(N4C[C@H](Cn5ccnn5)OC4=O)cc3F)cn2)[C@@H]2CS(=O)(=O)C[C@@H]21,C40950363_decoy,CASP3,Decoy,0,-8.82357,-8.77,-1.77,-6.1501171303101065
COc1cccc(-c2nc(CN3N=N[C@@H]4C(=O)N(c5ccc(F)cc5)C(=O)[C@@H]43)c(C)o2)c1OC,C20989069_decoy,CASP3,Decoy,0,-7.47922,-7.37,-1.29,-6.068675161948794
COC(=O)CC1=NC(SCC(=O)N2N=C(c3ccc(C)cc3)C[C@@H]2c2ccco2)=NC(=O)C1,C63908615_decoy,CASP3,Decoy,0,-7.43496,-8.4,-2.86,-6.8521085480818495
CCOC(=O)C1=C2C(=O)N=C(CN3CCN(c4ccc(C(F)(F)F)cn4)CC3)N=C2O[C@H]1C,C64046602_decoy,CASP3,Decoy,0,-8.20384,-6.3,-1.37,-7.033507898559383
Cc1cccc(N2CCN(C(=O)C3CCN(S(=O)(=O)[C@@H]4C=C[C@@H]([C@@H]5C=CN=N5)O4)CC3)CC2)c1,C64711092_decoy,CASP3,Decoy,0,-7.622,-7.46,-1.97,-5.340768566003665
Cc1cccc(N2CCN(S(=O)(=O)[C@H]3C=NC(c4nnc(C(=O)N5CCCC5)o4)=C3)C[C@@H]2C)c1,C65035225_decoy,CASP3,Decoy,0,-8.62628,-7.37,-1.69,-6.347923768898578
CC(=O)c1ccc(N2CCN(C(=O)c3cn(-c4ccc(S(=O)(=O)N(C)C)cc4)cn3)CC2)cc1,C65131150_decoy,CASP3,Decoy,0,-9.14404,-6.33,-1.35,-6.237526482628025
Cc1ccc(Cn2cc(-n3c(S)nnc3[C@H]3CCCN(S(=O)(=O)c4cnn(C)c4)C3)cn2)cc1,C02808601_decoy,CASP3,Decoy,0,-9.82243,-7.57,-2.44,-7.451491796431436
COc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-],C08843094_decoy,CASP3,Decoy,0,-6.46892,-7.23,-2.08,-6.617855950185867
Cn1cnnc1Sc1ccc(C(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-],C08881632_decoy,CASP3,Decoy,0,-4.52929,-6.78,-1.13,-5.071854471438711
CN(C(=O)COC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)[C@@H]1CCS(=O)(=O)C1,C09792014_decoy,CASP3,Decoy,0,-8.36032,-7.26,-0.54,-7.308336914797028
CN(C(=O)COC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)[C@H]1CCS(=O)(=O)C1,C09792019_decoy,CASP3,Decoy,0,-8.28844,-6.55,-1.52,-6.695671097279849
CCOc1ccc(-n2nnc3c(N4CCN(C(=O)c5ccc6c(c5)OCO6)CC4)ncnc32)cc1,C09851345_decoy,CASP3,Decoy,0,-8.1072,-7.0,-0.94,-5.526881512626254
O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCN(c2ncnc3c2nnn3Cc2ccccc2)CC1,C09851828_decoy,CASP3,Decoy,0,-7.96917,-7.74,-1.7,-5.288792908242264
COc1ccc(-n2nnc3c(N4CCN(C(=O)c5ccccc5S(C)(=O)=O)CC4)ncnc32)cc1,C10256421_decoy,CASP3,Decoy,0,-8.7318,-6.56,-1.9,-5.814150909533997
O=C([C@@H]1CC(=O)N(c2cccc(F)c2)C1)N1CCN(c2ncnc3c2nnn3Cc2ccccc2)CC1,C10256485_decoy,CASP3,Decoy,0,-8.81679,-7.23,-2.35,-6.039073102468861
CC(=O)N1CCN(c2ccc(C(=O)N(C)Cc3cnn(Cc4ccccc4)c3)cc2[N+](=O)[O-])CC1,C11083699_decoy,CASP3,Decoy,0,-7.86121,-6.39,-0.86,-6.127987048377678
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)c1cc(C(C)C)nn1C)CC2,C11791008_decoy,CASP3,Decoy,0,-8.12748,-5.98,-2.84,-6.224941068843566
COC(=O)c1c(OCc2ccccn2)cc(=O)n2c1CCN(C(=O)[C@@H]1CC(=O)N(C(C)C)C1)CC2,C12190823_decoy,CASP3,Decoy,0,-8.88835,-6.24,-2.13,-6.536076349140099
Cc1ccc(-n2nnc3c(N4CCN(C(=O)c5ccc(S(=O)(=O)N(C)C)cc5)CC4)ncnc32)cc1,C12310228_decoy,CASP3,Decoy,0,-7.18186,-7.15,-2.02,-5.805249513491152
COC(=O)c1c(OC(C)C)cc(=O)n2c1CCN(C(=O)[C@H]1CC(=O)N(Cc3ccccn3)C1)CC2,C12152775_decoy,CASP3,Decoy,0,-6.48776,-6.15,-3.13,-5.760609130468353
COc1ccc(-n2ncc3c(SCC(=O)N4CCN(C(=O)c5ccco5)CC4)ncnc32)cc1,C01357361_decoy,CASP3,Decoy,0,-7.29506,-7.07,-3.23,-5.354404430081416
CC[C@@H](C)N(C(=O)COC(=O)Cc1c(C)nc2nc(SC)nn2c1C)[C@H]1CCS(=O)(=O)C1,C19614975_decoy,CASP3,Decoy,0,-6.83173,-8.11,-2.85,-5.714581782016071
O=C([C@@H]1CCCN1c1nnc(N2CCCC2=O)s1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C21025942_decoy,CASP3,Decoy,0,-7.71501,-6.95,-1.8,-5.981468853404965
O=C([C@@H]1CCCN(c2nnc(N3CCCC3=O)s2)C1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C21026269_decoy,CASP3,Decoy,0,-8.85713,-6.65,-2.0,-5.730250720987067
CSc1nc2nc(C)c(CC(=O)N3CCN(Cc4nc(-c5cccs5)no4)CC3)c(C)n2n1,C21073515_decoy,CASP3,Decoy,0,-10.7432,-6.86,-1.12,-6.6630885294330495
Cc1cc(C(=O)COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)n1[C@H]1CCS(=O)(=O)C1,C21421247_decoy,CASP3,Decoy,0,-7.38896,-6.95,-1.13,-6.957010346744392
C[C@@H]1CN(C(=O)CSc2nc(-c3cccc([N+](=O)[O-])c3)nc3c2c(=O)n(C)c(=O)n3C)C[C@H](C)O1,C13956734_decoy,CASP3,Decoy,0,-6.58189,-7.58,-3.1,-6.928605075066195
CCOc1ccc(N2C[C@H](C(=O)N3CCN(Cc4nnnn4-c4ccc(F)cc4)CC3)CC2=O)cc1,C23232368_decoy,CASP3,Decoy,0,-8.17165,-6.46,-0.98,-8.129783156126583
CCOc1ccc(-n2nnnc2CN2CCN(C(=O)Cc3ccc(OC)c(OC)c3)CC2)cc1,C23233810_decoy,CASP3,Decoy,0,-7.46357,-6.89,-1.72,-6.275573830982529
CSc1nc2nc(C)c(CC(=O)N3CCN(Cc4cc(=O)n5ccsc5n4)CC3)c(C)n2n1,C23865931_decoy,CASP3,Decoy,0,-10.4549,-6.48,-4.37,-7.14328640288935
CCOc1ccccc1-n1nnnc1SCC(=O)N1CCN([C@H]2CCS(=O)(=O)C2)CC1,C24138610_decoy,CASP3,Decoy,0,-8.28175,-7.75,-1.36,-7.559067594870882
O=C(C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1,C25105616_decoy,CASP3,Decoy,0,-7.95909,-7.58,-1.75,-6.135665417141233
CCn1c(CN2CCN(c3ncnc4c3cnn4C)CC2)nc2cc(S(=O)(=O)N(C)C)ccc21,C14813333_decoy,CASP3,Decoy,0,-8.55021,-7.02,-2.57,-6.391816694064783
O=C(c1cccc([N+](=O)[O-])c1)[C@H](C(=O)N1CCC(C(=O)N2CCCCC2)CC1)n1ccccc1=O,C27830754_decoy,CASP3,Decoy,0,-7.18304,-6.69,-3.6,-6.060053941046899
O=C(CSc1nnnn1-c1cccc(F)c1)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1,C29990456_decoy,CASP3,Decoy,0,-7.46718,-7.5,-3.57,-5.372155149079761
Cn1c(SCC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)nnc1[C@@H]1CCS(=O)(=O)C1,C32777872_decoy,CASP3,Decoy,0,-8.98366,-6.26,-1.96,-6.657793675354256
Cc1nc(C)c(C(=O)OCC(C)C)c(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H](C)C2)n1,C35174145_decoy,CASP3,Decoy,0,-7.25696,-5.72,-2.51,-5.716423079897445
CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)c2cc(OC)cc(OC)c2)[C@H](C)C1,C35175254_decoy,CASP3,Decoy,0,-7.67278,-6.61,-1.67,-5.754930501189865
CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1,C35175287_decoy,CASP3,Decoy,0,-6.19694,-6.28,-2.01,-5.702705224052463
C[C@@]1(Cn2cnnn2)[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C[C@@H]2S1(=O)=O,C35565012_decoy,CASP3,Decoy,0,-6.40748,-7.3,-1.35,-5.884973884656559
CC[C@@H](C)N1Cc2c(n(CC(=O)N3CCN(C(C)=O)CC3)c3cc(C(C)(C)C)nn3c2=O)C1=O,C35943943_decoy,CASP3,Decoy,0,-7.40411,-7.69,-2.81,-6.666994481824785
COc1cc2c(cc1OC)CN(C(=O)Cn1cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c1=O)CC2,C36832255_decoy,CASP3,Decoy,0,-6.67222,-6.57,-1.21,-7.325244271918955
COc1cc(C(=O)N2CCN(c3cc(N4C[C@@H](C)O[C@@H](C)C4)ncn3)CC2)c([N+](=O)[O-])cc1OC,C38528914_decoy,CASP3,Decoy,0,-7.61274,-7.19,-2.76,-5.981834908688931
COc1cccc(OC)c1C(=O)N1CCN(C(=O)c2nc(C)nc(C)c2C(=O)OC(C)C)C[C@@H]1C,C40362080_decoy,CASP3,Decoy,0,-7.24903,-6.72,-3.88,-6.669278416070375
CC(C)n1c(N2CCCN(C(=O)[C@H](C)N3C(=O)COc4ccccc43)CC2)cc(=O)n(C(C)C)c1=O,C21703460_decoy,CASP3,Decoy,0,-7.47336,-6.42,-3.74,-5.789083515600708
COc1cc(-c2ccnc(N3CCN(C(=O)[C@]45CC[C@](C)(C(=O)O4)C5(C)C)CC3)n2)cc(OC)c1OC,C43506273_decoy,CASP3,Decoy,0,-8.47372,-6.48,-1.98,-5.559350548978664
COc1cc(C(=O)OCC(=O)N2CCN(C(=O)c3ccco3)CC2)c([N+](=O)[O-])cc1OC(F)F,C45660967_decoy,CASP3,Decoy,0,-6.24504,-6.9,-2.04,-7.688104372570242
CN(Cc1ccco1)C(=O)COC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1,C45766771_decoy,CASP3,Decoy,0,-7.8916,-8.06,-1.67,-6.245106783785908
COc1nn(C)cc1C(=O)N1CCC(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)CC1,C56906653_decoy,CASP3,Decoy,0,-8.15256,-6.51,-1.28,-5.573232011971866
COc1cccc(C2=C[C@H](C(=O)N3CCN(C(=O)c4cc(OC)c(OC)c(OC)c4)CC3)N=N2)c1,C63562391_decoy,CASP3,Decoy,0,-7.93807,-6.26,-2.07,-5.796481712319469
COC(=O)C1=CC2=NC(COC(=O)c3sc4nc5n(c(=O)c4c3C)CCC5)=NC(=O)C2=CC1,C40083852_decoy,CASP3,Decoy,0,-8.52563,-7.5,-0.56,-6.169782216843844
COc1ccc(-c2noc(CN3N=N[C@H]4C(=O)N(c5ccc(F)c(F)c5)C(=O)[C@H]43)n2)cc1OC,C64565381_decoy,CASP3,Decoy,0,-7.39621,-6.74,-1.43,-5.571109042804437
CCOC(=O)C1CCN(C(=O)c2nc(-c3nn(-c4ccc(F)cc4)c(=O)n(C)c3=O)no2)CC1,C45946058_decoy,CASP3,Decoy,0,-8.02995,-7.91,-1.53,-6.593510237609125
COc1ccccc1N1CCN(C(=O)C2CCN(S(=O)(=O)[C@H]3C=C[C@H]([C@@H]4C=CN=N4)O3)CC2)CC1,C64710707_decoy,CASP3,Decoy,0,-9.59214,-7.12,-1.02,-6.351985334680534
O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ncccn4)CC3)c2)o1)N1CCCC1,C65098861_decoy,CASP3,Decoy,0,-9.34113,-8.04,-1.68,-7.202490443770902
O=C(c1nnc(-c2csc(S(=O)(=O)N3CCN(c4ncccn4)CC3)c2)o1)N1CCCCC1,C65098998_decoy,CASP3,Decoy,0,-8.55959,-8.43,-1.45,-7.091039184463955
COc1cc(OC)cc(C(=O)/N=C2\SCCN2C(=O)c2cc(OC)cc(OC)c2)c1,C08920566_decoy,CASP3,Decoy,0,-7.95372,-5.88,-2.21,-7.271503497342801
COc1ccc(N2CCN(C(=O)c3nn(-c4ccc(F)cc4)c(=O)cc3OC)CC2)cc1,C09573787_decoy,CASP3,Decoy,0,-7.07786,-6.34,-1.36,-5.781935465631137
O=C1S/C(=C\c2cccs2)C(=O)N1CC(=O)N1CCCc2cc([N+](=O)[O-])ccc21,C10538503_decoy,CASP3,Decoy,0,-6.44409,-6.19,-3.59,-5.24530850949889
COc1ccc(-c2ccc(N3CCN(S(=O)(=O)c4cccs4)CC3)nn2)cc1OC,C11695364_decoy,CASP3,Decoy,0,-9.70313,-6.04,-1.9,-6.321904905457357
COC(=O)c1c(OC2Cc3ccccc3C2)cc(=O)n2c1CCN(C(=O)[C@@H]1CCCO1)CC2,C11910004_decoy,CASP3,Decoy,0,-9.02773,-6.49,-2.25,-6.447298119665393
COc1cc(OC)c(C2=CCN(C(=O)C3CCN(C(=O)c4ccco4)CC3)CC2)c(OC)c1,C11918821_decoy,CASP3,Decoy,0,-8.36167,-6.73,-1.73,-6.27031317757631
COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)cc1OC,C12371191_decoy,CASP3,Decoy,0,-6.0072,-7.01,-2.31,-6.033520163731449
O=C(O[C@@H](C(=O)N1CCCCC1)c1ccccc1)C1=CN2CCS(=O)(=O)N=C2C=C1,C12818922_decoy,CASP3,Decoy,0,-9.35237,-7.4,-1.79,-7.374477590816464
CCOc1cc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)c([N+](=O)[O-])cc1OC,C12995212_decoy,CASP3,Decoy,0,-5.67411,-5.92,-1.69,-5.160297924852824
COc1ccc2c(C)cc3nnc(SCC(=O)N(C)[C@@H]4CCS(=O)(=O)C4)n3c2c1,C13038670_decoy,CASP3,Decoy,0,-8.26319,-6.15,-1.1,-6.865672954082693
O=C(CSc1nnc(-c2ccccc2F)n1C1CC1)N1CCN(C(=O)c2ccco2)CC1,C13114609_decoy,CASP3,Decoy,0,-7.85366,-6.5,-1.07,-5.809269929662706
O=C(c1ccc(Cl)c(N2CCCC2=O)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1,C14893448_decoy,CASP3,Decoy,0,-7.56503,-6.88,-3.42,-6.662540926879258
O=C(c1cnn(-c2nccc(-c3ccc4c(c3)OCO4)n2)c1C1CC1)N1CCCCCC1,C15006509_decoy,CASP3,Decoy,0,-8.54657,-7.59,-1.65,-8.339664616413678
CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)CSc1nnc2ccccn12,C16804488_decoy,CASP3,Decoy,0,-4.97691,-7.33,-1.56,-5.9960781276565935
Cn1c(=O)c2c(ncn2CCC(=O)Oc2ccc(I)cc2)n(C)c1=O,C18229250_decoy,CASP3,Decoy,0,-6.32356,-5.67,-1.08,-3.9458417330402784
O=C(c1ccc2c(c1)CCCC2)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1,C21203140_decoy,CASP3,Decoy,0,-5.80433,-9.0,-2.26,-7.580209827731663
O=C(c1cc(-c2ccc3c(c2)OCCO3)on1)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1,C21524223_decoy,CASP3,Decoy,0,-8.91349,-6.18,-1.54,-6.049092188127188
COC(=O)c1cccc2c1CCCN2C(=O)Cc1c(C)nc2nc(C(F)(F)F)nn2c1C,C25194466_decoy,CASP3,Decoy,0,-6.38348,-7.13,-2.9,-5.526608776138841
O=C(CSc1nncn1-c1cccc(Cl)c1)N1CCC[C@H](c2nnc3ccccn23)C1,C27074354_decoy,CASP3,Decoy,0,-6.2094,-8.6,-0.98,-5.909395234546016
COc1cc(OC)c(C2=CCN(C(=O)c3cc4cnn(C(C)C)c4nc3C)CC2)c(OC)c1,C28338203_decoy,CASP3,Decoy,0,-7.59411,-5.97,-3.13,-6.721388645678826
O=C(c1ccc(F)cc1)N1CCC[C@@H](C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1,C31487082_decoy,CASP3,Decoy,0,-6.06988,-6.82,-1.93,-5.260391049287123
CN(Cc1nc2ccccc2n1C(F)F)C(=O)Cn1cnc2c(oc3ccccc32)c1=O,C32753513_decoy,CASP3,Decoy,0,-6.68045,-8.08,-2.48,-6.598296548765371
O=C([C@H]1CCCN(c2nc3cccnc3s2)C1)N1CCN(Cc2ccc3c(c2)OCO3)CC1,C33045122_decoy,CASP3,Decoy,0,-10.5177,-7.28,-1.35,-6.899355839747047
CC(=O)Oc1ccc(C(=O)[C@H]2[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@H]3[C@@H]3C=CC=NN32)cc1,C18022672_decoy,CASP3,Decoy,0,-8.613,-6.84,-2.28,-6.741736608383303
COc1ccc(-n2ncc3c(N4CCN(C(=O)c5ccccc5Cl)CC4)nc(C)nc32)cc1,C35644320_decoy,CASP3,Decoy,0,-7.59809,-6.61,-2.02,-5.328899728298361
Cc1nn(C)cc1-c1nn(S(=O)(=O)c2ccccc2)c(-c2cn(C)nc2C)c1Cl,C36611617_decoy,CASP3,Decoy,0,-6.49404,-5.98,-3.13,-4.783501993777978
COc1ccc(N2CCN(C(=O)[C@@H]3CN(S(C)(=O)=O)c4cc(Cl)ccc4O3)CC2)cc1,C38851197_decoy,CASP3,Decoy,0,-7.67201,-6.26,-3.56,-5.957335099523457
O=C([C@H]1C=C(C2CC2)N=N1)N1CC(=O)N(C2CCCCC2)C[C@@H](OCc2ccccn2)C1,C39344709_decoy,CASP3,Decoy,0,-7.78187,-8.43,-2.4,-7.159772270870959
C[C@H]1CCc2c(sc3ncnc(OCC(=O)N4CCN(C(=O)c5ccco5)CC4)c23)C1,C03599766_decoy,CASP3,Decoy,0,-7.84784,-6.77,-4.36,-7.0340908656178245
CC(=O)N1CCN(C(=O)[C@@H]2CCCN(c3ccc(-c4noc(C(C)C)n4)cc3F)C2)CC1,C40876996_decoy,CASP3,Decoy,0,-8.25883,-7.14,-1.39,-5.825974743100977
CC(=O)OC[C@]12C(=O)C[C@@H](C)[C@]3(C[C@@H](c4ccoc4)O[C@H]3OC(C)=O)[C@@H]1CCC[C@]21CO1,C43510204_decoy,CASP3,Decoy,0,-6.77226,-5.73,-3.59,-6.474310143182386
COC(=O)[C@H]1C[C@H](OC(C)=O)C(=O)[C@@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C,C44832129_decoy,CASP3,Decoy,0,-8.0444,-6.23,-0.66,-6.537260047199703
Cn1ccnc1SCc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)o1,C45934546_decoy,CASP3,Decoy,0,-8.83832,-7.55,-2.56,-7.372116647941926
Cc1cnc2c(S(=O)(=O)N3CCN(Cc4nc(C(C)(C)C)no4)CC3)cccc2c1,C46720902_decoy,CASP3,Decoy,0,-8.48205,-8.01,-2.02,-6.233953904368387
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC(c2nc3ccccc3o2)CC1,C48302846_decoy,CASP3,Decoy,0,-7.45176,-8.59,-2.38,-11.539043539678554
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2c4ccccc4C=CN2[C@@H]3C(=O)c2ccco2)cc1,C15989229_decoy,CASP3,Decoy,0,-8.79435,-6.68,-2.15,-6.922983006402321
COc1ccc(C(=O)[C@@H]2[C@@H]3C(=O)N(c4ccc(C)cc4C)C(=O)[C@@H]3[C@H]3C=CC=NN32)cc1OC,C09190751_decoy,CASP3,Decoy,0,-7.93517,-6.32,-1.43,-6.830325460125818
COC(=O)Cc1c(C)c2cc3c(c(C)c2oc1=O)OCN([C@@]1(C)CCS(=O)(=O)C1)C3,C57151476_decoy,CASP3,Decoy,0,-8.19523,-6.71,-1.29,-7.154579483539806
Cc1noc(C)c1CN1CCN(C(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)CC1,C58977885_decoy,CASP3,Decoy,0,-9.95093,-6.54,-4.2,-7.390830332491342
COc1ccc(-c2nnn(Cc3cc4c(cc3Br)OCCO4)n2)cc1OC,C58994594_decoy,CASP3,Decoy,0,-8.70728,-6.46,-2.45,-5.941145600981668
COc1ccc(C(=O)[C@@H]2[C@@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@@H]3C=CC=NN23)cc1OC,C15987434_decoy,CASP3,Decoy,0,-6.5806,-7.06,-4.83,-5.017336774358216
Cn1nc(Br)c2c(Sc3nnc(-c4ccncc4)n3C3CC3)ncnc21,C60378700_decoy,CASP3,Decoy,0,-7.68628,-5.71,-0.69,-5.566555889156769
O=C([C@H]1CCCN(c2ccc(-n3ccnc3)nn2)C1)N1CCN(c2ccc(F)cc2)CC1,C62164533_decoy,CASP3,Decoy,0,-7.66642,-6.17,-1.28,-5.035250085268434
COc1ccc(C(=O)[C@@H]2[C@@H]3C(=O)N(c4ccc(C)cc4)C(=O)[C@@H]3[C@@H]3C=CC=NN23)cc1OC,C16039302_decoy,CASP3,Decoy,0,-6.67909,-6.29,-1.92,-4.80818309093925
COc1ccc(C(=O)[C@H]2[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@H]3C=CC=NN32)cc1OC,C08738810_decoy,CASP3,Decoy,0,-8.92778,-7.83,-1.14,-7.47958897167813
COc1ccc(N2CCN(C(=O)[C@@H](C)n3c4ccccc4c4cnn(C)c(=O)c43)CC2)cc1,C64775985_decoy,CASP3,Decoy,0,-8.66276,-7.85,-1.67,-6.756082265898216
Cc1nn(-c2cc(N(C)C)ncn2)c(C)c1CCC(=O)N1CCN(c2ccccc2F)CC1,C64925250_decoy,CASP3,Decoy,0,-7.29713,-6.99,-0.57,-5.530016965266539
O=C(c1nnc(-c2csc(S(=O)(=O)N3CCc4ccccc43)c2)o1)N1CCCCC1,C65098931_decoy,CASP3,Decoy,0,-7.6428,-7.56,-0.87,-5.559577392098151
CCn1nccc1C(=O)N1CCCN(C2=NS(=O)(=O)C(c3ccc(C)cc3)=C2C)CC1,C65239461_decoy,CASP3,Decoy,0,-6.9581,-6.32,-1.83,-5.585440109693301
Cc1nc(-c2ccccc2)sc1C(=O)N1CCN(c2cc(-n3cccn3)ncn2)CC1,C65364149_decoy,CASP3,Decoy,0,-8.94355,-7.24,-1.17,-6.371579331589421
C[C@H]1CO[C@@H](c2ccco2)O1,C01674309_decoy,CASP3,Decoy,0,-4.82185,-4.01,-0.12,-2.391602257562637
Cc1nnc(N(C)C)nc1C,C01728544_decoy,CASP3,Decoy,0,-4.69389,-3.9,-0.73,-3.3356919287864266
CC1=CC=NN2C(=O)[C@H](C)[C@H]2C1,C05811827_decoy,CASP3,Decoy,0,-5.31928,-4.46,-0.28,-3.169059010434255
Cn1cc(-c2ccncc2)cn1,C01501838_decoy,CASP3,Decoy,0,-4.54249,-3.52,-0.02,-3.053555858875391
O=C1CCN2C=CSC2=N1,C01655490_decoy,CASP3,Decoy,0,-5.54815,-3.14,-0.15,-2.194708422833156
O=S1(=O)C[C@H]2[C@@H]1[C@@H]1C=C[C@H]2O1,C01705820_decoy,CASP3,Decoy,0,-6.04153,-4.88,-0.4,-3.872415535617544
N#CS[C@@H]1CS(=O)(=O)C=C1Cl,C04575221_decoy,CASP3,Decoy,0,-6.47825,-4.31,-0.15,-4.903436576749735
O=Cc1ccc(-n2ccnc2)c(F)c1,C12505546_decoy,CASP3,Decoy,0,-4.75876,-4.64,-0.59,-3.961746768855273
CC1(C)O[C@@H]2[C@@H]([C@@H]3CO3)OC[C@@H]2O1,C12857072_decoy,CASP3,Decoy,0,-4.82573,-3.94,0.03,-3.598862306268023
Brc1ccc2nnnn2c1,C16124908_decoy,CASP3,Decoy,0,-4.62223,-3.27,-0.16,-2.5334147175637622
C[C@@]12C(=O)OC[C@@H]1[C@]1(C)CC[C@H]2O1,C17111191_decoy,CASP3,Decoy,0,-5.02866,-4.11,-0.75,-2.0030318009052324
CN(C)[C@H](C#N)c1ccncc1,C19934009_decoy,CASP3,Decoy,0,-4.14559,-3.8,-0.29,-3.265985176824474
Cc1nccc([N+](=O)[O-])c1C,C21299925_decoy,CASP3,Decoy,0,-3.23547,-3.51,-0.38,-2.3651978531521523
CSc1ccc([S@+](C)[O-])nn1,C21995367_decoy,CASP3,Decoy,0,-5.43392,-3.29,-0.73,-3.4554179186016265
c1cnn([C@@H]2CCCCO2)c1,C33359463_decoy,CASP3,Decoy,0,-4.58941,-3.39,0.24,-3.0851781104674743
Cn1cc(C(=O)C(F)(F)F)cn1,C35655547_decoy,CASP3,Decoy,0,-4.49206,-3.94,-0.59,-3.696189890188664
C[C@@H](Cl)c1nnc([C@@H]2C[C@@H]2C)o1,C35658246_decoy,CASP3,Decoy,0,-5.66783,-4.42,0.45,-3.3954236848212864
Cc1nnc(-c2ccncc2)n1C,C35904593_decoy,CASP3,Decoy,0,-4.60967,-4.81,-0.37,-3.388724277561212
CON(C)C(=O)[C@@H](C)Cl,C36825766_decoy,CASP3,Decoy,0,-4.58352,-2.71,-1.61,-3.48754933503331
C[C@@H]1CN(C[C@@H](C)C#N)CCO1,C36668836_decoy,CASP3,Decoy,0,-5.11448,-3.64,-0.02,-4.461993627207963
C[C@]1(n2cccn2)CCS(=O)(=O)C1,C37761011_decoy,CASP3,Decoy,0,-4.97856,-4.59,0.08,-3.80253588928097
N#Cc1cnn2c(C3CC3)ccnc12,C01399429_decoy,CASP3,Decoy,0,-5.28477,-4.9,-1.64,-3.670938947394062
Cc1nnc2n1CCCCC2,C04728721_decoy,CASP3,Decoy,0,-4.66646,-4.64,-0.38,-2.999720817784768
C[C@@]1(C(=O)Cl)CO[S@@](=O)O1,C38482170_decoy,CASP3,Decoy,0,-5.52285,-3.36,0.3,-2.4332426244869207
CC(=O)[C@@H]1OC(C)=NC1(C)C,C39070166_decoy,CASP3,Decoy,0,-4.75125,-3.79,-0.0,-3.7846055917157466
CC(=O)[C@H]1O[C@H](C)OC1(C)C,C39070564_decoy,CASP3,Decoy,0,-4.75632,-3.57,-0.59,-2.571323678374411
CO[C@@]1(C)CO[C@@]1(C)C(C)=O,C39070707_decoy,CASP3,Decoy,0,-5.27308,-4.13,-0.7,-4.156343691652557
C=C1CO[C@@H](OC)[C@]1(C)C(C)=O,C39072653_decoy,CASP3,Decoy,0,-4.32975,-3.83,-0.95,-2.538649261464583
N#CCN1C[C@H]2CC[C@@H](C1)O2,C39080361_decoy,CASP3,Decoy,0,-5.77333,-3.36,-4.15,-1.29100143085344
C[C@H]1CC(F)(F)n2n(F)n21,C39088562_decoy,CASP3,Decoy,0,-4.56886,-4.28,-0.3,-2.81973984444296
C=C1CCO[P@@](=O)(OCC)C(=C)C1,C39099164_decoy,CASP3,Decoy,0,-5.28724,-4.16,-0.71,-3.035091216231029
CC(C)c1nnc(C#N)s1,C39103173_decoy,CASP3,Decoy,0,-5.49333,-3.5,-0.09,-2.743159897375108
O=C1CS(=O)(=O)C2(CCCC2)O1,C39112074_decoy,CASP3,Decoy,0,-6.02685,-4.41,0.29,-3.420014163534762
Cc1noc(C)c1C1(C#N)CC1,C39113110_decoy,CASP3,Decoy,0,-4.19488,-4.52,-2.08,-2.4807725974364345
CO[C@@]1(F)C(=O)[C@@]1(F)OC,C39125573_decoy,CASP3,Decoy,0,-4.69901,-3.78,-0.48,-3.691925038840224
ClC1=NN=C(Cl)[C@@H]2N=CN=C12,C39223596_decoy,CASP3,Decoy,0,-6.18626,-3.66,,99.0
Cc1nc(C)c([C@H]2C=CN=N2)s1,C39569995_decoy,CASP3,Decoy,0,-5.86929,-3.86,-0.24,-3.966653384578356
Cc1nc(N(C)C)sc1C=O,C40162892_decoy,CASP3,Decoy,0,-6.1996,-3.82,-0.56,-3.2792370960904496
N#Cc1cncc(Br)n1,C40448309_decoy,CASP3,Decoy,0,-5.45764,-3.11,0.04,-2.207821265890895
O=CCN1CCO[C@H]2CCCC[C@@H]21,C43803616_decoy,CASP3,Decoy,0,-5.38345,-4.18,-0.42,-4.966201022308765
CN(C)C(=O)C1(C#N)CCCC1,C44292391_decoy,CASP3,Decoy,0,-3.80323,-5.01,-0.21,-4.863194554240837
CC(C)N(C)C(=O)[C@@H](C)C#N,C44810612_decoy,CASP3,Decoy,0,-4.76407,-3.56,0.08,-4.545747749409847
O=S1(=O)C[C@@]23CC=CC[C@@]2(COC3)C1,C45027880_decoy,CASP3,Decoy,0,-5.56398,-4.6,-0.59,-3.959074161597469
C[C@@H](C#N)Sc1nncs1,C48403816_decoy,CASP3,Decoy,0,-6.57673,-3.89,-0.42,-5.41510764014689
Clc1nccc(-n2cccn2)n1,C51850436_decoy,CASP3,Decoy,0,-4.52218,-3.86,0.03,-3.094341609774596
Cc1nccn1-c1ncccc1CCl,C40886028_decoy,CASP3,Decoy,0,-5.00911,-5.3,-1.4,-4.5225883136616
CC(=O)N1CCC2(CC1)OCCCO2,C62026853_decoy,CASP3,Decoy,0,-5.67779,-3.81,-0.0,-4.14710699030034
CC1=N[C@@H]2N=NC=C2C(Cl)=N1,C38520684_decoy,CASP3,Decoy,0,-5.25317,-3.88,-0.04,-2.369947476104782
BrC1=CN=C2N=NC=C2C1,C39698252_decoy,CASP3,Decoy,0,-4.81788,-3.7,0.02,-2.313963057713785
Clc1cnn(CN2CCSCC2)c1,C66350552_decoy,CASP3,Decoy,0,-6.4062,-3.3,-0.62,-3.760622022260414
CCOC(=O)[C@H](C)Sc1ccnc2c1c(=O)n(C)c(=O)n2C,C04942224_decoy,CASP3,Decoy,0,-7.54053,-5.38,-1.45,-5.525976710199734
O=c1ccn(-c2ccccc2)nc1-c1ccn([C@H]2CCS(=O)(=O)C2)n1,C05685264_decoy,CASP3,Decoy,0,-8.11948,-7.31,-1.21,-6.014970558775304
Cc1noc(C)c1CC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1,C07777810_decoy,CASP3,Decoy,0,-6.44906,-6.3,-3.47,-5.546747177455927
O=C(c1cnn(-c2ccccc2)c1)N1CCN(c2ncccn2)CC1,C08134772_decoy,CASP3,Decoy,0,-5.98866,-5.99,-0.64,-5.151238394905236
O=C(C1=COCCO1)N1CCN(S(=O)(=O)c2cccs2)CC1,C08380450_decoy,CASP3,Decoy,0,-6.68393,-5.86,-0.6,-4.969062673342801
CN(C)C(=O)Cn1nc(-c2cccs2)n(-c2ccncc2)c1=O,C12117426_decoy,CASP3,Decoy,0,-6.35898,-5.14,-0.58,-5.026668495382215
Cc1csc(-n2c(C)cc(C(=O)Cn3cnc(C#N)n3)c2C)n1,C12986470_decoy,CASP3,Decoy,0,-6.62175,-5.78,-1.37,-5.224254623394015
O=C([C@H]1CCCN1c1nnc(N2CCCC2=O)s1)N1CCCC1,C15672269_decoy,CASP3,Decoy,0,-8.05823,-5.42,-4.86,-5.452899565099098
CS(=O)(=O)N1CCC[C@@H](c2nnc(S)n2C[C@@H]2CCCO2)C1,C17072163_decoy,CASP3,Decoy,0,-8.78749,-5.61,-0.62,-7.142711229697827
CC(C)N1C[C@@H](C(=O)N2CCC[C@@H](C(=O)c3nccn3C)C2)CC1=O,C20994589_decoy,CASP3,Decoy,0,-7.42261,-5.72,-2.8,-6.168776925189158
CC(C)c1noc2ncc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)cc12,C25676453_decoy,CASP3,Decoy,0,-7.27965,-5.8,-2.53,-5.542243401331453
Cc1noc(C)c1S(=O)(=O)N(C)CC(=O)N1CCCC[C@H]1C,C26398632_decoy,CASP3,Decoy,0,-6.0395,-6.4,-1.3,-6.414244072461274
O=C(c1ccc(F)c(F)c1)N1CCN(Cc2nnnn2C2CC2)CC1,C26446024_decoy,CASP3,Decoy,0,-6.32393,-6.02,-1.42,-6.725838783340867
CC(=O)N1CCN(C(=O)CSc2nnc(-c3cccs3)o2)CC1,C28627795_decoy,CASP3,Decoy,0,-8.62714,-7.42,-1.85,-6.21199499064268
Cn1cc(/C=C/C(=O)N(Cc2ccco2)C2CC2)c(=O)n(C)c1=O,C29270282_decoy,CASP3,Decoy,0,-6.60152,-5.91,-1.3,-5.701899298443297
CCOC(=O)c1sc(N2C(=O)C[C@@H]3CS(=O)(=O)C[C@@H]32)nc1C,C32912430_decoy,CASP3,Decoy,0,-7.0546,-6.89,-1.24,-5.526834081051498
CN(C)C(=O)Cc1nc(CSc2ncnc3c2cnn3C)cs1,C32922681_decoy,CASP3,Decoy,0,-7.77494,-5.22,-1.93,-6.526367564819447
Cc1noc(C)c1CN(C)S(=O)(=O)c1ncn(C)c1Cl,C37986135_decoy,CASP3,Decoy,0,-6.32996,-4.86,-0.83,-5.1949698265379824
CS(=O)(=O)N1CCN(C(=O)c2csc(-n3cccc3)n2)CC1,C38679103_decoy,CASP3,Decoy,0,-6.30684,-6.93,-1.29,-4.692782130115867
O=C1C[C@H](C(=O)N2CCC3(CC2)OCCCO3)CN1Cc1ccco1,C39266842_decoy,CASP3,Decoy,0,-6.48575,-5.71,-2.56,-4.978680106962204
O=C(C1=NN=C(c2ccccc2)C1)N1CCN(C(=O)[C@H]2CC=CO2)CC1,C39746816_decoy,CASP3,Decoy,0,-7.03728,-7.25,-2.26,-6.673552725024039
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)[C@H]1CC(=O)N(C)C1,C40508520_decoy,CASP3,Decoy,0,-6.12661,-6.33,-1.64,-5.317214260600989
C[C@@H]1CN(C(=O)c2cc(C3CC3)n([C@H]3CCS(=O)(=O)C3)n2)CCO1,C40670734_decoy,CASP3,Decoy,0,-8.62114,-5.76,-2.23,-6.091975003453687
CS(=O)(=O)N1CCN([C@@H](C#N)c2ccc3c(c2)OCO3)CC1,C41260744_decoy,CASP3,Decoy,0,-7.63103,-5.46,-1.61,-5.636535514549464
C[C@@H]1Cc2ccccc2N1C(=O)CCn1cnc2c(cnn2C)c1=O,C44894164_decoy,CASP3,Decoy,0,-5.96073,-7.33,-2.06,-5.39108531390426
CCN(Cc1ccco1)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12,C44909331_decoy,CASP3,Decoy,0,-6.73466,-5.41,-3.42,-5.4924940408886425
O=S(=O)(Cc1nc(C2CC2)no1)c1ccc2c(c1)OCCO2,C44948006_decoy,CASP3,Decoy,0,-6.36451,-5.97,-0.75,-5.5043261498062375
C[C@@H](c1nc(C2CC2)no1)N1CCN(C(=O)[C@H]2CCCO2)CC1,C44975127_decoy,CASP3,Decoy,0,-6.35428,-6.34,-1.72,-4.486979724192946
Cn1c(COC(=O)c2ccc([S@+](C)[O-])cc2)cc(=O)n(C)c1=O,C45668634_decoy,CASP3,Decoy,0,-7.46047,-6.56,-1.24,-5.1178568920041405
CN(Cc1ccc2c(c1)OCCO2)C(=O)CN(C)c1cnccn1,C48075144_decoy,CASP3,Decoy,0,-6.40491,-6.27,-0.62,-6.295214359516442
Cc1cccc(C(=O)N2CCN(C(=O)c3nnc(C(C)C)o3)CC2)c1,C49705733_decoy,CASP3,Decoy,0,-6.39871,-7.31,-3.95,-4.561598010493891
CC(C)CN1C(=O)C(=O)N(CC(=O)N2[C@H](C)CCC[C@H]2C)C1=O,C57533033_decoy,CASP3,Decoy,0,-6.06747,-5.36,-1.01,-5.569657845452138
Cn1ccnc1SCC(=O)N1CCN(c2cnccn2)CC1,C42131303_decoy,CASP3,Decoy,0,-5.88951,-4.74,-1.05,-4.610013808367084
Cc1noc(C)c1CN1CCN(C(=O)/C=C/c2cnn(C)c2)CC1,C47254230_decoy,CASP3,Decoy,0,-6.49561,-5.08,-0.61,-4.825695478063388
O=C(c1sccc1-n1cnnn1)N1CCN(CC(F)F)CC1,C61600428_decoy,CASP3,Decoy,0,-5.45984,-6.9,-2.72,-5.430673407120686
Cc1nnc(C2CCN(C(=O)c3c(C(C)(C)C)noc3C)CC2)o1,C62268096_decoy,CASP3,Decoy,0,-6.32393,-7.59,-4.08,-5.679322694716793
COc1ccc(-c2oncc2C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1,C62632010_decoy,CASP3,Decoy,0,-6.14835,-5.18,-3.01,-5.032078278549417
O=C(/C=C/c1cccs1)N1CCN(C2=NC=NC3=NC=N[C@@H]32)CC1,C63295916_decoy,CASP3,Decoy,0,-8.6268,-5.57,-0.89,-5.519554829700275
C[C@@H](C#N)CN(C)C(=O)c1nc2ncc(Br)cn2n1,C63746699_decoy,CASP3,Decoy,0,-6.41357,-4.5,-1.28,-5.315707663933675
O=C1OCC[C@@H]1Sc1nnc(N2CCCC2)n1C[C@H]1CCCO1,C58394041_decoy,CASP3,Decoy,0,-7.4187,-5.11,-2.31,-5.467831925845744
O=C1N=C2C(c3ccccn3)=NS[C@H]2C(=O)N1Cc1ccco1,C64403136_decoy,CASP3,Decoy,0,-6.76226,-6.29,-2.1,-4.572540106698337
CC1=NC(C)=C(c2nnc(C)o2)[C@@H]1S(=O)(=O)N1CCC(C)CC1,C65186684_decoy,CASP3,Decoy,0,-6.3368,-5.65,-1.35,-5.63892436708006
CC1=NC(C)=C(c2nnc(C3CC3)o2)[C@H]1S(=O)(=O)N1CCCCC1,C65193904_decoy,CASP3,Decoy,0,-6.75448,-5.43,-0.5,-4.5891756402438535
C[C@@H](C(=O)N1CCN(c2cccc(F)c2C#N)CC1)n1cncn1,C31400025_decoy,CASP3,Decoy,0,-6.48295,-5.96,-0.96,-5.000376203029483
C[C@@H]1CCCN(S(=O)(=O)N2CCC[C@H](c3nncn3C)C2)C1,C45741684_decoy,CASP3,Decoy,0,-7.20911,-6.11,-2.01,-5.495008508579614
CCS(=O)(=O)N1CCN(Cn2nc(N(C)C)sc2=S)CC1,C66448984_decoy,CASP3,Decoy,0,-6.4562,-5.28,-0.44,-4.76650186385124
Cn1c(=O)ccn(CC(=O)N2C[C@@H](c3ccccc3)OCC2(C)C)c1=O,C66512688_decoy,CASP3,Decoy,0,-5.39592,-5.77,-1.09,-4.945552959631638
CC(C)C(=O)N1CCCN(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)CC1,C66578032_decoy,CASP3,Decoy,0,-7.07235,-5.3,-1.03,-5.675877996876032
CCCC(=O)N1CSC[C@H]1C(=O)N1CCC(n2cncn2)CC1,C66644028_decoy,CASP3,Decoy,0,-6.76487,-5.21,-2.79,-5.513156740096484
COC(=O)c1ncn(CN2CCO[C@@H](c3ccccc3F)C2)n1,C66794022_decoy,CASP3,Decoy,0,-6.68344,-5.88,-1.26,-5.48692407118272
Cc1cc(-n2c(C)cc(C(=O)Cn3ncc(Cl)c(Cl)c3=O)c2C)no1,C03464929_decoy,CASP3,Decoy,0,-7.53526,-6.76,-1.44,-6.084581604350284
COc1cc(OC)c(OC)cc1/C=C1\SC(N2C[C@@H](C)O[C@H](C)C2)=NC1=O,C04603325_decoy,CASP3,Decoy,0,-6.64825,-5.44,-0.67,-3.929817764358511
N#C/C(=C\c1ccc(N2CCOCC2)o1)C(=O)N1CCN(c2ccccc2)CC1,C04711011_decoy,CASP3,Decoy,0,-7.327,-6.2,-2.09,-5.217740584341119
Cc1ccc2cc(CN(C[C@@H]3CCCO3)C(=O)C(F)(F)F)c3nnnn3c2c1,C01367337_decoy,CASP3,Decoy,0,-6.63517,-6.76,-0.02,-5.55783063200986
CCOC(=O)c1s/c(=N/C(=O)c2cccc(S(C)(=O)=O)c2)n(C)c1C,C05223112_decoy,CASP3,Decoy,0,-7.98561,-5.46,-0.57,-6.117962815906755
COc1ccc([C@@H]2[C@@H](Cl)C(=O)N2n2cnc3ccccc3c2=O)cc1OC,C01632105_decoy,CASP3,Decoy,0,-6.17083,-7.23,-4.82,-5.481482243950947
COc1ccc(C(=O)CSc2c(C)cnc3c2c(=O)n(C)c(=O)n3C)cc1,C10216506_decoy,CASP3,Decoy,0,-7.56345,-6.02,-3.15,-6.03539856299416
C[C@H](C(=O)N(C)c1ccccc1)N(c1ccc2c(c1)OCCO2)S(C)(=O)=O,C13670607_decoy,CASP3,Decoy,0,-7.21391,-6.55,-1.14,-5.629146467597285
Cc1cc(/C=C/C(=O)N2CCN(c3ncccn3)CC2)c(C)n1Cc1ccco1,C13986891_decoy,CASP3,Decoy,0,-8.53533,-6.32,-0.91,-5.621680761802846
C[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3c2cnn3Cc2ccco2)CCO1,C14366835_decoy,CASP3,Decoy,0,-7.72507,-6.02,-0.93,-5.0154942136747325
c1cc(-c2cc(-n3cccn3)ncn2)cc(-c2ccn(Cc3nccs3)n2)c1,C19794662_decoy,CASP3,Decoy,0,-10.13,-7.45,-0.75,-7.117861375741189
Cc1cc(C(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)c(C)n1-c1nccs1,C22320790_decoy,CASP3,Decoy,0,-8.14885,-6.84,-2.12,-6.016110948542658
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)S(=O)(=O)N1CCc2ccccc2C1,C22959053_decoy,CASP3,Decoy,0,-7.05521,-7.0,-1.47,-5.817358008015388
Cc1cc(CN(C)C(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)no1,C25138011_decoy,CASP3,Decoy,0,-8.08306,-6.56,-0.87,-6.750152820048573
c1ccc(-n2cnc(SC[C@H]3CSc4nnc(-c5cccnc5)n43)n2)cc1,C30572794_decoy,CASP3,Decoy,0,-7.93761,-6.35,-0.66,-6.414792074250998
Cn1nc(C(=O)N2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)ccc1=O,C32333050_decoy,CASP3,Decoy,0,-7.11119,-7.53,-2.92,-6.295211371950127
Cc1cc2nnc(C(=O)N(Cc3ccccn3)[C@H](C)c3ccccc3)c(C)n2n1,C35522646_decoy,CASP3,Decoy,0,-6.99595,-6.06,-3.82,-5.402797079006794
O=C(C1CC1)N1CCCN(c2nc(C3CC3)nc3c2cnn3-c2ccccc2)CC1,C36006231_decoy,CASP3,Decoy,0,-7.94043,-6.41,-0.58,-6.12361407996863
COc1cc([C@H]2C3=C(CC(C)(C)CC3=O)N(C)C(=O)N2C)cc(OC)c1OC,C03218529_decoy,CASP3,Decoy,0,-6.34835,-5.23,-1.1,-5.451636410771276
O=C(c1cnn(-c2ccccc2)n1)N1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1,C38729502_decoy,CASP3,Decoy,0,-7.41305,-6.81,-1.73,-5.238479344487708
O=C(c1cnn(-c2ccccc2)n1)N1CCN(C(=O)[C@@H]2C[C@@H]2c2cccs2)CC1,C38730556_decoy,CASP3,Decoy,0,-7.49039,-6.2,-0.97,-5.685117307460669
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)/C=C/c3ccccc3)CC2)C[C@H](C)O1,C40081065_decoy,CASP3,Decoy,0,-7.83769,-6.23,-0.51,-5.078122784151786
Cc1oc(-c2cccs2)nc1CC(=O)[C@H](C#N)c1nnc2n1CCCCC2,C41506779_decoy,CASP3,Decoy,0,-7.47671,-6.17,-0.79,-5.960729103078923
COc1cccc(-c2nc([C@H]3CC(=O)N(c4ccc(OC)c(F)c4)C3)no2)c1,C44424839_decoy,CASP3,Decoy,0,-7.20346,-6.0,-1.81,-5.377636023633223
CCN1C[C@H](CN(C)C(=O)c2cc(C)nc3c2c(C)nn3C)Oc2ccccc21,C45824440_decoy,CASP3,Decoy,0,-6.95675,-6.32,-1.53,-5.6993712139203705
O=C(CS(=O)(=O)Cc1noc(-c2cccs2)n1)N1CCc2ccccc21,C46158141_decoy,CASP3,Decoy,0,-8.37395,-7.42,-0.01,-6.39749654384465
C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](C)S(=O)(=O)Cc2noc(-c3cccs3)n2)C1,C46158392_decoy,CASP3,Decoy,0,-9.61122,-6.61,-0.16,-7.639894435584348
CCOC(=O)c1sc2nc(C)nc(N3CCC(C(=O)N(C)C)CC3)c2c1C,C46229135_decoy,CASP3,Decoy,0,-8.07814,-5.37,-1.02,-8.290711333295501
Cc1cc(C)c(S(=O)(=O)N(C)C(=O)[C@@H](C)Sc2nncn2C)c(C)c1,C51206150_decoy,CASP3,Decoy,0,-8.02375,-5.55,-1.18,-6.395966912218027
CCN(CC)C(=O)N1CCN(C(=O)[C@H]2CCN(c3ccc(C)cc3)C2=O)CC1,C53479367_decoy,CASP3,Decoy,0,-6.44541,-6.54,-1.99,-5.489787872477922
O=C(C1CCN(Cn2ncnc2-c2ccccc2Cl)CC1)N1CCOCC1,C54452609_decoy,CASP3,Decoy,0,-7.75938,-6.03,-1.15,-5.587052296399814
COc1ccc(C(=O)N2Cc3nn(C(C)(C)C)c(-n4cccc4)c3C2)cc1OC,C56910957_decoy,CASP3,Decoy,0,-6.61445,-5.41,-1.84,-4.935967480774151
CN(CCOc1ccc(Cl)cc1)C(=O)C1=CN2CCS(=O)(=O)N=C2C=C1,C21847729_decoy,CASP3,Decoy,0,-8.04357,-6.31,-0.89,-7.468180174502091
Cc1sc2ncnc(N3CCC(C(=O)O[C@H](C)C(=O)N(C)C)CC3)c2c1C,C07538811_decoy,CASP3,Decoy,0,-7.69747,-6.39,-0.48,-7.312694797006689
CCc1ccccc1N1C(=O)C[C@H](Sc2nnc3nc(C)cc(C)n23)C1=O,C20799418_decoy,CASP3,Decoy,0,-6.3036,-6.29,-0.92,-4.88683797736927
CCOC(=O)c1sc2ncn(CC(=O)N3[C@H](C)CCC[C@@H]3C)c(=O)c2c1C,C28828713_decoy,CASP3,Decoy,0,-8.37552,-6.8,-1.1,-6.0941777739213805
CCOC(=O)c1sc2ncn(CC(=O)N3[C@H](C)CCC[C@H]3C)c(=O)c2c1C,C28828714_decoy,CASP3,Decoy,0,-6.23268,-6.69,-1.93,-4.463938589493311
CC(=O)N(C)c1nc(/C=C2\N=C(c3ccccc3OC(F)F)OC2=O)cs1,C63438875_decoy,CASP3,Decoy,0,-6.52705,-7.35,-1.17,-5.316949089349058
CC[C@@H]1CN(C(=O)CS(=O)(=O)c2nccn2-c2ccc(C)c(C)c2)CCO1,C63545769_decoy,CASP3,Decoy,0,-6.3137,-6.21,-0.76,-7.370190166233939
CC[C@@H]1CN(C(=O)c2cc(-c3cc(C)oc3C)nc3c2cnn3C(C)C)CCO1,C63734488_decoy,CASP3,Decoy,0,-7.49264,-7.09,-3.73,-6.519438859095851
Cc1cc(N2CCN(Cc3csc(C4CCCC4)n3)CC2)n2ncnc2n1,C63994282_decoy,CASP3,Decoy,0,-8.54219,-5.98,-0.71,-5.2916615016184805
CC(C)c1ccc2c(c1)N=C(C(=O)N1CCN(S(=O)(=O)N3CCCC3)CC1)C2,C45353050_decoy,CASP3,Decoy,0,-7.99608,-6.2,-1.41,-5.683733778632337
C[C@@H](Sc1nc2ncccn2n1)C1=NC(=O)C2=C(c3cccs3)CSC2=N1,C39752291_decoy,CASP3,Decoy,0,-8.72977,-7.39,-0.54,-6.465507442324639
N#C[C@H](C(=O)c1cnn(-c2ccccc2Cl)c1)c1nnc2n1CCCCC2,C50206438_decoy,CASP3,Decoy,0,-8.06625,-6.44,-0.42,-7.537018049236835
Cc1ccc(C(=O)N2CCCN(c3cc(=O)n(C(C)C)c(=O)n3C(C)C)CC2)cc1,C65024453_decoy,CASP3,Decoy,0,-6.90074,-5.45,-3.76,-5.711421413852054
Cc1nc(-c2ccccc2C)n(CN2CCN(C(=O)c3cc(C)oc3C)CC2)n1,C66077352_decoy,CASP3,Decoy,0,-7.605,-8.08,-2.98,-6.919777302673429
COC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3C(F)F)[C@H](C)C2)cc1,C66359328_decoy,CASP3,Decoy,0,-6.33896,-5.43,-2.21,-6.710597763939302
CCS(=O)(=O)N(C)C(=O)c1nnn(-c2ccc(-c3ccccc3)cc2)c1C,C66730078_decoy,CASP3,Decoy,0,-5.69072,-5.99,-1.71,-4.298416244298431
Cn1c(-c2ccccc2)nnc1[C@@H](C#N)C(=O)[C@@]1(C)Cc2ccccc2C(=O)O1,C66867732_decoy,CASP3,Decoy,0,-6.45174,-7.05,-1.75,-5.162741370308351
CCn1cnnc1C1CCN(C(=O)[C@@H]2CCN(c3ccc(C)c(C)c3)C2=O)CC1,C67005144_decoy,CASP3,Decoy,0,-7.45516,-6.15,-4.05,-5.360901470032294
CCOC(=O)C1=NN(C(C)=O)[C@@]2(CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)C1,C05021931_decoy,CASP3,Decoy,0,-7.44332,-6.9,-1.66,-5.667237491296845
CCOC(=O)C1=NN(C(C)=O)[C@]2(CC(=O)N(c3cc(Cl)cc(Cl)c3)C2=O)C1,C05023015_decoy,CASP3,Decoy,0,-7.18374,-6.09,-0.92,-5.530508539042351
Cc1ccc(-n2nnnc2SCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1C,C05171302_decoy,CASP3,Decoy,0,-7.42814,-7.38,-1.74,-6.331015353573699
Cn1c([C@@H](C#N)C(=O)c2nc(S(C)(=O)=O)ncc2Cl)nc2ccccc21,C05317915_decoy,CASP3,Decoy,0,-8.17557,-6.61,-0.6,-6.324095228977192
Cc1cccc(-n2nnnc2S[C@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1,C11618200_decoy,CASP3,Decoy,0,-5.60992,-7.27,-0.7,-5.805996297667473
COc1ccc(-n2c(C)nnc2SCC(=O)N2CCN(C(=O)C3CC3)CC2)cc1,C12606267_decoy,CASP3,Decoy,0,-7.30663,-5.78,-1.45,-6.291853519597466
CCOC(=O)c1nn(C)c2c1CN(C(=O)[C@H]1CC(=O)OC13CCCCC3)CC2,C14541317_decoy,CASP3,Decoy,0,-7.65808,-5.76,-2.12,-5.669916156471959
Cc1nc2ncnn2c(C)c1CCC(=O)N1CCN(C(=O)c2ccccc2F)CC1,C19578529_decoy,CASP3,Decoy,0,-6.70565,-6.52,-2.08,-6.240017433081979
CCN(CC)S(=O)(=O)N1CCN(S(=O)(=O)N2CCC[C@@H](C)C2)CC1,C19715973_decoy,CASP3,Decoy,0,-7.75741,-6.23,-2.49,-6.949503757714953
CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)c3csc(C)n3)C2)nn1,C20149562_decoy,CASP3,Decoy,0,-9.75195,-5.62,-1.22,-6.98167881958299
Cc1noc(C)c1CC(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1,C22227879_decoy,CASP3,Decoy,0,-9.57205,-6.99,-1.2,-6.644703283979448
CC(C)n1ncc2c(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc(C3CC3)nc21,C25050840_decoy,CASP3,Decoy,0,-7.74838,-5.23,-2.53,-6.013061991003273
CCCn1nc(C(=O)N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)ccc1=O,C26947187_decoy,CASP3,Decoy,0,-7.60431,-5.83,-1.1,-5.481769066183693
CCN(CC)C(=O)N1CCN(C(=O)c2cc(C)nc3c2cnn3C(C)C)CC1,C31502626_decoy,CASP3,Decoy,0,-6.96781,-5.63,-2.27,-5.405744353781225
COC(=O)c1cc(C#N)c(=O)n(CC(=O)c2cc(C)n(-c3nccs3)c2C)c1,C31805938_decoy,CASP3,Decoy,0,-7.14707,-6.13,-2.3,-5.210127829243415
Cc1nc(C#N)c(N2CCN(C(=O)Cn3cc(C(F)(F)F)ccc3=O)CC2)o1,C31916981_decoy,CASP3,Decoy,0,-6.15239,-6.25,-5.02,-4.6721780960067685
CC(=O)N1CCN(C(=O)[C@@H](Sc2nnc3cc(C)nc(C)n23)C(C)C)CC1,C33030352_decoy,CASP3,Decoy,0,-6.68118,-6.14,-1.15,-5.734984063061331
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)C2CC2)[C@@H](C)C1,C33659048_decoy,CASP3,Decoy,0,-6.96493,-5.32,-1.87,-5.448772003165457
COC(=O)N1CC[C@]23c4c5ccc(OC(C)=O)c4O[C@H]2[C@@H](OC(C)=O)C=C[C@H]3[C@H]1C5,C35644995_decoy,CASP3,Decoy,0,-7.39399,-5.71,-0.38,-6.272187713122602
COC(=O)c1c(C(=O)N2CCN(C(=O)C3CC3)[C@H](C)C2)nc(C)nc1C(C)C,C35703106_decoy,CASP3,Decoy,0,-6.31708,-5.19,-1.55,-4.312104967869423
CC(=O)N1CCN(C(=O)c2csc(COc3ccc4c(c3)OCO4)n2)CC1,C36084213_decoy,CASP3,Decoy,0,-8.32244,-5.82,-0.88,-5.674843394973099
COc1cc(OC)c2c(c1)OC(=O)[C@H](CC(=O)N1CCC3=NC=N[C@@H]3C1)[C@H]2C,C39232828_decoy,CASP3,Decoy,0,-7.24815,-5.87,-2.78,-4.860539184839109
CC(C)c1nccn1CC1=C[C@@H](C(=O)N2CCN(Cc3cccnc3)CC2)N=N1,C39518263_decoy,CASP3,Decoy,0,-7.35423,-6.65,-1.21,-6.288506925954446
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)c3cccc(N(C)C)c3)CC2)C[C@@H](C)O1,C40087196_decoy,CASP3,Decoy,0,-7.17061,-6.28,-0.97,-5.796705857179118
C[C@H](C(=O)N1CCN(S(C)(=O)=O)CC1)n1nc(-c2ccc(F)cc2)ccc1=O,C44392543_decoy,CASP3,Decoy,0,-8.91524,-8.56,-1.68,-13.225450524924211
Cc1nn(C)c(C)c1C(=O)OCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1,C12346364_decoy,CASP3,Decoy,0,-9.90914,-6.57,-1.55,-6.645644508943723
CC(=O)N(c1nn(CN2CCN(C(=O)OC(C)(C)C)CC2)c(=S)s1)C1CC1,C45800249_decoy,CASP3,Decoy,0,-8.02736,-5.42,-3.38,-5.499596761377595
CCN(Cc1ccc2c(c1)OCO2)C(=O)C1=CC=CN2CCS(=O)(=O)N=C12,C45865560_decoy,CASP3,Decoy,0,-7.21978,-6.49,-0.82,-6.0337633647621765
CCN1C[C@@H](CN(C)C(=O)/C=C/c2cn(C)c(=O)n(C)c2=O)Oc2ccccc21,C46744064_decoy,CASP3,Decoy,0,-7.29405,-6.5,-1.55,-6.285916490758903
CCN(C(=O)[C@H](C)Sc1nc2nc(C)c(C)c(C)n2n1)[C@@H]1CCS(=O)(=O)C1,C46865563_decoy,CASP3,Decoy,0,-8.67462,-5.14,-1.34,-5.505216379884806
CS(=O)(=O)c1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1,C48306207_decoy,CASP3,Decoy,0,-6.64931,-6.03,-0.67,-4.828631521953477
COc1ccccc1N(C)C(=O)C(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1,C52705334_decoy,CASP3,Decoy,0,-5.98298,-5.87,-2.65,-5.2429326208697855
CCN(CC)C(=O)N1CCN(Cn2c(=S)nc3nc(C)c(C)c(C)n32)CC1,C54465218_decoy,CASP3,Decoy,0,-6.62409,-6.42,-1.78,-5.246648838069239
Cc1ccc(C(=O)N2CCN(Cn3nnn(-c4cccs4)c3=O)CC2)s1,C55035201_decoy,CASP3,Decoy,0,-8.15743,-5.96,-1.36,-7.4585971533941295
C[C@@H](C(=O)N(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)n1cccn1,C58839273_decoy,CASP3,Decoy,0,-7.86586,-6.69,-3.66,-6.512569797281705
C/C=C/C=C/C(=O)N1CCN(S(=O)(=O)c2c(C)oc(C)c2C(=O)OC)CC1,C46592242_decoy,CASP3,Decoy,0,-6.62129,-5.53,-3.04,-4.647042971036751
O=C(CCOc1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccsc2)CC1,C60403558_decoy,CASP3,Decoy,0,-5.99974,-5.94,-0.79,-5.202789731892833
CC(=O)N1CCN(C(=O)CSCc2nnnn2-c2c(C)cccc2C)CC1,C60520424_decoy,CASP3,Decoy,0,-7.60089,-6.85,-1.19,-6.321683696950402
O=C(CCc1nc2ccccc2s1)N1CCN([C@H]2N=CN=C3N=CN=C32)CC1,C39958704_decoy,CASP3,Decoy,0,-8.03319,-7.01,-4.38,-6.718586357351763
CC(=O)C1=C(C)C(C(=O)OCC(=O)N2CCN(C(=O)c3cccs3)CC2)=N[C@@H]1C,C38696869_decoy,CASP3,Decoy,0,-8.22916,-6.7,-1.32,-6.537612113785355
Cc1noc([C@@H](C)N2CCN(CC3=NC(=O)C4=C5CCCC[C@@H]5SC4=N3)CC2)n1,C64058206_decoy,CASP3,Decoy,0,-9.19336,-7.52,-1.73,-6.256829680869774
O=C(CS[C@H]1N=Nc2nc3ccccc3n21)C1=CC(C(=O)N2CCCC2)=NC1,C64156110_decoy,CASP3,Decoy,0,-6.69259,-6.58,-1.62,-6.544374025113551
O=C(c1nnc(-c2csc(S(=O)(=O)N3CCCC3)c2)o1)N1CCCC1,C35527634_decoy,CASP3,Decoy,0,-7.56864,-7.19,-0.75,-6.39736123372053
CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2nn(C)c3c2CN(C(=O)C2CC2)CC3)C1,C64565682_decoy,CASP3,Decoy,0,-6.76508,-5.12,-0.67,-5.097814591652132
CC(=O)c1ccc(N2CCN(S(=O)(=O)[C@@H]3CC[C@@H]([C@@H]4C=CN=N4)O3)CC2)cc1,C64710368_decoy,CASP3,Decoy,0,-8.81603,-5.91,-1.39,-7.306563683448881
O=S(=O)(c1ccc(-c2nnc(C3CC3)o2)s1)N1CCC2(CC1)OCCO2,C64920292_decoy,CASP3,Decoy,0,-8.58893,-5.69,-4.46,-6.06228935001616
CC1=NC(C)=C(c2nnc(C)o2)[C@H]1S(=O)(=O)N1CCN(C2CCCCC2)CC1,C65186689_decoy,CASP3,Decoy,0,-7.45314,-6.91,-0.76,-6.4706495083433655
CC1=NC(C)=C(c2nnc(C)o2)[C@@H]1S(=O)(=O)N1CCN(C2CCCCC2)CC1,C65186690_decoy,CASP3,Decoy,0,-7.91779,-6.44,-0.88,-6.584016927004742
COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3nc4ncccn4n3)n2)cc1,C66543580_decoy,CASP3,Decoy,0,-7.9219,-7.49,-0.71,-8.237700353428716
O=S(=O)(c1cccc(-n2cnnn2)c1)N(C[C@@H]1CCCO1)[C@@H]1CCSC1,C67429370_decoy,CASP3,Decoy,0,-7.44066,-5.65,-2.3,-6.234936454322677
CC(=O)c1ccc(-n2nnnc2SCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1,C01361418_decoy,CASP3,Decoy,0,-7.1415,-6.75,-1.14,-5.8301348248682805
CCn1nc(C)c(CN(C)C(=O)c2cc3ncc(Br)cn3n2)c1C,C02790930_decoy,CASP3,Decoy,0,-6.81554,-6.01,-2.68,-6.115096755815521
Cc1ccccc1-c1nc(CC(=O)N2CCN(C(=O)C(C)C)[C@@H](C)C2)no1,C04923082_decoy,CASP3,Decoy,0,-5.94305,-6.29,-0.9,-4.767564986152291
COC(=O)C1=C(C)N=C2S[C@@H](C)C(=O)N2[C@@H]1c1ccc(OC)c(OC)c1,C02254234_decoy,CASP3,Decoy,0,-7.29222,-4.61,-2.44,-5.130102145530376
O=C1C=C(c2cccs2)C[C@@H](c2cccs2)[C@@H]1n1cnc([N+](=O)[O-])n1,C01056414_decoy,CASP3,Decoy,0,-9.92614,-5.84,-1.06,-6.621147407588416
CC(C)CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1,C04504735_decoy,CASP3,Decoy,0,-6.41746,-5.44,-0.49,-5.554791702625956
Cc1nn(Cc2ccc(C(=O)N(C)Cc3cnn(C)c3C)o2)c(C)c1Cl,C02780630_decoy,CASP3,Decoy,0,-7.7521,-5.98,-1.66,-5.623882363166311
Cc1nn(C)cc1CN(C)C(=O)c1ccc(Cn2nc(C)c(Cl)c2C)o1,C06527314_decoy,CASP3,Decoy,0,-5.9272,-6.24,-2.62,-4.511489106779455
Cc1nc(C)c(-c2nnc(C(F)(F)F)o2)cc1-c1nnc(C(F)(F)F)o1,C08276241_decoy,CASP3,Decoy,0,-6.77696,-5.53,-3.32,-4.872834681442876
Cc1noc2nc(C3CC3)cc(C(=O)N(C)Cc3cnn(-c4ccccc4)c3)c12,C12770487_decoy,CASP3,Decoy,0,-7.83074,-7.41,-1.27,-9.567442775941633
CCN1C(=O)N(CC(=O)N2c3ccccc3C[C@H]2C)c2cccnc2N1CC,C19528333_decoy,CASP3,Decoy,0,-7.20036,-6.86,-1.87,-6.997982290775918
C[C@@H]1CN(C(=O)CSc2nnc3n2CCN3c2ccccc2)C[C@H](C)O1,C13958909_decoy,CASP3,Decoy,0,-5.9383,-6.94,-1.29,-6.587668613033893
Cc1cccc(C(=O)N2CCN(Cc3nnnn3-c3ccc(F)c(F)c3)CC2)c1,C23233096_decoy,CASP3,Decoy,0,-6.30872,-7.59,-1.22,-5.35493111536988
COc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OC,C38606940_decoy,CASP3,Decoy,0,-7.74997,-5.87,-2.83,-8.121013933194494
Cc1cccc2c(=O)cc(C(=O)N(Cc3ccco3)[C@@H]3CCS(=O)(=O)C3)oc12,C38644124_decoy,CASP3,Decoy,0,-6.78044,-7.63,-2.04,-6.560136613424402
CC1=NC(=O)C2=C(C)[C@H](C(=O)OCC(=O)N3CCc4ccccc43)SC2=N1,C39164140_decoy,CASP3,Decoy,0,-5.76271,-6.96,-0.31,-4.634382093001424
CC(C)c1ccc(CN2CCC[C@]3(CCN(C(=O)C4=NC(=O)N=C4)C3)C2=O)cc1,C39485103_decoy,CASP3,Decoy,0,-8.16737,-6.48,-2.02,-6.271690701167889
COc1cc2c(cc1OC)CN(C(=O)c1cc([N+](=O)[O-])c(F)c(F)c1F)CC2,C41132166_decoy,CASP3,Decoy,0,-6.58564,-5.7,-1.49,-5.132224638432271
Cn1c(SCc2cn3cc(Cl)ccc3n2)nnc1[C@H]1CCS(=O)(=O)C1,C07119116_decoy,CASP3,Decoy,0,-7.91484,-5.78,-1.51,-5.036600947391232
Cc1nc(S[C@H](C(=O)N2CCN(c3ncccn3)CC2)C(C)C)oc1C,C47559716_decoy,CASP3,Decoy,0,-7.12689,-5.53,-3.15,-4.990477227774657
C[C@H]1CCc2ccccc2N1C(=O)CS(=O)(=O)c1nnc(C2CC2)n1C,C47945214_decoy,CASP3,Decoy,0,-7.47812,-5.95,-1.13,-5.711501939724964
C[C@@H]1C[C@H](C)CN(C(=O)[C@@H](C)S(=O)(=O)Cc2cc(=O)n3ccccc3n2)C1,C48713383_decoy,CASP3,Decoy,0,-6.54265,-6.7,-1.8,-5.993350675259806
O=S(=O)(c1c(F)cccc1F)N1CC(c2nc(-c3ccccn3)no2)C1,C49482110_decoy,CASP3,Decoy,0,-7.12591,-7.6,-1.49,-5.898323551881702
Cc1cccc(CS(=O)(=O)N2CC(c3nc(-c4ccccn4)no3)C2)c1,C49482122_decoy,CASP3,Decoy,0,-6.32483,-6.73,-1.15,-5.965353424128528
Cc1noc(C)c1S(=O)(=O)N(C)C(=O)c1sccc1-n1c(C)ccc1C,C54465304_decoy,CASP3,Decoy,0,-6.40834,-5.9,-3.21,-6.000149338166665
C[C@@H]1CN(C(=O)[C@@H](C)Sc2nnc(N3CCCC3)n2C2CC2)C[C@@H](C)O1,C54977359_decoy,CASP3,Decoy,0,-7.24796,-6.31,-0.2,-5.955271264738491
C[C@H](c1nc(C2CC2)no1)S(=O)(=O)Cc1cc(Cl)c2c(c1)OCO2,C55197326_decoy,CASP3,Decoy,0,-8.44514,-5.45,-0.73,-5.582000055423086
Cc1c(C(=O)O[C@@H](c2nccn2C)C(F)(F)F)sc2ncn(C)c(=O)c12,C55400522_decoy,CASP3,Decoy,0,-7.44482,-5.92,-1.99,-4.747375707216323
C=CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](N1CCN(C=O)CC1)C2,C14732998_decoy,CASP3,Decoy,0,-7.71441,-5.36,-4.0,-6.268902594832011
O=C(c1ccco1)N1CCN(C(=O)C2(c3cc(-c4cccs4)on3)CC2)CC1,C56918842_decoy,CASP3,Decoy,0,-6.86945,-5.94,-2.62,-6.255013194608257
Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCN(c2ncccn2)CC1,C08134528_decoy,CASP3,Decoy,0,-6.68765,-6.18,-4.71,-5.896045954275992
C[C@@H](OC(=O)c1ccc(-n2cncn2)cc1)C(=O)N1CCc2ccccc2C1,C25442866_decoy,CASP3,Decoy,0,-6.4655,-8.39,-0.76,-6.275878439455344
CCc1nn2c(=O)cc(CN3CCN(C(=O)c4cccs4)CC3)nc2s1,C24671777_decoy,CASP3,Decoy,0,-7.71348,-5.68,-2.55,-5.242615375001339
C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(S(C)(=O)=O)CC1,C52798597_decoy,CASP3,Decoy,0,-7.36751,-8.0,-1.73,-5.785160594877821
CN1N=C(C(=O)N(Cc2cccs2)c2ccc3c(c2)OCCO3)CCC1=O,C53177544_decoy,CASP3,Decoy,0,-7.83319,-6.41,-2.29,-7.068251697021365
O=C(c1cnn(Cc2ccccc2Cl)c1)N1CCN(c2ncccn2)CC1,C12608041_decoy,CASP3,Decoy,0,-6.93129,-6.86,-1.92,-5.826517298979431
Cn1cc(-c2nc(C(=O)OCC(=O)N3CCc4ccccc43)cs2)cn1,C53912689_decoy,CASP3,Decoy,0,-5.76545,-6.47,-1.67,-4.8455325178087145
Cn1cc(-c2nc(CN3CCC[C@H](c4nnc5n4CCCCC5)C3)cs2)cn1,C60466943_decoy,CASP3,Decoy,0,-8.38877,-7.7,-1.56,-6.822259006896866
C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc(-n3cnnn3)cc2)CC1,C60467602_decoy,CASP3,Decoy,0,-6.58177,-7.3,-0.82,-6.901559912556738
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc(=O)c2ccccc2o1,C24329813_decoy,CASP3,Decoy,0,-6.45275,-7.14,-1.1,-5.786025376456528
CCN(C(=O)CS[C@@H]1N=C2C(=O)N=C(C)N=C2N1C)c1cccc(C)c1,C64605530_decoy,CASP3,Decoy,0,-6.88672,-7.13,-1.51,-7.316719122878468
CCN(C[C@@H]1CCCO1)C(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12,C65309253_decoy,CASP3,Decoy,0,-7.13088,-5.25,-0.73,-5.229561294511548
CCN1C[C@H](n2cnc(-c3ccccc3)c2-c2cnn3cccnc23)CC1=O,C65397479_decoy,CASP3,Decoy,0,-6.26496,-7.5,-1.66,-5.153215094376976
N#Cc1cccnc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1,C66437844_decoy,CASP3,Decoy,0,-7.51296,-5.55,-1.3,-4.9377374170548585
O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)CN1Cc1ccco1,C66770622_decoy,CASP3,Decoy,0,-7.84978,-6.06,-2.77,-6.060834925496316
Cc1nc(C)c(COC(=O)c2nnn(-c3ccc4ncccc4c3)c2C)s1,C66771112_decoy,CASP3,Decoy,0,-8.40691,-7.87,-2.62,-6.476347218935195
N#Cc1ccc(OC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1F,C66805271_decoy,CASP3,Decoy,0,-7.07374,-7.59,-1.82,-4.834593490116494
CCn1cnnc1C1CCN(C(=O)[C@@H]2CC(c3ccc(Cl)s3)=NO2)CC1,C67005429_decoy,CASP3,Decoy,0,-8.87123,-6.56,-0.39,-6.610530262280599
Cc1c(C(=O)N(C)CCC(F)(F)F)nnn1-c1ccc2c(c1)OCCO2,C67145930_decoy,CASP3,Decoy,0,-6.13243,-6.9,-0.35,-5.501896101877674
COc1nccc(Oc2ccc(CN3CCOCC3)c3cccnc23)c1C#N,C67558931_decoy,CASP3,Decoy,0,-7.79973,-5.82,-1.16,-5.844798543870402
CCOC(=O)[C@@H](C)N1C(=O)S/C(=C\c2cc(Br)c(OCC(=O)[O-])c(OC)c2)C1=O,C03005570_decoy,CASP3,Decoy,0,-7.9472,-5.88,-1.22,-6.161438792325959
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@H](NC(=O)Cn3nc(C(F)(F)F)cc3C3CC3)[C@@H]2SC1,C09431452_decoy,CASP3,Decoy,0,-6.96606,-7.45,-1.68,-6.438880086932148
CCN(C(=O)[C@@H](C)Sc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13019008_decoy,CASP3,Decoy,0,-9.26192,-7.06,-0.69,-8.38442267299778
CCN(C(=O)CSc1nnc(-c2cccc(C)c2)n1CCC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13034222_decoy,CASP3,Decoy,0,-8.0727,-7.22,-1.19,-7.453136231100663
CCN(C(=O)CSc1nnc(-c2cccs2)n1[C@H](C(=O)[O-])C(C)C)[C@H]1CCS(=O)(=O)C1,C13034244_decoy,CASP3,Decoy,0,-9.29347,-6.6,-1.88,-8.576280198318052
CCN(C(=O)CSc1nnc(-c2cccs2)n1[C@@H](C(=O)[O-])C(C)C)[C@H]1CCS(=O)(=O)C1,C13034246_decoy,CASP3,Decoy,0,-8.69993,-6.66,-1.05,-7.644177925682203
CCOc1ccc(-c2nnc(SCC(=O)N[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])cc1,C13034716_decoy,CASP3,Decoy,0,-9.082,-7.25,-1.75,-6.215728335557097
CCN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)c1cc(/C=C/C(=O)[O-])cc(OC)c1OC,C13072417_decoy,CASP3,Decoy,0,-8.5962,-5.91,-1.67,-6.525007774234877
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)/C=C/c1cc(OC)c(OC)c(OC)c1)CC2,C13182054_decoy,CASP3,Decoy,0,-8.35972,-5.77,-1.52,-5.508849745710365
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)/C=C/c1cc(OC)c(OC)c(OC)c1)CC2,C13182057_decoy,CASP3,Decoy,0,-7.82074,-7.04,-1.95,-6.547202484120874
CCOC(=O)c1cc(C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2CC(=O)[O-])cc([N+](=O)[O-])c1,C13183435_decoy,CASP3,Decoy,0,-7.05918,-7.22,-2.47,-6.0682542518148965
CCOc1cc(C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2CC(=O)[O-])ccc1OC(F)F,C13183582_decoy,CASP3,Decoy,0,-7.10005,-5.65,-1.08,-5.988014401053137
COc1cc(OC)c(OC)cc1/C=C/C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1CC(=O)[O-],C13183698_decoy,CASP3,Decoy,0,-7.68958,-6.89,-0.33,-6.754122770652987
CCOc1ccc(-c2nnc(SCC(=O)N3CCN(C(=O)c4ccco4)CC3)n2CC(=O)[O-])cc1,C13194898_decoy,CASP3,Decoy,0,-7.44125,-6.31,-1.45,-5.91987838617045
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nnc(-c2ccc(OC)cc2)n1CC(=O)[O-],C13201476_decoy,CASP3,Decoy,0,-7.96807,-6.66,-1.76,-5.666928574599309
CCCc1nnc(SCC(=O)N2N=C(c3ccc(C)o3)C[C@@H]2c2ccco2)n1CC(=O)[O-],C13203121_decoy,CASP3,Decoy,0,-7.31002,-7.47,-2.01,-6.872439743123564
Cc1cccc(-c2nnc(SCC(=O)N(CC(C)C)[C@@H]3CCS(=O)(=O)C3)n2CC(=O)[O-])c1,C13205743_decoy,CASP3,Decoy,0,-8.30363,-6.3,-1.73,-9.425390280342494
CC[C@@H](C)N(C(=O)CSc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13220587_decoy,CASP3,Decoy,0,-7.80949,-6.53,-1.46,-7.161106185113313
CC[C@H](C)N(C(=O)CSc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-])[C@H]1CCS(=O)(=O)C1,C13220589_decoy,CASP3,Decoy,0,-7.69317,-6.85,-0.71,-7.451340485304839
N#CCCN(CCC#N)C(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1-c1ccccc1F,C13231273_decoy,CASP3,Decoy,0,-8.75807,-6.38,-1.9,-6.788444525620795
CCCN(C(=O)CSc1nc2ccccc2c(=O)n1[C@H](C(=O)[O-])C(C)C)[C@@H]1CCS(=O)(=O)C1,C13234260_decoy,CASP3,Decoy,0,-6.46505,-7.69,-2.13,-6.928890347044114
CCCN(C(=O)CSc1nc2ccccc2c(=O)n1[C@@H](C(=O)[O-])C(C)C)[C@H]1CCS(=O)(=O)C1,C13234263_decoy,CASP3,Decoy,0,-6.64102,-6.43,-2.68,-5.753533903391363
CCCN(C(=O)CSc1nnc(-c2ccc(C)cc2)n1CC(=O)[O-])[C@@H]1CCS(=O)(=O)C1,C13235369_decoy,CASP3,Decoy,0,-8.74476,-7.39,-2.11,-6.1023534851638
N#CCCn1cc(/C=C2/SC(=S)N(CCCCC(=O)[O-])C2=O)c(-c2ccc3c(c2)OCO3)n1,C13264716_decoy,CASP3,Decoy,0,-7.81559,-7.37,-0.72,-7.46819202864655
N#CCCn1cc(/C=C2/SC(=S)N(CCCCC(=O)[O-])C2=O)c(-c2ccc(F)cc2)n1,C13362786_decoy,CASP3,Decoy,0,-8.86328,-7.06,-1.76,-7.515174123313753
CCOC(=O)c1ccsc1NC(=O)CSc1nc2ccccc2c(=O)n1CC(=O)[O-],C13445046_decoy,CASP3,Decoy,0,-7.20364,-6.93,-0.82,-10.681629793168062
COc1cc([C@H]2C(C(=O)[O-])=C(COC(C)=O)Oc3cc4c(cc32)OCO4)cc(OC)c1OC(C)=O,C17176660_decoy,CASP3,Decoy,0,-6.34466,-5.99,-3.09,-6.05148620145218
CCOC(=O)c1[nH]c(C)c(C(=O)C2=C([O-])C(=O)N(Cc3cccnc3)[C@H]2c2cccc([N+](=O)[O-])c2)c1C,C09192758_decoy,CASP3,Decoy,0,-6.76373,-7.64,-2.66,-7.412582942396383
COc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@H](C)O4)=C([O-])C(=O)N2CCCn2ccnc2)cc1OC,C15924821_decoy,CASP3,Decoy,0,-8.14931,-6.2,-2.71,-6.606872872873953
COc1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCCn2ccnc2)cc1OC,C15924827_decoy,CASP3,Decoy,0,-8.45527,-6.52,-2.28,-8.62768635006127
CCOc1ccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)cc1S(=O)(=O)N1CCCC1,C22021508_decoy,CASP3,Decoy,0,-8.59323,-7.2,-2.99,-6.650745790168548
CCOc1ccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)cc1S(=O)(=O)N(C)C,C22021535_decoy,CASP3,Decoy,0,-7.74028,-6.58,-2.96,-6.844132362689908
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCCn3ccnc3)[C@H]2c2cccc([N+](=O)[O-])c2)cc1F,C16730996_decoy,CASP3,Decoy,0,-7.79282,-8.0,-1.5,-7.529515614569583
CCOc1cc([C@@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2CCCn2ccnc2)ccc1O,C09425184_decoy,CASP3,Decoy,0,-8.57354,-6.92,-1.69,-7.527911416021664
CCOc1ccc([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1S(=O)(=O)N(C)C,C25146784_decoy,CASP3,Decoy,0,-6.72241,-6.45,-3.14,-5.382945962588848
COC(=O)c1cccc(CN2C(=O)S/C(=C\c3ccc(OCC(=O)[O-])c(OC)c3)C2=O)c1,C35146991_decoy,CASP3,Decoy,0,-8.32847,-7.17,-2.22,-8.783947010725491
CCOc1cc2c(cc1OCC)[C@H](C(=O)[O-])[C@H](c1cc(OC)c(OC)c(OC)c1)N(C)C2=O,C03957639_decoy,CASP3,Decoy,0,-6.57357,-7.35,-1.17,-6.576360737081669
CCOc1cc2c(cc1OCC)[C@@H](C(=O)[O-])[C@H](c1cc(OC)c(OC)c(OC)c1)N(C)C2=O,C03957635_decoy,CASP3,Decoy,0,-6.65761,-6.5,-1.92,-7.082602470135341
CCn1c(N2CCOCC2)c(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C33813441_decoy,CASP3,Decoy,0,-9.53894,-6.54,-2.02,-7.420757801970872
COCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C)c(C#N)c1=O,C38620583_decoy,CASP3,Decoy,0,-8.84371,-7.07,-3.11,-6.689061942880669
COCCn1c([O-])c(C(=O)CCCN2C(=O)/C(=C/c3ccccc3)SC2=S)c(C)c(C#N)c1=O,C38620592_decoy,CASP3,Decoy,0,-7.70012,-6.07,-1.48,-5.652662043202532
CCCCn1c(N2CCCC2)c(/C=C2/SC(=S)N(CCCC(=O)[O-])C2=O)c(C)c(C#N)c1=O,C39770563_decoy,CASP3,Decoy,0,-8.36349,-6.11,-3.38,-6.462305910493561
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@@H]1c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2,C40096288_decoy,CASP3,Decoy,0,-7.59701,-7.66,-2.78,-7.072899152001542
CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@](Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])N[C@H]2c1ccc(N(C)C)cc1,C33869011_decoy,CASP3,Decoy,0,-6.63623,-6.67,-3.42,-6.195344501183525
CCOC(=O)CSc1nnc(/N=C(\[O-])C(=O)c2c(C)nn(-c3ccccc3)c2C)s1,C45947652_decoy,CASP3,Decoy,0,-7.80154,-5.71,-2.16,-5.639744453801756
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nc3nc(C)c(CC(=O)[O-])c(C)n3n2)c1C,C13405080_decoy,CASP3,Decoy,0,-7.82554,-5.9,-2.62,-5.472694339475932
C[C@H](Sc1nnc(C2CC2)n1Cc1ccco1)C(=O)c1ccc([N-]S(C)(=O)=O)cc1,C57480964_decoy,CASP3,Decoy,0,-8.34633,-8.1,-1.62,-6.672695684177553
C[C@@H](Sc1nnc(C2CC2)n1Cc1ccco1)C(=O)c1ccc([N-]S(C)(=O)=O)cc1,C57480967_decoy,CASP3,Decoy,0,-8.46261,-8.2,-1.37,-6.623400756689495
CCOCCCn1c(SCC(=O)/N=C2\O[C@H](C)c3c(C)nnc([O-])c32)nnc1-c1ccncc1,C39789974_decoy,CASP3,Decoy,0,-7.89345,-7.78,-1.68,-7.44357337849826
CCOC(=O)C1CCN(C(=O)C2=NN=C(S(=O)(=O)[N-]c3ccc(OCC)cc3)C2)CC1,C32985022_decoy,CASP3,Decoy,0,-7.7895,-6.84,-1.93,-6.687430021839931
Nc1cccc([S@+]([O-])Cc2ccc(OCCCCCCCCc3ccc(F)cc3)c(/C=C/C(=O)[O-])n2)c1,C13833528_decoy,CASP3,Decoy,0,-9.39624,-7.45,-3.96,-7.046180377223
C=CCc1cc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc(OCC)c1OCc1ccc(C(=O)[O-])cc1,C16688413_decoy,CASP3,Decoy,0,-7.67746,-6.37,-3.12,-5.5542287469680085
O=C([O-])CCCC/C=C(\c1ccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1,C29561517_decoy,CASP3,Decoy,0,-9.69275,-7.3,-3.81,-6.560000448225599
O=C([O-])CCCC/C=C(\c1cccnc1)c1cccc(C2=N[C@@H](C(=O)NCCCCC3CCCCC3)CO2)c1,C29563071_decoy,CASP3,Decoy,0,-10.0534,-6.25,-3.26,-6.761592003304215
O=C([O-])CCCC/C=C(\c1ccc(C2=N[C@H](C(=O)NCCCCC3CCCCC3)CO2)cc1)c1cccnc1,C29566310_decoy,CASP3,Decoy,0,-9.33165,-6.6,-2.22,-7.987695282952707
CCOCC[C@]1(Oc2ccc(Oc3ccc(C(=O)NCc4ccccn4)cc3)cc2)C(=O)NC(=O)N=C1[O-],C34802384_decoy,CASP3,Decoy,0,-8.18275,-7.0,-1.67,-7.8776725846651265
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@@H]1c1ccc(C(F)(F)F)cc1,C35693064_decoy,CASP3,Decoy,0,-9.77305,-6.13,-3.91,-7.453390269261618
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N[C@@H](C)c3ccccc3)N2[C@@H]1c1ccc(OC)cc1,C35693124_decoy,CASP3,Decoy,0,-8.15626,-7.68,-3.19,-7.240693056981865
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc(F)cc3)N2[C@H]1c1ccc(OC)cc1,C35693130_decoy,CASP3,Decoy,0,-7.77181,-5.43,-2.2,-6.34561147765251
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1ccc(Cl)cc1,C35696288_decoy,CASP3,Decoy,0,-10.0971,-5.33,-3.99,-7.3345306422897
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1ccc(C(C)C)cc1,C35696443_decoy,CASP3,Decoy,0,-9.96331,-5.97,-2.78,-7.415244028931899
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1cc(OC)cc(OC)c1,C35700934_decoy,CASP3,Decoy,0,-7.92383,-5.26,-0.85,-6.382788110768792
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc(F)cc3)N2[C@@H]1c1ccccc1OC,C35701038_decoy,CASP3,Decoy,0,-9.53159,-7.22,-2.88,-7.975701762716004
CCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3cccc(OCc4ccccc4)c3)N12,C35703582_decoy,CASP3,Decoy,0,-9.42341,-6.92,-4.28,-8.131408799285007
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1cc(OC)ccc1OC,C35703645_decoy,CASP3,Decoy,0,-9.03014,-5.74,-2.84,-7.623844702041797
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@H]1c1cc(OC)cc(OC)c1,C36053195_decoy,CASP3,Decoy,0,-9.20003,-7.21,-2.56,-7.999621593138975
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@H]1c1ccc(OC)cc1OC,C36058679_decoy,CASP3,Decoy,0,-8.58966,-7.08,-3.52,-7.462423895639135
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccc3)N2[C@H]1c1cccc(OC)c1OC,C36058715_decoy,CASP3,Decoy,0,-9.90177,-5.25,-3.61,-7.566144739150061
CCC1=C(C(=O)OC)[C@H](c2cccc(OC)c2OC)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C36064580_decoy,CASP3,Decoy,0,-8.35265,-6.19,-1.6,-7.56557619131441
C/C=C/[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(CCCCCC)C(=O)c1cc([N+](=O)[O-])ccc1[O-],C36513899_decoy,CASP3,Decoy,0,-7.65057,-7.25,-1.61,-7.3871964126266
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(OC)c(OC)c1,C36570239_decoy,CASP3,Decoy,0,-7.49931,-6.46,-3.02,-6.606500350934123
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc([N+](=O)[O-])cc1,C36570247_decoy,CASP3,Decoy,0,-6.72071,-7.47,-3.73,-7.0685445649463
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(N(C)C)cc1,C36570300_decoy,CASP3,Decoy,0,-7.63827,-6.91,-2.97,-7.374005198424463
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(N(C)C)cc1,C36570301_decoy,CASP3,Decoy,0,-7.53844,-6.69,-3.96,-6.998482028887119
CCC(CC)[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)c1cc([N+](=O)[O-])ccc1[O-])C(C)(C)C,C36585901_decoy,CASP3,Decoy,0,-7.44036,-7.48,-3.42,-6.874190384596087
CCOC(=O)COc1c(I)cc(/C=N\Nc2ccc(C(=O)[O-])cc2)cc1OCC,C36622902_decoy,CASP3,Decoy,0,-7.24196,-5.72,-3.24,-6.0549306093458215
CCCCCC(=O)Cc1cc(O)cc(O)c1C(=O)Oc1cc(CC(=O)CCCCC)c(C(=O)[O-])c(OC)c1,C04165719_decoy,CASP3,Decoy,0,-8.75606,-7.46,-3.65,-7.492009324662762
CCOc1cc([C@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2CCOCCO)ccc1OCCC(C)C,C40076303_decoy,CASP3,Decoy,0,-8.29693,-7.09,-2.63,-7.5972291239171295
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(Br)cc3)=C([O-])C(=O)N2CCO)cc1OC,C40076973_decoy,CASP3,Decoy,0,-8.83068,-4.99,-3.67,-7.239742599656419
CCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCOCCO)cc1OC,C40079598_decoy,CASP3,Decoy,0,-7.88479,-5.2,-2.89,-7.041564651776209
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(OC)cc3C)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40079720_decoy,CASP3,Decoy,0,-8.17246,-6.54,-4.1,-7.528314447002281
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccc(OC)c(OC)c2)c(C)c1,C40083537_decoy,CASP3,Decoy,0,-8.20784,-5.79,-1.7,-6.855332453946238
CCCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCCC)cc3C)=C([O-])C(=O)N2CCO)cc1OC,C40083926_decoy,CASP3,Decoy,0,-9.14412,-6.98,-2.25,-11.289104919783709
CCCCCCOc1ccc([C@H]2C(C(=O)c3ccc(OCCCC)cc3C)=C([O-])C(=O)N2CCO)cc1OC,C40083928_decoy,CASP3,Decoy,0,-8.79459,-7.4,-1.23,-8.142789480727672
COC(=O)c1ccc([C@H]2C(C(=O)c3ccc(OCC(C)C)cc3C)=C([O-])C(=O)N2CCOCCO)cc1,C40084702_decoy,CASP3,Decoy,0,-8.78318,-6.78,-1.51,-7.706192360435968
COc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc1C,C40085187_decoy,CASP3,Decoy,0,-8.80923,-5.97,-2.55,-6.679160703636203
CCCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c2ccccc2OCCC)cc1C,C40092676_decoy,CASP3,Decoy,0,-8.62188,-5.9,-1.79,-6.7888875011528445
CCCCCOc1ccc([C@@H]2C(C(=O)c3ccc(OCCCC)c(C)c3)=C([O-])C(=O)N2CCO)cc1OCC,C40092819_decoy,CASP3,Decoy,0,-8.7882,-6.43,-2.13,-9.65023149018512
CCCCOc1ccc([C@H]2C(C(=O)c3ccc(C)c(F)c3)=C([O-])C(=O)N2CCOCCO)cc1OCC,C40099825_decoy,CASP3,Decoy,0,-8.51022,-7.12,-2.76,-7.4766789179356445
C=CCOc1ccccc1[C@H]1C(C(=O)c2cccc(OCc3ccccc3Cl)c2)=C([O-])C(=O)N1CCO,C40102925_decoy,CASP3,Decoy,0,-8.17646,-7.08,-2.51,-7.260830475689603
Cc1ccc(COc2cccc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@@H]3c3cccc(Cl)c3)c2)cc1,C40109048_decoy,CASP3,Decoy,0,-8.20177,-7.8,-0.84,-8.144306978561188
Cc1ccc(COc2cccc(C(=O)C3=C([O-])C(=O)N(CCOCCO)[C@H]3c3ccccc3Cl)c2)cc1,C40109061_decoy,CASP3,Decoy,0,-8.19544,-7.26,-1.9,-7.516657647314125
O=C(C1=C([O-])C(=O)N(CCOCCO)[C@H]1c1cccc(O)c1)c1ccc(OCc2ccccc2Cl)cc1,C40109539_decoy,CASP3,Decoy,0,-7.81256,-7.78,-1.99,-6.502704941004249
CCCCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCO)cc1OC,C39898117_decoy,CASP3,Decoy,0,-8.48774,-5.44,-3.29,-6.551064154785866
CCCCCCOc1ccc([C@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCOC)cc1OC,C39898216_decoy,CASP3,Decoy,0,-8.95386,-5.96,-2.64,-7.330624203269594
CCCCOc1ccc([C@@H]2c3c(n[nH]c3-c3cc(Cl)ccc3[O-])C(=O)N2CCCOC)cc1OCC,C39898299_decoy,CASP3,Decoy,0,-8.79181,-6.4,-3.75,-8.188695972665752
CCCCCCOc1ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)[N-]c3onc(C)c3C)cc2)cc1OC,C40852681_decoy,CASP3,Decoy,0,-8.03692,-6.9,-4.28,-6.280816032140257
CCCOCCN1C(=O)[C@H]2[C@@H](c3cccc(OC(F)(F)F)c3)N[C@@](Cc3ccccc3)(C(=O)[O-])[C@@H]2C1=O,C33905741_decoy,CASP3,Decoy,0,-7.22089,-6.35,-2.14,-7.842784881374735
CCCC/C=C/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,C43218452_decoy,CASP3,Decoy,0,-6.26975,-7.32,-1.99,-6.794998282495019
CCO/C([O-])=C1\C(COCCNc2n[nH]c(N)n2)=NC(C)=C(C(=O)OC)[C@@H]1c1cccc(Cl)c1Cl,C27630833_decoy,CASP3,Decoy,0,-10.0175,-6.07,-1.85,-8.721880963571243
CCN(CC)S(=O)(=O)c1cc(C(=O)OCc2cc(=O)n3cc(Br)ccc3n2)ccc1F,C02640494_decoy,CASP3,Decoy,0,-7.84904,-7.35,-2.08,-6.881328049360162
C=CCn1/c(=N/C(=O)c2ccc(S(=O)(=O)N(CCC#N)CCC#N)cc2)sc2cccc(F)c21,C09079003_decoy,CASP3,Decoy,0,-8.00323,-6.05,-3.56,-5.946252427466564
CCOC(=O)/C=c1\s/c(=C\c2ccc(C(=O)OC)cc2)c(=O)n1CC(=O)N1C[C@@H](C)C[C@H](C)C1,C03411605_decoy,CASP3,Decoy,0,-8.46142,-7.26,-1.98,-7.448330036616188
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)OCC(=O)[C@H](C#N)c3nc(C)cs3)cc2)c1,C09254104_decoy,CASP3,Decoy,0,-9.81115,-8.01,-2.85,-7.653866931343308
COc1cc(C(=O)COC(=O)c2cc3c(C)nn(-c4ccc(F)cc4)c3s2)cc(OC)c1OC,C03241277_decoy,CASP3,Decoy,0,-8.77548,-7.67,-1.41,-7.1575900535138
COCCCn1c(SCc2nc3ccccc3c(=O)n2CC#N)nnc1-c1ccc(Cl)cc1,C03432326_decoy,CASP3,Decoy,0,-8.60737,-7.04,-1.43,-8.157628030561103
CCc1nn2c(=O)cc(CSc3nnc(COc4ccccc4Cl)n3C3CC3)nc2s1,C09724223_decoy,CASP3,Decoy,0,-8.76611,-7.83,-1.3,-6.628007405756967
O=C(CSc1nnnn1-c1cccc(F)c1)N(Cc1cccs1)c1ccc2c(c1)OCCO2,C09871222_decoy,CASP3,Decoy,0,-8.52045,-6.3,-2.15,-6.79552998421269
C=CCn1c(SCC(=O)N2N=C(c3cccs3)C[C@@H]2c2ccco2)nnc1-c1cccnc1,C09875967_decoy,CASP3,Decoy,0,-9.86696,-6.95,-2.37,-8.783008737979435
CCCCN(C(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1)[C@H]1CCS(=O)(=O)C1,C10015164_decoy,CASP3,Decoy,0,-9.58513,-6.59,-3.88,-8.08392216184667
Cc1cccc(N2CCN(C(=O)CSc3nnnn3-c3ccc(OC(F)(F)F)cc3)CC2)c1,C10350755_decoy,CASP3,Decoy,0,-6.24236,-6.95,-2.91,-5.6077347563125
Cc1ccc(C2=NN(C(=O)CSc3nnc(-c4ccncc4)n3C3CC3)[C@H](c3ccco3)C2)cc1,C12568842_decoy,CASP3,Decoy,0,-8.38129,-8.28,-4.32,-7.653975417486355
O=C1c2ccccc2C(=O)N1CC(=O)N(CCCn1ccnc1)c1nc2ccc(Cl)cc2s1,C10581237_decoy,CASP3,Decoy,0,-7.10906,-6.31,-1.9,-5.799488369919424
CCOc1cc(C(=O)N2CCN(c3nccn3-c3cccc(Cl)c3)CC2)cc(OCC)c1OCC,C13694236_decoy,CASP3,Decoy,0,-8.32173,-5.83,-3.14,-5.950043456216648
COc1ccc([C@H]2C3=C(CC(C)(C)CC3=O)N=C(C)C2C(=O)OC[C@H]2CCCO2)c(OC)c1OC,C09113563_decoy,CASP3,Decoy,0,-8.92601,-7.16,-2.95,-7.392487763982839
CCn1ncc2c(C(=O)O[C@H](C)C(=O)c3ccc4c(c3)CCN4C(C)=O)cc(-c3ccccc3)nc21,C14363349_decoy,CASP3,Decoy,0,-8.1504,-9.16,-1.26,-7.704715730416882
CCOC(=O)C1CCN(C(=O)c2cnn(-c3ncc(C)c(-c4ccc(F)cc4)n3)c2C(C)C)CC1,C14966951_decoy,CASP3,Decoy,0,-7.55309,-7.26,-2.95,-5.523641361960224
CCOc1c(Br)cc(/C=C2\N=C(c3cc(OC)c(OC)c(OC)c3)OC2=O)cc1OC,C15263301_decoy,CASP3,Decoy,0,-9.4421,-6.4,-3.25,-7.068341721409249
COc1ccc(-n2nc(-c3ccc(C)o3)cc2C(=O)N(C)CCc2ccc(OC)c(OC)c2)cc1,C16605794_decoy,CASP3,Decoy,0,-7.96421,-5.52,-2.29,-7.414878232559177
COc1ccc([C@@H]2[C@H](C(=O)N3C[C@H](C)C[C@H](C)C3)CCC(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1,C09935353_decoy,CASP3,Decoy,0,-8.27898,-6.01,-3.03,-6.501970962513268
COC(=O)[C@@H]1C[C@@]2(C)[C@@H](CC[C@]2(OC(C)=O)C(=O)COC(C)=O)[C@@H]2CCC3=CC(=O)C=C[C@@]3(C)[C@@H]21,C20310453_decoy,CASP3,Decoy,0,-7.62498,-5.91,-1.41,-6.1619328771792485
COC(=O)c1c(OCCc2cccs2)cc(=O)n2c1CCN(Cc1ccc3nsnc3c1)CC2,C20991904_decoy,CASP3,Decoy,0,-11.3045,-6.2,-2.02,-7.325482637031471
COc1ccc(-c2nc(CSc3nnc([C@H]4COc5ccccc5O4)n3C)cs2)cc1OC,C23638612_decoy,CASP3,Decoy,0,-10.1728,-6.82,-2.74,-6.44410852204602
Cc1ccc(N(CCC#N)C(=O)CSc2nnnn2-c2ccc(OC(F)(F)F)cc2)cc1C,C24788508_decoy,CASP3,Decoy,0,-7.24252,-7.09,-3.18,-6.749001048358895
CCOC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2nn(-c3ccccc3)cc2OC)CC1,C32848133_decoy,CASP3,Decoy,0,-7.32007,-6.15,-3.17,-5.228252766736267
Cc1ccc(/C=C/c2onc(C)c2S(=O)(=O)N2CCC[C@H](C(=O)N(C)Cc3ccco3)C2)cc1,C32944082_decoy,CASP3,Decoy,0,-7.59131,-6.53,-2.86,-6.063843005967344
CC[C@@H]1SC2=NC(C)=C(C(=O)OCc3ccccc3)[C@@H](c3ccc(OC(C)=O)c(OC)c3)N2C1=O,C33423354_decoy,CASP3,Decoy,0,-6.84708,-7.46,-1.76,-7.229203205048692
CCOC(=O)c1sc2c(c1C)c(=O)n(Cc1ccc(C)cc1C)c(=O)n2CC(=O)N(CC)CC,C34776149_decoy,CASP3,Decoy,0,-7.26954,-5.26,-2.7,-5.677762879406007
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)c3ccc(C(C)(C)C)cc3)[C@H](C)C2)c1C(=O)OCC,C35059371_decoy,CASP3,Decoy,0,-7.08662,-7.42,-4.73,-6.355747037610115
CC(C)C(=O)N(CCN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1)CC1=CC[C@@H]2C[C@H]1C2(C)C,C35095571_decoy,CASP3,Decoy,0,-7.67284,-7.28,-3.61,-6.349736905720162
CCC(=O)N1CCN(C(=O)CSc2nnc(-c3ccco3)n2-c2cccc(C(F)(F)F)c2)C[C@H]1C,C35141148_decoy,CASP3,Decoy,0,-7.78455,-8.12,-5.06,-7.009665291798295
C=CCOC(=O)c1c(C)nc(-c2ccccc2)nc1C(=O)N1CCN(C(=O)c2ccc(C)cc2)[C@@H](C)C1,C35175632_decoy,CASP3,Decoy,0,-6.69938,-6.41,-1.44,-5.884609551770619
CCOC(=O)C1=C(C)N(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)C(=O)C[C@H]1c1ccccc1F,C35292782_decoy,CASP3,Decoy,0,-8.0482,-6.95,-2.05,-5.9230688698088905
CCCCCOc1ccc([C@@H]2c3c(oc4ccc(F)cc4c3=O)C(=O)N2c2nnc(C)s2)cc1OC,C35485892_decoy,CASP3,Decoy,0,-9.0655,-6.1,-3.48,-6.95142950592278
CCOc1ccccc1N1CCN(C(=O)c2ccc(CN3CCn4cccc4[C@H]3c3ccoc3)o2)CC1,C35846370_decoy,CASP3,Decoy,0,-8.42192,-6.79,-2.85,-7.135508780744304
O=C(OCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)C1=NN(c2ccccc2)C(=O)CC1,C36235094_decoy,CASP3,Decoy,0,-10.2112,-8.34,-2.77,-6.971496194934362
CCN(CC)C(=O)c1csc(CN2C(=O)COc3ccc(C(=O)COc4ccccc4C)cc32)n1,C37520069_decoy,CASP3,Decoy,0,-7.75424,-6.32,-1.55,-6.287802423276256
COCCCN1C(=O)C[C@@](CC(=O)N(C)C[C@@H]2N=NC3=C2CCCCC3)(c2ccccc2C)C1=O,C39355269_decoy,CASP3,Decoy,0,-7.87066,-6.88,-4.16,-6.399024488627187
COc1ccc(Cn2nnnc2S[C@H](C)C2=NC(=O)C3=C(c4ccccc4)CSC3=N2)cc1,C39444344_decoy,CASP3,Decoy,0,-7.80252,-5.52,-1.82,-5.560673785749226
C=CCn1c(SCC(=O)N2N=C(c3cc4ccccc4o3)C[C@H]2c2ccco2)nnc1C1CC1,C36661751_decoy,CASP3,Decoy,0,-8.77384,-7.15,-1.72,-7.737604421694332
CCOC(=O)C1=C(C(=O)CSc2nnc(-c3cccnc3)n2-c2ccccc2C)C(C)=N[C@@H]1C,C40061705_decoy,CASP3,Decoy,0,-8.57184,-7.31,-1.74,-8.219241252387706
CCOC(=O)C1=C(C(=O)CSc2nnc(-c3cccnc3)n2-c2ccccc2C)C(C)=N[C@H]1C,C40061707_decoy,CASP3,Decoy,0,-8.58293,-7.36,-1.85,-7.1746943900523314
CCCCS(=O)(=O)N1CCC(C(=O)N2CC=C(c3c(OC)cc(OC)cc3OC)CC2)CC1,C40135760_decoy,CASP3,Decoy,0,-8.30155,-6.45,-1.05,-6.157037877269354
COc1cccc(C(=O)N2CCN(Cc3nc(-c4ccc(OC(C)C)cc4)oc3C)CC2)c1OC,C40967697_decoy,CASP3,Decoy,0,-7.339,-6.61,-2.13,-5.274151787087628
CCOC(=O)C1=C(C)C(C(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2Cc2ccco2)=N[C@@H]1C,C44645926_decoy,CASP3,Decoy,0,-7.1781,-6.79,-2.17,-7.594802829856818
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)O[C@H](C)C(=O)N3CCc4ccccc43)cc2)c1C,C45412004_decoy,CASP3,Decoy,0,-7.79144,-6.76,-2.0,-6.081679833562953
c1coc(CN(C[C@@H]2CCCO2)[C@@H](c2ccc3ncccc3c2)c2nnnn2C2CCCCC2)c1,C57614102_decoy,CASP3,Decoy,0,-8.01616,-6.86,-3.8,-7.269860012268932
Cc1ccc(S(=O)(=O)Cn2nnnc2[C@@H](C(C)C)N2CCN(c3cccc(C)c3C)CC2)cc1,C57671722_decoy,CASP3,Decoy,0,-7.9047,-7.62,-2.55,-8.015696418804113
CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1OC,C59333042_decoy,CASP3,Decoy,0,-8.03111,-6.09,-1.47,-5.917431935695437
COc1cc(CCC(=O)OCC2=NC(=O)C3=C4CC[C@@H](C)C[C@@H]4SC3=N2)cc(OC)c1OC,C40012437_decoy,CASP3,Decoy,0,-8.56278,-7.25,-1.55,-6.28857394737068
CC(=O)C(=CN(C)C)C(=O)N1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1,C03116602_decoy,CASP3,Decoy,0,-6.0959,-6.76,-0.91,-4.956739875900206
COP(=O)(OC)[C@H](c1ccccc1)[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2,C02087219_decoy,CASP3,Decoy,0,-4.97283,-6.13,-1.73,-5.374636735210726
C[C@H]1C[C@H](C)CN(C(=O)[C@@H](C)[NH+]2CCN(S(=O)(=O)c3cccs3)CC2)C1,C07639235_decoy,CASP3,Decoy,0,-8.19979,-6.51,-3.03,-7.729785804765124
C[NH+](CC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)[C@@H]1CCS(=O)(=O)C1,C09255963_decoy,CASP3,Decoy,0,-8.37367,-6.92,-4.01,-6.358010627204958
Cc1sc2nc(C3CC3)n(C3CC[NH+](CC(=O)N(C)C)CC3)c(=O)c2c1C,C12145319_decoy,CASP3,Decoy,0,-8.12339,-6.19,-0.66,-6.620400076538562
Cc1cc(C)cc(N(CCC#N)C(=O)C[NH+]2CCC(C(=O)N(C)C)CC2)c1,C15297451_decoy,CASP3,Decoy,0,-7.71603,-5.92,-3.18,-6.8325511006470805
CC[NH+](CC)[C@@H]1CCN(C(=O)c2cc(-c3cnn(C)c3)nc3ccc(F)cc23)C1,C19226264_decoy,CASP3,Decoy,0,-7.28501,-6.16,-2.29,-6.198150366721325
COc1cc2c(cc1OC)CN([C@H]1CCC[NH+](Cc3cnn(C)c3)C1)CC2,C19837372_decoy,CASP3,Decoy,0,-6.97491,-5.13,-1.97,-4.333021234674924
CS(=O)(=O)c1ncc(CN2CC[NH+]3CCC[C@@H]3C2)n1CC1CCCCC1,C20205212_decoy,CASP3,Decoy,0,-6.95444,-5.3,-1.24,-4.177367066041257
COc1cc2c(cc1OC)CN([C@@H]1CCC[NH+](C3CCN(C(C)=O)CC3)C1)CC2,C20512776_decoy,CASP3,Decoy,0,-8.07541,-6.76,-1.82,-6.535666131796161
CN(Cc1ccc2ccccc2n1)C(=O)c1ccc(N2CCC[NH+](C)CC2)nc1,C20537309_decoy,CASP3,Decoy,0,-5.32008,-5.78,-1.25,-4.308691953189782
CC(=O)Cn1c2c(c3ccccc31)CC[NH+]([C@H]1CC(=O)N(c3ccccc3)C1=O)C2,C22607626_decoy,CASP3,Decoy,0,-8.26087,-6.63,-4.31,-5.366440203308991
CSc1nc(C2CC2)cc(C(=O)N2CCN(c3cc[nH+]cc3)CC2)c1C#N,C27141539_decoy,CASP3,Decoy,0,-9.53609,-6.0,-2.01,-7.288300119577577
CCC[NH+]1CCN(C(=O)c2ccc(Cn3cc(Br)cn3)o2)CC1,C28227392_decoy,CASP3,Decoy,0,-5.75692,-5.73,-1.38,-4.223756577110832
CC[NH+](Cn1nc([C@@H]2CCS(=O)(=O)C2)n(C)c1=S)C1CCCCC1,C32781597_decoy,CASP3,Decoy,0,-7.58221,-4.97,-0.85,-5.481055936675615
O=C([C@H](c1ccccc1)N1CC[NH+]([C@@H]2CCS(=O)(=O)C2)CC1)N1CCCC1,C22799007_decoy,CASP3,Decoy,0,-6.68999,-5.23,-0.06,-5.521416889922204
COc1ccc(C(=O)N2CCO[C@H](C[NH+]3CCN(c4ccc(F)cc4)CC3)C2)cc1,C34667051_decoy,CASP3,Decoy,0,-7.24257,-6.58,-2.7,-5.631233386608409
CCOc1ccc2c(c1)=C[C@@H](/C=C1\SC(=S)N(C[C@H]3CCCO3)C1=O)C(=O)[NH+]=2,C39352077_decoy,CASP3,Decoy,0,-7.91556,-6.16,-0.64,-5.018118618061138
CCOc1ccc2c(c1)=C[C@H](/C=C1\SC(=S)N(C[C@H]3CCCO3)C1=O)C(=O)[NH+]=2,C39352078_decoy,CASP3,Decoy,0,-8.07513,-6.06,-0.82,-6.246640657717321
O=C(c1ccsc1)N1CCC[C@@H]([NH+]2CCN(Cc3ccc4c(c3)OCO4)CC2)C1,C23373745_decoy,CASP3,Decoy,0,-6.49556,-6.42,-1.59,-6.151682356749637
COc1cc2c(cc1OC)[C@]13CC[NH+]4CC5=CCO[C@@H]6CC(=O)N2[C@@H]1[C@H]6[C@H]5C[C@H]43,C39945460_decoy,CASP3,Decoy,0,,-6.6,,
Cn1c(C[NH+]2CCCC[C@@H]2c2nc3ccccc3s2)cc(=O)n(C)c1=O,C40024435_decoy,CASP3,Decoy,0,-7.74545,-7.44,-3.55,-6.475232240862439
CC1(C)C[C@H]2C[C@](C)(CN2C(=O)CSc2nnc(C[NH+]3CCCC3)o2)C1,C39940754_decoy,CASP3,Decoy,0,-8.38136,-7.58,-2.03,-9.396595220967631
COCCN1CC[NH+](C2CCN(c3ccc(-n4cccn4)cc3)CC2)CC1,C48501679_decoy,CASP3,Decoy,0,-7.43304,-5.6,-1.66,-4.621101248741225
COc1cc(C(=O)N2CC[NH+]([C@H]3CCc4ccccc43)CC2)cc(OC)c1OC,C49719913_decoy,CASP3,Decoy,0,-7.70575,-6.66,-1.59,-5.392075720754305
Cc1nc2nc(=S)n(C[NH+](C)Cc3ccc(N(C)C)cc3)n2c(C)c1C,C54440556_decoy,CASP3,Decoy,0,-7.15989,-6.23,-2.44,-5.945333249599299
Fc1cc2c(c(CN3CCN(Cc4cn5ccccc5[nH+]4)CC3)c1)OCOC2,C54616117_decoy,CASP3,Decoy,0,-7.03609,-6.62,-2.01,-5.380473240154521
C[NH+]1CCN(CC2CCN(C(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)CC2)CC1,C57066373_decoy,CASP3,Decoy,0,-7.10655,-6.22,-1.02,-5.874244299808191
COc1ccc(-n2c(C[NH+]3CCC[C@H]3C(=O)N(C)C)nc3ccccc32)cc1,C58644126_decoy,CASP3,Decoy,0,-6.7246,-6.95,-4.45,-6.403941503773164
C[C@H]1C[C@@H](Sc2nnc(C[NH+]3CCCCC3)n2-c2ccccc2)C(=O)O1,C60891290_decoy,CASP3,Decoy,0,-7.76427,-5.9,-1.56,-6.221510073367091
CC(C)c1[nH+]ccn1CC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1,C62129167_decoy,CASP3,Decoy,0,-7.45112,-7.28,-1.01,-5.902048715791368
C[C@@H]1CN(C(=O)c2nc(C3CC3)n3ccccc23)C[C@H](C)N1CC[NH+](C)C,C62453781_decoy,CASP3,Decoy,0,-5.76678,-5.73,-1.71,-4.140361544173343
CC1=C2C(=O)N(C)CN=C2S[C@@H]1C(=O)N1CCC(C2=c3ccccc3=[NH+]C2)CC1,C63110947_decoy,CASP3,Decoy,0,-7.18382,-6.27,-1.52,-4.82646603130026
CC1(C)[C@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(Cc3cccnc3)CC(=O)N21,C63138750_decoy,CASP3,Decoy,0,-6.90736,-6.51,-1.24,-4.873001461133333
COc1ccccc1[C@H]1CN2C(=O)CN(C)C(=O)[C@]2(C)[C@@H]2[NH+]=c3ccccc3=C21,C63363095_decoy,CASP3,Decoy,0,-6.22496,-6.8,-1.96,-5.413462065287714
COc1ccc2c(c1)=C(C)[C@H](C(=O)N1CCc3cc(OC)c(OC)cc3C1)[NH+]=2,C63832774_decoy,CASP3,Decoy,0,-5.44677,-7.05,-2.46,-4.869984269570291
O=C(c1ccc(-n2ccnc2)cc1)N1CCC2=C(C1)[C@@H](c1ccccc1)[NH+]=N2,C63848184_decoy,CASP3,Decoy,0,-6.25412,-7.08,-3.12,-5.394942031551261
Cc1cccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCN2CCCCO2)n1,C64031704_decoy,CASP3,Decoy,0,-6.9127,-6.82,-1.43,-6.715492909888467
COC(=O)C1=C(C)C(C(=O)N2CCC(C[NH+]3CCC(C)CC3)CC2)=N[C@@H]1C,C64110512_decoy,CASP3,Decoy,0,-7.03007,-5.4,-0.84,-5.3594148594961775
O=C1[C@H]2CC3=c4ccccc4=[NH+][C@@H]3CN2C(=O)CN1/N=C/c1cccc(F)c1,C64277595_decoy,CASP3,Decoy,0,-7.04921,-5.8,-1.18,-4.082405343222806
CN1CCN(C(=O)[C@H]2CCc3ccccc3N2C(=O)CCC2=c3ccccc3=[NH+]C2)CC1,C64364934_decoy,CASP3,Decoy,0,-6.33623,-7.14,-1.5,-5.925730836627233
COc1ccc2c(c1)=C[C@@H](C(=O)N1CCN(C(=O)c3cccc(C)c3)CC1)[NH+]=2,C64541358_decoy,CASP3,Decoy,0,-5.7725,-6.1,-1.73,-4.748194123296304
CN(Cc1ccco1)C(=O)CC1CCN(C(=O)[C@H]2C=c3ccccc3=[NH+]2)CC1,C64743884_decoy,CASP3,Decoy,0,-7.2317,-6.24,-2.75,-5.701245670735163
COCCn1c([C@@H]2CCN(C(=O)Cc3ccsc3)C2)[nH+]c2ccncc21,C65292964_decoy,CASP3,Decoy,0,-7.95995,-6.62,-1.13,-6.2450276065770165
CCCc1cncnc1N1CCN(C2CC[NH+](Cc3ccco3)CC2)CC1,C65398711_decoy,CASP3,Decoy,0,-7.26821,-5.37,-3.2,-5.533375275461064
CCN(C(=O)C[NH+]1CCC[C@H](c2nnc3n2CCCCC3)C1)C1=CCCC1,C65607707_decoy,CASP3,Decoy,0,-7.4431,-7.23,-0.95,-6.752906703496957
CCN(C1CC[NH+](Cc2cc(F)cc3c2OCOC3)CC1)S(C)(=O)=O,C66884070_decoy,CASP3,Decoy,0,-7.06848,-7.07,-1.93,-5.497540987468364
C[NH+](C)[C@@H]1Cc2ccccc2N(C(=O)Cc2csc(-c3ncccn3)n2)C1,C67205482_decoy,CASP3,Decoy,0,-6.90545,-6.24,-1.57,-7.173760704005389
O=C([C@@H]1CCCC[NH+]1CC(=O)N(C1=CCCCC1)C1CC1)N1CCOCC1,C67230078_decoy,CASP3,Decoy,0,-7.68637,-6.75,-2.22,-6.278282052282222
Cc1noc(C)c1CSc1ccccc1C(=O)N(C)Cc1[nH+]ccn1C,C41835626_decoy,CASP3,Decoy,0,-6.40623,-5.89,-1.56,-5.836347967082028
CC1=CCC[C@]2(C)C[C@H]3OC(=O)[C@H](C[NH+]4CCN(c5ncccn5)CC4)[C@H]3C=C12,C04084935_decoy,CASP3,Decoy,0,-7.89047,-6.75,-1.6,-4.641103419753125
CCN(CC)C(=O)[C@@H]1c2cccn2-c2ccccc2C[NH+]1C1CCN(C(C)=O)CC1,C01742833_decoy,CASP3,Decoy,0,-7.14964,-6.37,-3.92,-7.881376306384569
COC(=O)c1ccc([C@H]2[C@H](C(C)=O)[NH+]3C=Cc4ccccc4[C@@H]3C2(C#N)C#N)cc1,C04454757_decoy,CASP3,Decoy,0,-6.70016,-5.39,-1.07,-5.196576810098596
O=C(OC[C@@H]1CCC[NH+]2CCCC[C@H]12)c1cc2ncc(Br)cn2n1,C04689289_decoy,CASP3,Decoy,0,-7.18121,-5.93,-2.47,-5.099472246021652
C[C@@H]1CN(c2[nH+]c(-c3ccc(Cl)cc3)c(S(C)(=O)=O)cc2C#N)C[C@@H](C)O1,C01502845_decoy,CASP3,Decoy,0,-5.72217,-5.42,-1.79,-3.611605764292608
O=S1(=O)CC[C@@H]([NH+]2CCN(c3nc(C(F)(F)F)nc4ccccc34)CC2)C1,C08075530_decoy,CASP3,Decoy,0,-7.78475,-6.51,-1.97,-5.866596775465816
O=c1cc(C[NH+]2CCC[C@@H]2c2ccc3c(c2)OCCCO3)nc2sccn12,C08271378_decoy,CASP3,Decoy,0,-8.81377,-7.37,-2.05,-6.211720435013995
Cc1ccc2nc(C[NH+]3CCC[C@H]3c3ccc4c(c3)OCCCO4)cc(=O)n2c1,C08310462_decoy,CASP3,Decoy,0,-6.68207,-7.77,-1.67,-5.135773925527645
O=C(c1cn(C2CCCCC2)nn1)N1CCC([NH+]2CCc3ccccc3C2)CC1,C11879437_decoy,CASP3,Decoy,0,-8.5987,-6.61,-0.71,-5.325020312388161
Cc1c2c(cc3c1O/C(=C\c1ccccc1F)C3=O)C[NH+]([C@@H]1CCS(=O)(=O)C1)CO2,C12409039_decoy,CASP3,Decoy,0,-6.66198,-7.93,-1.05,-5.023857033203522
Cc1ccc(-c2nc(C[NH+]3CCCN(C(=O)c4ccco4)CC3)c(C)o2)s1,C12710272_decoy,CASP3,Decoy,0,-7.4329,-6.2,-1.2,-5.824785771259309
c1nc(Sc2nnc(C[NH+]3CCCC3)o2)c2c3c(sc2n1)CCCCC3,C12808968_decoy,CASP3,Decoy,0,-7.25853,-6.21,-0.93,-4.82062428592105
C[C@@H](CCn1nc2ccccn2c1=O)[NH+]1CCN(c2cccc(Cl)c2)CC1,C13782780_decoy,CASP3,Decoy,0,-6.67944,-6.26,-1.52,-4.373999238663119
C[NH+]1CCN([C@H](c2ccc(Cl)cc2)c2nnnn2Cc2ccccc2)CC1,C19589866_decoy,CASP3,Decoy,0,-7.4176,-5.79,-2.01,-5.8415240400575374
CCCn1cc(-c2cc(C(=O)N(C)[C@@H]3CC[NH+](C)C3)c3cccc(C)c3n2)cn1,C23544045_decoy,CASP3,Decoy,0,-7.16841,-5.37,-4.24,-5.711515699570019
CCc1c(C)sc2nc(SC)nc(N3CC[NH+](CC(=O)N4CC4)CC3)c12,C34760868_decoy,CASP3,Decoy,0,-8.42997,-6.29,-0.68,-7.057498850181978
CCc1c(C)sc2nc(SCC(=O)N(C)C)nc(N3CC[NH+](C)CC3)c12,C34762249_decoy,CASP3,Decoy,0,-8.23597,-5.78,-1.21,-5.955289838884816
C[C@@H](C(=O)N1CCCc2ccccc21)N1CCN(Cc2cn3ccccc3[nH+]2)CC1,C22926320_decoy,CASP3,Decoy,0,-7.24519,-6.03,-4.05,-6.299507743764157
C[NH+](C)CCn1cnc2sc3c(c2c1=O)CCN(C(=O)C(C)(C)CCl)C3,C35498026_decoy,CASP3,Decoy,0,-7.74134,-4.41,-1.28,-5.534670717706788
COCC[NH+]1CCN(c2c3c(nc4cc(-c5cccc(F)c5)nn24)CCC3)CC1,C04966863_decoy,CASP3,Decoy,0,-8.02314,-5.7,-2.63,-5.4811683035566405
C[NH+]1CCN(c2nc(-c3ccccc3)ncc2S(=O)(=O)c2ccccc2)CC1,C05698883_decoy,CASP3,Decoy,0,-7.13418,-6.84,-1.79,-7.044970258809781
O=C1CCCN1CCC1CC[NH+]([C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1,C04196497_decoy,CASP3,Decoy,0,-8.09056,-6.71,-1.56,-5.518813861546652
O=C1/C(=C/c2cccs2)Oc2c1ccc1c2C[NH+](CCN2CCOCC2)CO1,C22935387_decoy,CASP3,Decoy,0,-9.7137,-5.91,-0.66,-6.399262213058392
Cc1ccc2c(c1)=C[C@H](CN(C[C@H]1COCCO1)C(=O)c1ccccc1)C(=O)[NH+]=2,C38806446_decoy,CASP3,Decoy,0,-7.86994,-6.7,-1.28,-7.041788739021722
Cc1ccc(C)n1[C@@H]1C=CS[C@H]1[C@@H]1C=C(/[NH+]=c2/c(C=O)coc3ccc(F)cc23)N=N1,C39316183_decoy,CASP3,Decoy,0,-7.49762,-8.15,-1.63,-6.6241711146912685
COc1cccc(C[NH+]2CCC[C@]3(CCN(C(=O)[C@@H]4N=C(C)C=C4C)C3)C2)c1OC,C39420818_decoy,CASP3,Decoy,0,-7.70352,-5.84,-1.5,-6.90306031652896
c1csc(CN2CCC[C@@H](N3CC[NH+](Cc4ccc5c(c4)OCO5)CC3)C2)n1,C23360067_decoy,CASP3,Decoy,0,-9.2357,-6.79,-1.84,-8.338559136272027
COc1cc2c(cc1OC)[C@@H]([C@H]1C=c3ccc(C)cc3=[NH+]C1=O)N(C(=O)C1CC1)CC2,C40010571_decoy,CASP3,Decoy,0,-6.14833,-6.97,-1.45,-4.141978859752366
Cc1nn2c(=O)cc(C[NH+]3CCN(Cc4ccc(Cl)s4)CC3)nc2s1,C43272926_decoy,CASP3,Decoy,0,-8.76821,-5.09,-1.34,-5.524548349792743
Cc1cc(CN2CC[NH+](Cc3nn(-c4ccc(F)cc4)c4c3CCC4)CC2)on1,C48364991_decoy,CASP3,Decoy,0,-6.58251,-6.69,-2.78,-5.775779649340936
CCn1c(-c2cccs2)nn(CN2CCN(c3cc[nH+]cc3)CC2)c1=S,C52569791_decoy,CASP3,Decoy,0,-8.31894,-5.86,-0.39,-7.471770891678735
COc1cc2c(cc1OCc1ccncc1)CC1=C(c3ccc(C#N)cc3)N=[NH+][C@@H]12,C52637024_decoy,CASP3,Decoy,0,-7.6357,-6.08,-5.05,-5.656973715862806
Cc1ccc(-n2nc3c(c2-n2cccc2)CN(C(=O)[C@H]2CCC[NH+](C)C2)C3)cc1,C56911344_decoy,CASP3,Decoy,0,-5.82291,-6.96,-0.9,-4.108500934155649
O=C(CSc1nncn1-c1cccc(Cl)c1)N1CCC[NH+](C2CC2)CC1,C61604749_decoy,CASP3,Decoy,0,-7.67322,-5.38,-0.17,-5.898076387843334
O=C(c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC[NH+](C2CC2)CC1,C61605151_decoy,CASP3,Decoy,0,-6.73065,-8.2,-3.78,-6.377659180198256
O=C(c1ccc2c(c1)OCO2)N1CCC(Cn2cc[nH+]c2-c2ccccc2)CC1,C62130203_decoy,CASP3,Decoy,0,-7.88808,-8.29,-1.49,-6.348600734653083
COc1ccc2c(c1)=C1CCN([C@@H]3CC(=O)N(c4ccccc4F)C3=O)C[C@H]1[NH+]=2,C63340001_decoy,CASP3,Decoy,0,-6.40007,-8.36,-2.63,-5.871605354239373
CC1(C)[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(/N=C/c3ccccc3)CC(=O)N21,C63350903_decoy,CASP3,Decoy,0,-6.31726,-6.58,-2.94,-4.821795625146752
CC1=N[C@H](C)S[C@H]1c1nnc(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2C)o1,C63403616_decoy,CASP3,Decoy,0,-9.76833,-6.95,-1.56,-7.796560510072884
CC(C)c1cc(C(=O)N2CCC[NH+](C(C)(C)C)CC2)c2cnn(C(C)C)c2n1,C63725004_decoy,CASP3,Decoy,0,-6.34963,-6.33,-3.37,-7.225827818620267
CN1N=C(C(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccccc2Cl)CCC1=O,C64043923_decoy,CASP3,Decoy,0,-7.24479,-7.1,-3.87,-5.165558890055542
Cc1cccc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C(=O)c2cn(C)c3ccccc3c2=O)n1,C64045117_decoy,CASP3,Decoy,0,-7.39479,-9.06,-1.95,-6.990072644574134
CCC[NH+]1CCC(N(C)C(=O)c2cc(C)nc3c2nc2n3CCCCC2)CC1,C64310084_decoy,CASP3,Decoy,0,-6.78612,-5.85,-0.48,-5.444650696376669
COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3C=c4cc(Cl)ccc4=[NH+]3)CC2)cc1,C64541458_decoy,CASP3,Decoy,0,-6.77161,-5.7,-0.91,-4.731818182958797
CN(Cc1[nH+]ccn1C)C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl,C65537970_decoy,CASP3,Decoy,0,-7.15498,-6.66,-2.83,-5.713709189442974
O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N1CCC[NH+](C2CC2)CC1,C66832309_decoy,CASP3,Decoy,0,-7.84648,-5.94,-1.67,-4.976889146293125
Cc1cc(=O)c(C(=O)N2C[C@@H]([NH+](C)C)Cc3ccccc32)nn1-c1ccccc1,C67208805_decoy,CASP3,Decoy,0,-6.49548,-5.63,-2.06,-4.202069974605433
C[NH+](C)[C@H]1Cc2ccccc2N(C(=O)c2cnc3c(cnn3C3CCCC3)c2)C1,C67209991_decoy,CASP3,Decoy,0,-6.10688,-7.75,-1.74,-5.9942531329262
C[NH+](C)[C@@H]1Cc2ccccc2N(C(=O)CCC(=O)c2ccc3c(c2)OCCO3)C1,C67340161_decoy,CASP3,Decoy,0,-7.57024,-7.93,-2.08,-6.6809314986095405
CN(Cc1[nH+]ccn1C)C(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F,C41835666_decoy,CASP3,Decoy,0,-6.82326,-6.15,-1.34,-5.287406523114706
Cc1nc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)c2c3c(sc2n1)CCC3,C04284152_decoy,CASP3,Decoy,0,-8.40742,-7.43,-1.69,-8.264814052922503
Cc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)N4CC[NH+](C)CC4)cc3n2)cc1,C02987301_decoy,CASP3,Decoy,0,-6.2962,-6.56,-0.73,-4.556907631024899
CCc1cc(=O)oc2c3c(ccc12)OCN(c1ccc(C[NH+]2CCOCC2)cc1)C3,C05347489_decoy,CASP3,Decoy,0,-7.66312,-5.51,-2.34,-4.592076302676819
CN(c1ccc(C(=O)N2CC[NH+](C)CC2)cc1)S(=O)(=O)c1ccc(Cl)cc1,C05051450_decoy,CASP3,Decoy,0,-7.2934,-5.98,-0.9,-6.71798062125317
O=C(c1cnn2c(C(F)F)cc(-c3ccc(F)cc3)nc12)N1CC[NH+]2CCC[C@H]2C1,C02776930_decoy,CASP3,Decoy,0,-6.74434,-8.39,-0.79,-6.1330959514127406
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@H](C(=O)c2ccccc2)[NH+]2C=CC(C#N)=C[C@H]32)cc1,C06845350_decoy,CASP3,Decoy,0,-7.18307,-7.14,-1.05,-5.566207709366555
CN(C)C(=O)[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2Cn1cc(-c2ccc(-c3ccccc3)cc2)nn1,C08299139_decoy,CASP3,Decoy,0,-7.75986,-7.16,-1.39,-5.669241103522694
C[NH+](C)CCCN1C(=O)c2oc3ccc(Cl)cc3c(=O)c2[C@H]1c1ccncc1,C11614678_decoy,CASP3,Decoy,0,-5.76115,-5.43,-1.57,-3.9407419520917855
C[C@@H](c1nccs1)[NH+](C)Cc1c(C(=O)N2CCCCCCC2)nc2sccn12,C11820064_decoy,CASP3,Decoy,0,-9.32074,-5.83,-3.48,-7.125304631312665
Cn1cc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)c(-c2ccc3c(c2)OCCO3)n1,C12472198_decoy,CASP3,Decoy,0,-8.26594,-6.83,-3.52,-5.988331983214506
Cc1ccccc1Cn1cc(C(=O)N2CCC[NH+](C3Cc4ccccc4C3)CC2)nn1,C12717633_decoy,CASP3,Decoy,0,-7.10286,-7.61,-1.15,-5.413469501007808
O=C(c1cn(C[C@@H]2CCC[NH+](C3C4CC5CC(C4)CC3C5)C2)nn1)N1CCCC1,C14986046_decoy,CASP3,Decoy,0,-7.09758,-6.59,-0.91,-4.4691564636250645
Cc1ccc(S(=O)(=O)N2CC[NH+]([C@H](C)C(=O)N3C[C@H](C)C[C@H](C)C3)CC2)s1,C15099045_decoy,CASP3,Decoy,0,-8.39833,-7.18,-2.32,-6.673836924771781
C[NH+]1CCC(N(C[C@@H]2CCCO2)C(=O)[C@H]2COc3cc(C(C)(C)C)ccc3O2)CC1,C19084541_decoy,CASP3,Decoy,0,-7.1072,-5.76,-1.65,-4.680746885802454
Cc1cccn2c(C[NH+]3CCC[C@H]3c3nccs3)c(C(=O)N3CCCCC3)nc12,C19790929_decoy,CASP3,Decoy,0,-9.3745,-6.1,-3.56,-7.5799368484974385
CCc1ccc(-c2[nH]nc3c2c[n+](Cc2ccccc2OC)c2cc4c(cc32)OCO4)cc1,C20325921_decoy,CASP3,Decoy,0,-8.93776,-8.14,-1.54,-7.664875526406711
CN1CCc2c(sc3nc(N4CC[NH+](C)CC4)n(-c4ccc(Cl)cc4)c(=O)c23)C1,C20442946_decoy,CASP3,Decoy,0,-8.51798,-6.31,-1.67,-5.403504127739923
COc1cc2c(cc1OC)CN([C@H]1CCC[NH+](Cc3c(C)nn(C)c3Cl)C1)CC2,C20600281_decoy,CASP3,Decoy,0,-7.14238,-6.33,-1.34,-5.331262433818821
Cc1cccc(-n2ncc(C(=O)N3CCC([NH+]4CCCCC4)CC3)c2-n2cccc2)c1,C20979935_decoy,CASP3,Decoy,0,-7.32336,-6.25,-2.65,-5.217667071656643
C[C@@H]1C[NH+](C)CCCN1C(=O)c1cc(-c2cnn(C)c2)nc2ccc(Cl)cc12,C20992123_decoy,CASP3,Decoy,0,-7.67851,-7.29,-3.86,-6.284324747625562
Cn1cnnc1Sc1ccc(C[NH+]2CCC[C@@H](N3CCc4ccccc4C3)C2)o1,C20997755_decoy,CASP3,Decoy,0,-7.89723,-5.78,-1.64,-5.5029084380964095
Cc1oc(-c2cccc3ccccc23)nc1C[NH+]1CCN([C@@H]2CCS(=O)(=O)C2)CC1,C22851361_decoy,CASP3,Decoy,0,-6.49422,-7.39,-1.96,-6.5171853434519535
C[C@@H]1CN(C(=O)[C@@H](C)[NH+]2CCN([C@@H](C)c3nc4ccccc4s3)CC2)C[C@@H](C)O1,C26889999_decoy,CASP3,Decoy,0,-7.79068,-5.58,-1.44,-5.27058105897476
O=c1cc(C[NH+]2CCN(Cc3ccc4c(c3)CCO4)CC2)nc2ccc(Cl)cn12,C29189110_decoy,CASP3,Decoy,0,-6.70902,-6.98,-1.57,-5.194211315135749
COc1ccc(C[NH+]2COc3ccc4c5c(c(=O)oc4c3C2)CCCC5)cc1OC,C02120650_decoy,CASP3,Decoy,0,-7.69293,-8.42,-1.17,-5.518927739408751
Cc1ccc(C)n1-c1c(C(=O)N2CCN(c3cccc[nH+]3)CC2)sc2ncccc12,C33059935_decoy,CASP3,Decoy,0,-7.1816,-7.73,-0.93,-5.75128462047723
Cc1sc2nc(SCC(=O)N3CCCC3)nc(N3CC[NH+](C)CC3)c2c1C,C34759783_decoy,CASP3,Decoy,0,-8.19066,-5.44,-1.18,-5.483373429300139
CCN1CCN(C(=O)C2CC[NH+](C3CCN(C(=O)C4CCCCC4)CC3)CC2)CC1,C35959027_decoy,CASP3,Decoy,0,-8.14901,-7.11,-1.76,-6.270738786785896
CCn1nc(C)c2c(C(=O)N(C)C3CC[NH+](C)CC3)cc(-c3ccc(C)cc3)nc21,C36615944_decoy,CASP3,Decoy,0,-7.67613,-5.49,-4.14,-6.467819056265183
O=C1C[C@@H]([NH+]2CCC(c3nc4ccccc4o3)CC2)C(=O)N1c1ccc(Cl)cc1,C01068471_decoy,CASP3,Decoy,0,-5.4068,-7.54,-1.6,-4.772030977085564
C[NH+]1CCN(C(=O)c2cc3nc(-c4ccccc4)cc(-c4ccccc4)n3n2)CC1,C00728187_decoy,CASP3,Decoy,0,-5.70558,-7.11,-1.91,-4.171176452481941
CN1C(=O)[C@@H](c2ccc(OC(F)(F)F)cc2)C=C2C[NH+](C[C@@H]3C=CN=N3)CC[C@H]21,C39344763_decoy,CASP3,Decoy,0,-6.8282,-6.95,-2.27,-5.7446918219721175
C1=NN=C(c2ccc3c(c2)OCO3)[C@@H]1CN1CCC[NH+](C2Cc3ccccc3C2)CC1,C39388346_decoy,CASP3,Decoy,0,-7.02834,-6.65,-3.05,-5.368626188814959
O=C1CC(C(=O)OCc2cc3c(cc2Br)OCO3)=c2ccccc2=[NH+]1,C39729960_decoy,CASP3,Decoy,0,-8.09201,-8.16,-0.9,-6.97187342432255
COc1ccc2c(c1)=[NH+]C(=O)[C@H](CN(C(=O)c1ccncc1)c1ccc(C)cc1C)C=2,C39928362_decoy,CASP3,Decoy,0,-8.15172,-6.8,-1.52,-7.151202136988733
COc1ccc2c(c1)=C[C@H](CN(C(=O)c1ccncc1)c1cccc(C)c1C)C(=O)[NH+]=2,C39929152_decoy,CASP3,Decoy,0,-7.56272,-8.15,-1.42,-7.107447408530642
O=C1SC(=CC2=c3ccccc3=[NH+]C2)C(=O)N1Cc1cc2c(cc1Cl)OCO2,C39934687_decoy,CASP3,Decoy,0,-6.88038,-6.65,-1.84,-5.231048164267119
COc1cc2c(cc1OC)[C@@H]([C@H]1C=c3cc(C)ccc3=[NH+]C1=O)N(C(=O)C1CC1)CC2,C40010580_decoy,CASP3,Decoy,0,-7.44613,-6.15,-5.0,-5.688292900009033
COc1cc2c(cc1OC)[C@]13CC[NH+]4CCCCC5=CCO[C@@H]6CC(=O)N2[C@@H]1[C@@H]6[C@@H]5C[C@@H]43,C44184528_decoy,CASP3,Decoy,0,-7.34771,-7.44,-3.62,-5.860912132837131
CCOc1ccc([C@H]2CCC[NH+]2Cn2c(=S)nc3nc(C)c(C)c(C)n32)cc1,C54442252_decoy,CASP3,Decoy,0,-7.20328,-6.19,-0.7,-5.162855694970099
Cc1cccc2c(=O)n(CC(=O)N3CC=C(C4=c5ccccc5=[NH+]C4)CC3)cnc12,C39779175_decoy,CASP3,Decoy,0,-5.94498,-8.17,-1.38,-6.110277459163537
COCCN1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2ccc(Cl)cc2)C1=O,C63137809_decoy,CASP3,Decoy,0,-7.81406,-5.97,-1.81,-5.9118459702156585
O=C1[NH+]=c2cc3c(cc2=C[C@H]1/C=C1/SC(=S)N(C2CCCC2)C1=O)OCO3,C39950167_decoy,CASP3,Decoy,0,-6.22378,-6.02,-0.46,-3.9292409252467055
O=C1C[C@@H](N2CCC3=c4ccccc4=[NH+][C@@H]3C2)C(=O)N1c1cccc(OC(F)(F)F)c1,C63339959_decoy,CASP3,Decoy,0,-6.59406,-6.75,-0.58,-4.906850694640165
CC1(C)[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(/N=C/c3cccc(Br)c3)CC(=O)N21,C63351344_decoy,CASP3,Decoy,0,-8.49071,-6.77,-1.45,-5.124483265062622
CN1C2=c3ccccc3=[NH+]C(=O)C2=C[C@H]1C(=O)N1CCN(c2ccc(Cl)cc2)CC1,C63480649_decoy,CASP3,Decoy,0,-7.26172,-7.02,-1.8,-5.010232420146384
CCOc1ccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2C(=O)c2ccnn2C)cc1,C64557672_decoy,CASP3,Decoy,0,-7.10048,-6.63,-1.99,-5.594740982997191
O=C1C[C@@H](N2CCn3c2[nH+]c2ccccc23)C(=O)N1c1ccc(Br)cc1,C40382501_decoy,CASP3,Decoy,0,-7.01549,-5.36,-2.27,-4.371931597367935
O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N1CCC[C@H]([NH+]2CCCC2)C1,C66839219_decoy,CASP3,Decoy,0,-7.5544,-5.92,-1.24,-4.730135730535623
C[NH+]1CCN(C(=O)CC2CCN(C(=O)c3nc(Cl)ccc3Cl)CC2)CC1,C66858113_decoy,CASP3,Decoy,0,-8.56563,-6.03,-4.27,-6.035863604720578
COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)[C@H]2CCS(=O)(=O)C2)cc(OC)c1OC,C04030187_decoy,CASP3,Decoy,0,-7.99955,-6.4,-1.07,-7.545871933410763
COCCn1c(SCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)nnc1-c1ccc(Cl)cc1,C09048678_decoy,CASP3,Decoy,0,-7.41798,-6.43,-2.04,-6.754839780189225
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N3CCOCC3)c2C)cc1,C09093933_decoy,CASP3,Decoy,0,-8.10638,-6.39,-1.5,-6.475110228392433
O=C(CSc1nnnn1-c1ccccc1)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1,C09580843_decoy,CASP3,Decoy,0,-7.91993,-6.63,-2.59,-8.1826684075354
COc1ccccc1N(CC(=O)N(C)[C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1cccs1,C09592528_decoy,CASP3,Decoy,0,-8.20568,-6.2,-3.95,-6.864703491243886
Cc1cc(C(=O)CSc2nnc(C[C@@H]3CCS(=O)(=O)C3)o2)c(C)n1Cc1ccco1,C09726388_decoy,CASP3,Decoy,0,-9.02276,-7.77,-4.76,-6.67648683278948
Cc1ccc(N2C[C@@H](C(=O)Oc3coc(CSc4ncccn4)cc3=O)CC2=O)cc1,C09829321_decoy,CASP3,Decoy,0,-7.54982,-6.35,-1.98,-5.472115545654655
Cn1c(SCC(=O)N(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)nnc1-c1ccco1,C09911359_decoy,CASP3,Decoy,0,-8.35309,-7.25,-2.07,-6.810625062630915
Cc1occc1-c1nnc(SCC(=O)N(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)n1C,C09953302_decoy,CASP3,Decoy,0,-8.04966,-6.76,-0.39,-6.944280497169202
CN(Cc1ccc2c(c1)OCCO2)C(=O)CSc1nnc(-c2cccnc2)n1C1CC1,C09991603_decoy,CASP3,Decoy,0,-7.93578,-7.37,-2.8,-6.105846369680814
C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccco1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1,C11122734_decoy,CASP3,Decoy,0,-7.44433,-7.43,-3.5,-6.8502486864612
COc1cc(C(=O)N2CCN(c3ccccc3F)CC2)c(N(C)S(C)(=O)=O)cc1OC,C13582690_decoy,CASP3,Decoy,0,-7.34684,-6.01,-1.53,-5.561540150536475
CCN(C(=O)[C@H](C)Sc1ncnc2c1cnn2-c1ccccc1)[C@H]1CCS(=O)(=O)C1,C14240874_decoy,CASP3,Decoy,0,-6.34668,-5.51,-2.31,-5.436816883859946
COCc1ccc(C(=O)N2CC(=O)N(C3CCCCC3)C[C@@H](OCc3ccccn3)C2)o1,C14530434_decoy,CASP3,Decoy,0,-7.8001,-5.54,-1.91,-5.606819909839934
CCn1cc(C(=O)N2CC(=O)N(C(C)C)C[C@H](OCc3ccc(OC(F)(F)F)cc3)C2)cn1,C14541358_decoy,CASP3,Decoy,0,-5.56278,-5.74,-2.91,-4.763352395922282
COc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C(=O)c2csc(C)n2)C3)cc1,C14755212_decoy,CASP3,Decoy,0,-8.02266,-6.11,-3.71,-6.215583964831088
COc1ccc(-c2nn(-c3ccccc3)cc2/C=C/C(=O)N2CCN(C(C)=O)CC2)cc1OC,C15421211_decoy,CASP3,Decoy,0,-7.34369,-6.97,-0.91,-6.152488170372493
CCS(=O)(=O)c1ccccc1C(=O)OCC(=O)N1CCN(C(=O)c2cccs2)CC1,C17213469_decoy,CASP3,Decoy,0,-6.96689,-5.98,-4.15,-6.139214532196116
C[C@H](OC(=O)[C@H]1CCCN(C2=NS(=O)(=O)c3ccccc32)C1)C(=O)N(C)c1ccccc1,C19628369_decoy,CASP3,Decoy,0,-7.19345,-7.34,-1.65,-5.677296958650955
O=C(c1cccs1)[C@H]1CCCN(C(=O)Cn2nnnc2CN2CCc3ccccc3C2)C1,C20455544_decoy,CASP3,Decoy,0,-9.5146,-6.64,-0.58,-7.2510988604414415
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)OCC(=O)c3ccccc3)c12,C21441233_decoy,CASP3,Decoy,0,-7.82867,-7.23,-1.2,-5.670190107119125
Cc1cccc(N(CC(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)S(C)(=O)=O)c1,C22327183_decoy,CASP3,Decoy,0,-6.13481,-7.57,-3.03,-5.4163820306334935
Cc1csc([C@@H](C#N)C(=O)CSc2nnc(N3CCCCC3)n2Cc2ccco2)n1,C22764628_decoy,CASP3,Decoy,0,-8.58282,-5.84,-1.59,-7.994406343214162
Cc1noc(C)c1CN(C(=O)CN(C)S(=O)(=O)c1ccccc1C#N)c1ccccc1,C22992583_decoy,CASP3,Decoy,0,-7.41556,-5.84,-2.17,-5.5819835754850144
Cc1cc(C(=O)COC(=O)c2ccc3c(c2)OCCCO3)c(C)n1[C@@H]1CCS(=O)(=O)C1,C23264216_decoy,CASP3,Decoy,0,-8.80604,-7.66,-0.57,-8.50140406298912
O=C(COCc1nc2ccccc2s1)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1,C23818154_decoy,CASP3,Decoy,0,-8.80482,-6.64,-2.18,-5.206692952822797
N#CCCn1cc(/C=C/C(=O)N2CCN(Cc3cc(=O)n4ccsc4n3)CC2)c2ccccc21,C23819387_decoy,CASP3,Decoy,0,-9.9224,-6.43,-1.61,-5.899290378125597
COc1ccc(CN2CCN(C(=O)CSc3nc4nc(C)cc(C)n4n3)CC2)cc1F,C23881424_decoy,CASP3,Decoy,0,-7.66427,-6.5,-1.85,-5.511342603221057
Cn1c(-c2ccncc2)nn(CN2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)c1=S,C13148944_decoy,CASP3,Decoy,0,-8.2425,-7.27,-2.33,-5.21241411377048
COc1cc(/C=C/C(=O)N2CCN(C(=O)C3CC3)CC2)ccc1OCc1c(C)noc1C,C25587175_decoy,CASP3,Decoy,0,-8.44752,-7.42,-1.53,-7.048744779086047
CCOCC(=O)N1CCN(CCn2c(OCC)nc3sc4c(c3c2=O)CCCC4)CC1,C28559781_decoy,CASP3,Decoy,0,-9.91271,-5.89,-1.86,-6.331569579757079
COc1ccc(-n2c(C)nnc2SCC(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)cc1,C29318251_decoy,CASP3,Decoy,0,-8.58676,-7.59,-1.56,-7.223890742211945
COc1ccc(CCN(C)C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1OC,C30863690_decoy,CASP3,Decoy,0,-6.70762,-7.51,-1.36,-6.454531695182366
Cc1nc(-c2ccc3c(c2)CCN3C(=O)CSc2nnnn2C[C@@H]2CCCO2)cs1,C31628572_decoy,CASP3,Decoy,0,-8.74951,-6.66,-1.07,-6.303779741619578
CCN(C(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1)[C@H]1CCS(=O)(=O)C1,C09715181_decoy,CASP3,Decoy,0,-8.44868,-6.11,-2.64,-6.695596415324289
C=CCOC(=O)c1c(C)nc(C)nc1C(=O)N1CCN(C(=O)C(C)(C)CCl)[C@@H](C)C1,C33659054_decoy,CASP3,Decoy,0,-7.27842,-5.16,-3.36,-6.072475423045684
CCOC(=O)CCC(=O)N1CCN(c2nc(C)nc3sc4c(c23)CCN(CC)C4)CC1,C35549037_decoy,CASP3,Decoy,0,-9.3466,-5.95,-1.09,-6.704784319695466
Cc1cc(C(=O)CN2CCN(C(=O)C3CC3)CC2)c(C)n1-c1c(C)n(C)n(-c2ccccc2)c1=O,C14092904_decoy,CASP3,Decoy,0,-7.43242,-7.09,-1.93,-7.880320360772532
Cc1nc(Cc2nnc(SCC(=O)N3CCC[C@H]3c3ccc4c(c3)OCCO4)o2)cs1,C36885120_decoy,CASP3,Decoy,0,-10.3353,-7.57,-1.34,-7.721269818058591
CCN(C(=O)COC(=O)/C=C/c1c(C)nn(-c2ccccc2)c1C)[C@H]1CCS(=O)(=O)C1,C03397874_decoy,CASP3,Decoy,0,-8.10519,-6.52,-2.55,-5.92478399652156
CN(C(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1F)[C@@H]1CCS(=O)(=O)C1,C09662755_decoy,CASP3,Decoy,0,-8.99143,-8.24,-3.92,-7.923848289592526
CCOC(=O)c1sc2nc(C)nc(SCC(=O)N(C)[C@H]3CCS(=O)(=O)C3)c2c1C,C09493607_decoy,CASP3,Decoy,0,-9.58073,-5.77,-2.91,-6.618171225986617
CCn1cc(CN2CCN(C(=O)[C@@H]3C=C(c4ccc(OC(F)F)cc4)N=N3)CC2)c(C)n1,C39443582_decoy,CASP3,Decoy,0,-7.33334,-7.17,-4.25,-5.343350462864807
CC(C)C[C@@H](C(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O,C23326204_decoy,CASP3,Decoy,0,-6.24318,-6.88,-2.02,-5.725175022678334
O=C(CSc1nnnn1Cc1cccs1)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1,C09714123_decoy,CASP3,Decoy,0,-7.96991,-6.07,-2.7,-6.682208036677864
CCOc1ccc(-c2nc(CN3CCN(C(=O)C4CCN(C(C)=O)CC4)CC3)c(C)o2)cc1,C40966924_decoy,CASP3,Decoy,0,-8.15454,-6.23,-3.27,-5.51871427952988
COc1ccc(CN(C(=O)Cc2ccc3c(c2)OCCCO3)[C@H]2CCS(=O)(=O)C2)cc1OC,C41004873_decoy,CASP3,Decoy,0,-7.82814,-7.43,-1.09,-6.652986763075655
Cc1cc(C(=O)COC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c(C)n1CC(F)(F)F,C21855783_decoy,CASP3,Decoy,0,-7.74811,-7.5,-1.69,-7.129906766656762
CCOc1cc(/C=C/C(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)cc(Cl)c1OC,C22158820_decoy,CASP3,Decoy,0,-7.28313,-6.99,-2.11,-6.8049163878898185
COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)/C=C/c2ccccc2F)CC1,C58948447_decoy,CASP3,Decoy,0,-6.99799,-6.58,-1.91,-5.67560497190409
O=C(CSc1nnc(COc2ccccc2Cl)o1)N1CCN(C(=O)c2ccco2)CC1,C03343729_decoy,CASP3,Decoy,0,-7.55265,-8.19,-5.02,-7.0510427675674965
CN1C(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(CN(CCC#N)S(C)(=O)=O)o1,C08430159_decoy,CASP3,Decoy,0,-7.54268,-5.96,-2.64,-6.057548519538766
C=CCn1c(COc2ccc(CC)cc2)nnc1SCC(=O)N(C)[C@@H]1CCS(=O)(=O)C1,C04162374_decoy,CASP3,Decoy,0,-7.68038,-6.6,-1.09,-5.698927801296599
CCn1nc(C(=O)OCC(=O)c2cc(C)n([C@@H]3CCS(=O)(=O)C3)c2C)c2ccccc2c1=O,C08806222_decoy,CASP3,Decoy,0,-7.29695,-7.84,-0.77,-7.618496066183847
CCOC(=O)COc1c(Br)cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)cc1OC,C01438067_decoy,CASP3,Decoy,0,-7.7693,-6.27,-1.33,-6.249272671643348
COc1cc(/C=C/C(=O)OCC(=O)c2cc(C)n(C[C@@H]3CCCO3)c2C)ccc1OCC#N,C09539989_decoy,CASP3,Decoy,0,-6.98909,-7.15,-1.79,-5.800623286276807
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSc1nnnn1C1CC1)CC2,C09594503_decoy,CASP3,Decoy,0,-6.31203,-8.07,-1.75,-8.21989536221701
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2cc(C)n(C[C@H]3CCCO3)c2C)c1C,C09604307_decoy,CASP3,Decoy,0,-8.37971,-7.23,-1.39,-8.599175286439511
CCC(=O)N(c1nnc(SCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)s1)C1CC1,C09861850_decoy,CASP3,Decoy,0,-8.91332,-6.22,-3.54,-6.933712819408947
CCOc1ccc(C(=O)OCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)cc1OCC,C11341582_decoy,CASP3,Decoy,0,-8.96285,-5.5,-0.98,-7.356304696388186
COCCCN1C(=O)C[C@@](CC(=O)N2CCN(c3ccc(C(C)=O)cc3)CC2)(c2ccccc2)C1=O,C11909993_decoy,CASP3,Decoy,0,-7.53727,-6.63,-2.08,-6.140853079971723
COCCCN1C(=O)C[C@](CC(=O)N(C)CCc2cnn(C)c2)(c2ccccc2Cl)C1=O,C12281466_decoy,CASP3,Decoy,0,-8.06905,-5.67,-3.29,-6.195246772464561
CCOC(=O)/C=C1\SCC(=O)N1CC(=O)N1N=C(c2ccc(C)cc2)C[C@@H]1c1ccco1,C12766095_decoy,CASP3,Decoy,0,-7.05839,-7.95,-0.75,-6.874490932532474
CCOC(=O)/C=C1\SCC(=O)N1CC(=O)N1N=C(c2ccc(C)cc2)C[C@H]1c1ccco1,C12766099_decoy,CASP3,Decoy,0,-8.42715,-6.39,-3.17,-6.493148661387176
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)CSc1nccn1-c1cccc(F)c1,C12813941_decoy,CASP3,Decoy,0,-8.08224,-7.1,-1.87,-6.848361796792817
CCOc1cc(C(=O)N(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC,C13095704_decoy,CASP3,Decoy,0,-9.31772,-5.39,-1.34,-8.021796400254438
O=C(c1cccc(N2C(=O)CCC2=O)c1)N(CCCn1ccnc1)c1nc2c(F)cc(F)cc2s1,C10583495_decoy,CASP3,Decoy,0,-9.43398,-7.49,-2.72,-9.75683392152601
COc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1S(=O)(=O)N(C)C,C09672425_decoy,CASP3,Decoy,0,-8.2262,-5.89,-2.07,-7.1593750630145285
C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccco1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1,C14069814_decoy,CASP3,Decoy,0,-8.27311,-7.41,-4.35,-7.761493396627645
CCn1nc(C)cc1C(=O)N1CCc2c(c(C(=O)N(C)Cc3cscn3)nn2CC2CC2)C1,C14536107_decoy,CASP3,Decoy,0,-9.8155,-5.64,-2.91,-7.155920329562048
COCCN1C(=O)C[C@](CC(=O)N(C)Cc2cnn(-c3ccccc3C)c2)(c2ccccc2F)C1=O,C14880796_decoy,CASP3,Decoy,0,-7.38984,-6.99,-3.98,-6.42369073915947
COCCN1C(=O)C[C@](CC(=O)N2CCCC[C@@H]2c2nccs2)(c2ccccc2OC)C1=O,C14982387_decoy,CASP3,Decoy,0,-8.89718,-6.2,-3.43,-6.750065784349338
C[C@H](Sc1nnnn1-c1ccc(OC(F)(F)F)cc1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1,C15030054_decoy,CASP3,Decoy,0,-7.42527,-5.96,-1.41,-5.395386576768465
COc1cc(/C=N/N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@@H]3CC2)ccc1OCc1ccc([N+](=O)[O-])cc1,C15162141_decoy,CASP3,Decoy,0,-7.63071,-8.3,-1.28,-7.906723216342429
COCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)c1ccccc1,C16650544_decoy,CASP3,Decoy,0,-8.44124,-7.14,-2.81,-7.377355829470058
CN(Cc1cscn1)C(=O)c1nn(CC2CC2)c2c1CN(C(=O)Cc1ccn(C)c1)CC2,C19113155_decoy,CASP3,Decoy,0,-10.1877,-5.45,-1.86,-7.648100357959131
C[C@@H]1C[C@@H](C)CN(C(=O)CSc2nnc(CN(c3ccccc3)S(C)(=O)=O)n2C)C1,C19925896_decoy,CASP3,Decoy,0,-6.92777,-5.96,-1.3,-5.69391557061308
O=C1CCCCCN1Cc1nnc(SCc2nc(-c3ccsc3)no2)n1-c1cccnc1,C21604769_decoy,CASP3,Decoy,0,-8.70457,-7.95,-4.74,-6.057554366848127
C=CCn1c(S[C@H](C(=O)N2CCOCC2)c2ccccc2)nnc1[C@H]1CCS(=O)(=O)C1,C21999705_decoy,CASP3,Decoy,0,-9.5783,-7.49,-3.31,-8.376115782008373
COc1cccc(CCC(=O)OCC(=O)c2cc(C)n([C@@H]3CCS(=O)(=O)C3)c2C)c1OC,C24352150_decoy,CASP3,Decoy,0,-8.28009,-6.37,-1.81,-6.640372071662658
CCOC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccccc2-n2cnnn2)CC1,C25579581_decoy,CASP3,Decoy,0,-6.71211,-7.45,-2.04,-6.043906626661904
CCOCCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CC)c2N2CCOCC2)SC1=S,C33474224_decoy,CASP3,Decoy,0,-8.84303,-6.3,-1.93,-7.394351289730704
CCCc1nc(C)nc(C(=O)N2CCN(C(=O)C(C)(C)CCl)[C@@H](C)C2)c1C(=O)OCC,C35176032_decoy,CASP3,Decoy,0,-7.83633,-5.23,-3.6,-6.4029542262212376
CCCN(CCC)C(=O)[C@H]1CS[C@H](c2ccoc2)N1C(=O)c1cc(OC)c(OC)c(OC)c1,C35216812_decoy,CASP3,Decoy,0,-7.7193,-4.92,-2.14,-6.350542503865003
CC[C@@H](C)N(CC(=O)N(Cc1ccco1)C[C@H]1CCCO1)C(=O)c1ccc(OC)c(OC)c1,C35394093_decoy,CASP3,Decoy,0,-8.1201,-5.89,-1.64,-6.720301051606259
CCOC(=O)c1c(C)c(C(=O)CN(C[C@H]2CCCO2)C(=O)c2ccc(OC)cc2)c(C)n1C,C35993168_decoy,CASP3,Decoy,0,-7.52353,-7.48,-2.07,-6.857071448160765
O=C(C[C@H]1[C@]2([N+](=O)[O-])C=CC(=O)[C@@]1([N+](=O)[O-])CN(CCBr)C2)c1ccccc1,C36033894_decoy,CASP3,Decoy,0,-5.31174,-5.49,-1.87,-5.407294570384533
COCCN(C[C@@H]1CN(C(=O)c2cc(OC)cc(OC)c2)CCO1)C(=O)c1cccc(F)c1,C37611155_decoy,CASP3,Decoy,0,-7.60463,-6.39,-2.02,-6.402159492917527
COCCN(C[C@H]1CN(C(=O)c2cc(OC)cc(OC)c2)CCO1)C(=O)c1cccc(F)c1,C37611157_decoy,CASP3,Decoy,0,-7.70919,-6.71,-3.62,-6.758028995828502
COC(=O)CC1=C2C(=O)N=C(CN(C)Cc3ccccc3C(F)(F)F)N=C2S[C@@H]1C(=O)OC,C38783391_decoy,CASP3,Decoy,0,-8.17417,-6.94,-2.0,-8.030365982509958
Cc1noc(C)c1CO[C@H]1CN(CC(C)C)C(=O)CN(C(=O)[C@H]2C=C(c3ccsc3)N=N2)C1,C39337907_decoy,CASP3,Decoy,0,-7.62031,-8.17,-2.21,-6.080892883088058
CCOC(=O)C1=C(C(=O)COC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)C(C)=N[C@H]1C,C39367449_decoy,CASP3,Decoy,0,-7.17059,-7.24,-2.19,-6.072690510578818
COc1ccc(-c2nc(COC(=O)c3ccc(N4C(=O)CCC4=O)cc3)cs2)cc1OC,C39476318_decoy,CASP3,Decoy,0,-7.44604,-6.16,-1.3,-5.728689250667348
Cc1cc(C(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)c(C)n1C[C@H]1CCCO1,C39621313_decoy,CASP3,Decoy,0,-6.88732,-6.99,-1.55,-5.493243892747904
CCOc1ccc(/C=C/C(=O)OCC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)cc1OC,C17725532_decoy,CASP3,Decoy,0,-8.1398,-8.77,-2.66,-7.74479653944324
CCCCN(C(=O)COC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)[C@H]1CCS(=O)(=O)C1,C49597314_decoy,CASP3,Decoy,0,-7.38765,-7.25,-1.78,-7.141529802616486
CCOc1ccc(N2C(=O)C[C@H](N3C(=O)/C(=C/c4ccc(OC)c(OC)c4)SC3=S)C2=O)cc1,C15051284_decoy,CASP3,Decoy,0,-7.75247,-6.2,-1.36,-8.139966612330285
COc1cc(CN(C)Cc2nnc(SCc3ccccn3)n2C[C@@H]2CCCO2)cc(OC)c1,C55042024_decoy,CASP3,Decoy,0,-9.4006,-7.97,-1.83,-8.128820620935933
Cc1nc(CN2C[C@H](OCc3ccccn3)CN(Cc3cnn(-c4ccccc4)c3)CC2=O)cs1,C14536383_decoy,CASP3,Decoy,0,-7.91602,-5.68,-2.93,-5.500405361322547
Cc1cccc(C)c1OCc1nnc(SCC(=O)N(CCC#N)CCC#N)n1-c1ccccc1,C21229499_decoy,CASP3,Decoy,0,-7.6192,-6.67,-2.37,-7.880642948862833
CN(C)P(=NC(C)(C)C)(N=P(N(C)C)(N(C)C)N(C)C)N(C)C,C04521788_decoy,CASP3,Decoy,0,-3.59792,-3.71,-3.24,-3.445090976464377
Cc1cc(CN(Cc2ccccn2)C(=O)c2ccc3c(c2)OCO3)n(C)n1,C06669071_decoy,CASP3,Decoy,0,-7.3163,-5.87,-5.96,-6.208247348839136
COc1ccc(C(=O)N(C)Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1F,C06984536_decoy,CASP3,Decoy,0,-7.74835,-7.55,-1.89,-6.675241533324605
CN(C(=O)CSc1nnc(C(F)(F)F)n1C)[C@H]1CCS(=O)(=O)C1,C07198200_decoy,CASP3,Decoy,0,-6.62793,-6.59,-1.98,-6.195090971179972
C[C@H](Sc1nnc(C(F)(F)F)n1C)C(=O)N(C)[C@H]1CCS(=O)(=O)C1,C07817858_decoy,CASP3,Decoy,0,-6.9959,-6.24,-1.27,-5.834736722734199
Cc1cc(C(=O)CSc2nnc(C3CC3)o2)c(C)n1[C@H]1CCS(=O)(=O)C1,C08245399_decoy,CASP3,Decoy,0,-8.37411,-6.08,-3.24,-6.5252305602466745
Cc1cc(C(=O)CSc2nncn2C)c(C)n1[C@H]1CCS(=O)(=O)C1,C08249607_decoy,CASP3,Decoy,0,-8.00216,-6.4,-1.96,-6.108170688581504
CC1CCN(c2nnc(SCC(=O)N(C)C)n2C[C@@H]2CCCO2)CC1,C11746872_decoy,CASP3,Decoy,0,-7.86918,-5.21,-1.04,-6.089102504303103
Cc1ccc(S(=O)(=O)CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1,C12818792_decoy,CASP3,Decoy,0,-6.97158,-6.28,-1.44,-6.305771590594547
CCn1ncc(CN2CCN(C(=O)Cn3cc(Br)c(C)n3)CC2)c1C,C20028510_decoy,CASP3,Decoy,0,-7.15677,-4.9,-2.45,-4.841653634926178
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1CN(C)C(=O)c1ccc(OC(F)F)cc1,C24067822_decoy,CASP3,Decoy,0,-7.07979,-7.23,-1.96,-8.764648818251711
CCN(C(=O)[C@@H](C)Sc1nc2ccsc2c(=O)n1C)[C@H]1CCS(=O)(=O)C1,C26112359_decoy,CASP3,Decoy,0,-8.61182,-6.03,-4.75,-6.333150085401233
O=C([C@@H]1CCCN(C2=NS(=O)(=O)c3ccccc32)C1)N(Cc1ccco1)C1CC1,C29011972_decoy,CASP3,Decoy,0,-8.23023,-6.96,-0.62,-6.357356924008173
CC(=O)C[C@H]1N(C2CCCC2)C(=O)[C@@H]2N(Cc3ccccc3C)C(=O)[C@H]3CC(=O)O[C@]321,C35339889_decoy,CASP3,Decoy,0,-6.91161,-6.8,-0.84,-6.335551997480046
CN(C(=O)CSc1nncn1-c1ccccc1)[C@H]1CCS(=O)(=O)C1,C04835192_decoy,CASP3,Decoy,0,-7.5578,-6.59,-1.47,-7.111794258333857
COc1ccc(C(=O)N(C)Cc2ccc(C)o2)cc1OC1CCN(C(C)=O)CC1,C12386735_decoy,CASP3,Decoy,0,-7.71022,-5.93,-3.83,-6.756202110287387
Cn1c(S[C@@H](C(=O)N2CCCC2)c2ccccc2)nnc1[C@H]1CCS(=O)(=O)C1,C39525628_decoy,CASP3,Decoy,0,-8.06871,-7.78,-1.96,-7.972868773842469
CC1=N[C@H](C(=O)[O-])[C@@H](C)[C@H]1C(=O)/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1,C39715127_decoy,CASP3,Decoy,0,-7.29471,-8.21,-1.89,-7.03922038669739
C[C@H]1N=C(Cc2nnc(SCC3=NC(=O)[C@@H]4SC=CC4=N3)o2)CS1,C39760652_decoy,CASP3,Decoy,0,-10.1218,-6.1,-0.4,-5.586687374792259
CCN(C(=O)c1ccc(C)c(S(=O)(=O)N(C)C)c1)[C@H]1CCS(=O)(=O)C1,C40641220_decoy,CASP3,Decoy,0,-7.3569,-6.84,-2.1,-7.0636224717163865
CC(=O)N1CCN(C(=O)Cc2csc(COc3ccc(C)nc3)n2)CC1,C41224648_decoy,CASP3,Decoy,0,-6.55542,-5.7,-1.99,-5.223825243093828
CN(C(=O)CCC(=O)c1ccc2c(c1)OCCO2)[C@@H]1CCS(=O)(=O)C1,C41231997_decoy,CASP3,Decoy,0,-8.03002,-6.34,-0.92,-6.142633579259842
COCCN1C[C@@H](C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)CC1=O,C41243002_decoy,CASP3,Decoy,0,-7.45797,-5.13,-1.47,-5.504659545528144
Cc1csc([C@H](C#N)C(=O)CSc2nnc(-c3cccnc3)n2C)n1,C45411461_decoy,CASP3,Decoy,0,-8.82541,-5.25,-2.69,-5.873540553651536
CCC(=O)N1CCc2cc(C(=O)N(C)[C@H](C)c3ccc(-n4cncn4)cc3)ccc21,C46912347_decoy,CASP3,Decoy,0,-5.0509,-6.37,-1.51,-5.633957766778665
Cc1nnc(CN2CCN(S(=O)(=O)Cc3ccc(Cl)cc3)CC2)o1,C49704594_decoy,CASP3,Decoy,0,-7.95171,-5.3,-2.66,-4.958460073715213
CCN(C[C@H](C)C#N)C(=O)CN1CCN(C(=O)c2cc(C)oc2C)CC1,C53332919_decoy,CASP3,Decoy,0,-7.63707,-6.6,-1.77,-6.2978772191193455
Cc1cc(C)n2nc(C(=O)N(Cc3ccsc3)C[C@@H]3CCCO3)nc2n1,C55385735_decoy,CASP3,Decoy,0,-8.95228,-6.39,-1.79,-6.917328283889722
Cc1nn(C)c(C)c1S(=O)(=O)N(Cc1cccnc1)Cc1ccco1,C58612106_decoy,CASP3,Decoy,0,-6.58708,-5.64,-1.88,-4.781993933676065
O=C(CCS(=O)(=O)C1CCCC1)N1CCC[C@@H](C(=O)N2CCOCC2)C1,C48148430_decoy,CASP3,Decoy,0,-7.23405,-7.18,-1.57,-5.990667848321072
CCN(CC)C(=O)Cn1cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)c2ccccc21,C06629816_decoy,CASP3,Decoy,0,-6.97556,-6.28,-3.53,-6.465796258800071
C[C@@H]1Cc2cc(C(=O)N(CC(=O)N(C)C)CC(F)(F)F)ccc2N1S(C)(=O)=O,C59349112_decoy,CASP3,Decoy,0,-6.96696,-7.03,-0.77,-6.6402509036988535
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)N1CCN(CC(F)F)CC1,C61600614_decoy,CASP3,Decoy,0,-5.55253,-6.06,-1.62,-5.159101743214531
Cn1c(SCCC(=O)N2CCN(C=O)CC2)nnc1-c1ccccc1,C62071564_decoy,CASP3,Decoy,0,-5.72212,-5.36,-1.97,-4.718428017529801
CC(C)CCN1C(=O)C[C@@H](N(C)CC2=NC(=O)[C@H]3SC=CC3=N2)C1=O,C39781192_decoy,CASP3,Decoy,0,-8.99074,-7.04,-1.55,-6.343760189082001
COc1cc(OC)c(OC)cc1CN(C(=O)C1=CCC(=O)N=C1)C(C)C,C63857601_decoy,CASP3,Decoy,0,-7.10402,-6.47,-0.6,-7.958772859104623
O=C(OCC1=NC(=O)[C@@H]2SC=CC2=N1)[C@H]1CC(=O)N(C2CCCC2)C1,C38735134_decoy,CASP3,Decoy,0,-7.20267,-5.96,-0.06,-4.582442814591716
CCn1ccc(-c2c(-c3ccccc3)ncn2CCN(C)S(C)(=O)=O)n1,C65376133_decoy,CASP3,Decoy,0,-6.66521,-6.39,-1.06,-5.757650231976615
O=C(c1ccc(-n2cnnc2)cc1)N(Cc1ccccn1)C[C@@H]1CCCO1,C65434892_decoy,CASP3,Decoy,0,-7.58468,-6.97,-1.61,-7.642193304597403
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCC(C(=O)N2CCOCC2)CC1,C66308399_decoy,CASP3,Decoy,0,-7.30915,-5.93,-1.77,-5.340263536029332
C[C@H](CS(C)(=O)=O)N(C)C(=O)CN(C)S(=O)(=O)c1cccs1,C66369436_decoy,CASP3,Decoy,0,-7.27067,-5.84,-1.58,-5.64891393376554
CCCC(=O)N1CSC[C@@H]1C(=O)N1CCN(C(=O)N(CC)CC)CC1,C66612488_decoy,CASP3,Decoy,0,-6.91199,-5.81,-1.05,-6.042251025677737
CCCC(=O)N1CSC[C@H]1C(=O)N1CCC(N(C)S(C)(=O)=O)CC1,C66632853_decoy,CASP3,Decoy,0,-7.83132,-5.88,-2.91,-6.135912518618799
CN(C(=O)[C@H]1CSCN1C(=O)Cc1csc(-c2cnccn2)n1)C1CC1,C66644621_decoy,CASP3,Decoy,0,-8.88579,-5.13,-0.9,-6.974309520313375
CCS(=O)(=O)N(C)C1CCN(C(=O)[C@@H](C)S(=O)(=O)C(C)C)CC1,C66842427_decoy,CASP3,Decoy,0,-7.4997,-5.27,-2.52,-5.413719429826314
C/C=C/C(=O)N1CSC[C@@H]1C(=O)N1CCC(N(CC)S(C)(=O)=O)CC1,C66855809_decoy,CASP3,Decoy,0,-8.20723,-5.66,-4.28,-6.2432879426590375
CCS(=O)(=O)N(C)C1CCN(CN2C(=O)C[C@@]3(CCSC3)C2=O)CC1,C66859076_decoy,CASP3,Decoy,0,-8.01463,-5.65,-1.34,-5.542109991268617
Cc1cc(C(=O)N2CCN(S(=O)(=O)N(C)[C@@H](C)C3CC3)CC2)c(C)o1,C66913234_decoy,CASP3,Decoy,0,-7.51237,-6.1,-1.41,-6.160669524308717
CCn1cnnc1C1CCN(C(=O)/C=C/c2ccc(-n3ccnc3)cc2)CC1,C67005372_decoy,CASP3,Decoy,0,-5.47344,-6.45,-1.54,-4.738180456087685
CCc1noc(CN(C)C(=O)c2cccc(S(=O)(=O)CC(F)F)c2)n1,C67151799_decoy,CASP3,Decoy,0,-6.55919,-6.0,-1.14,-5.709309437689139
COC[C@@H](C)n1c(C)cc(C(=O)COC(=O)/C=C/c2ccc(OC(F)F)c(OC)c2)c1C,C09246988_decoy,CASP3,Decoy,0,-7.75341,-6.07,-1.71,-8.55868902100999
C=CCN(CC=C)C(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1,C10911500_decoy,CASP3,Decoy,0,-7.21172,-6.86,-2.09,-8.577271716538688
CCCc1noc([C@@H](C)Sc2nnc(-c3ccc(OC)c(OC)c3)n2CCCOC)n1,C13003262_decoy,CASP3,Decoy,0,-8.78076,-5.58,-1.41,-6.412059129106623
COc1cc(CN(Cc2ccccn2)C(=O)CCn2ccc(C)n2)ccc1OCCc1cccs1,C14888943_decoy,CASP3,Decoy,0,-8.8835,-6.19,-2.37,-6.954405807592762
CCOc1cc(/C=C/C(=O)c2ccc(OCC#N)cc2)ccc1OCC(=O)N(C(C)C)C(C)C,C15352582_decoy,CASP3,Decoy,0,-9.08087,-5.9,-2.67,-6.304979749492863
CCOCCCN(Cc1nc(C(=O)OCC)cs1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1,C16457969_decoy,CASP3,Decoy,0,-9.80793,-6.23,-3.52,-7.997262019315549
COCCN(CC(=O)N(Cc1cccn1Cc1cccc(C)c1)C(C)(C)C)C(=O)c1cc(OC)cc(OC)c1,C16458127_decoy,CASP3,Decoy,0,-7.80838,-7.05,-3.07,-6.529542906288931
COCCCN(CC(=O)N(Cc1cccn1Cc1ccc(F)cc1)C1CCCCC1)C(=O)[C@@H](C)Cl,C16458387_decoy,CASP3,Decoy,0,-9.48999,-6.85,-2.8,-7.780470580645856
COCCN(CC(=O)N(Cc1cccn1Cc1ccc(F)cc1)C1CCCCC1)C(=O)Cc1cccs1,C16461953_decoy,CASP3,Decoy,0,-9.69741,-7.0,-4.47,-9.122853409695503
CCCCN(Cc1cccn1Cc1cccc(C)c1)C(=O)CN(CCOC)C(=O)C(C)(C)CCl,C16462380_decoy,CASP3,Decoy,0,-8.11399,-6.18,-4.61,-8.434875078595574
CCCCN(Cc1cccn1Cc1ccc(Br)cc1)C(=O)CN(CCOC)C(C)=O,C16462671_decoy,CASP3,Decoy,0,-7.45716,-6.31,-3.95,-6.869868522494069
CCCCN(Cc1cccn1Cc1ccc(Br)cc1)C(=O)CN(CCCOC)C(=O)C(C)C,C16462804_decoy,CASP3,Decoy,0,-9.28917,-5.97,-2.48,-7.775145516701709
CCCN(Cc1cccn1Cc1ccc(C(=O)N(C)CCc2ccc(OC)c(OC)c2)o1)C(=O)CC,C16533671_decoy,CASP3,Decoy,0,-8.8596,-7.13,-1.45,-11.069383431781183
C=C(Cl)COC(=O)[C@@H](C)OC(=O)/C=C(\Cl)C(=O)O[C@H](C)C(=O)OCC(=C)Cl,C05735047_decoy,CASP3,Decoy,0,-9.7387,-5.3,-1.11,-6.272120874684967
CC/C(=C(/CC)c1ccc(OCC(=O)COC(C)=O)cc1)c1ccc(OCC(=O)COC(C)=O)cc1,C17003788_decoy,CASP3,Decoy,0,-8.72806,-7.13,-3.41,-7.4463316104834
C=CCN(CC=C)[C@H]1CC(C(=O)OCC)=C[C@@H](OC(CC)CC)[C@@H]1N(C(C)=O)C(C)(C)C,C21999751_decoy,CASP3,Decoy,0,-7.46234,-4.9,-4.59,-6.2347450915751885
Cc1nc(CSc2ccc(C(=O)OCC(=O)NCCc3ccc(OC(F)F)cc3)cc2)cs1,C22418429_decoy,CASP3,Decoy,0,-7.88247,-7.09,-2.27,-7.707256527812781
COCCCn1c(C)cc(C(=O)COC(=O)c2ccc(-c3ccc(OC(C)=O)cc3)cc2)c1C,C22836384_decoy,CASP3,Decoy,0,-8.60921,-6.44,-1.61,-7.668722827788457
CCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)o1)C(=O)C(C)C,C33475471_decoy,CASP3,Decoy,0,-7.75912,-6.06,-4.43,-6.381842838180923
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)CCCl,C33614140_decoy,CASP3,Decoy,0,-8.82563,-6.3,-1.61,-7.141317784249285
CCCC(=O)N(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(N(C)C)cc1)[C@@H](C)CC,C33645718_decoy,CASP3,Decoy,0,-8.35288,-7.08,-1.77,-7.6184509875276385
COc1ccc(CCN(Cc2cccs2)C(=O)CN(C[C@H]2CCCO2)C(=O)C(C)(C)C)cc1OC,C33778046_decoy,CASP3,Decoy,0,-10.2918,-7.13,-2.17,-9.382107420450746
CCCCN(Cc1cccn1C)C(=O)CN(C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)[C@H](C)CC,C33778332_decoy,CASP3,Decoy,0,-7.06487,-5.48,-4.33,-6.223954538186129
CCCCCCc1ccc(C(=O)N(CC(=O)N(CCOC)Cc2cccn2C)[C@H](C)CC)cc1,C33788373_decoy,CASP3,Decoy,0,-7.69715,-5.45,-1.79,-6.367428948168037
COc1ccc(CCN(Cc2ccc(C)s2)C(=O)CN(C(=O)/C=C/c2ccccc2)C2CC2)cc1OC,C34869719_decoy,CASP3,Decoy,0,-7.56261,-7.84,-2.96,-7.454446740245995
COc1ccc(CCN(Cc2sccc2C)C(=O)CN(CC(C)C)C(=O)CCl)cc1OC,C35214563_decoy,CASP3,Decoy,0,-8.29369,-5.66,-2.86,-6.770159371472448
CCCCN(Cc1cccn1C)C(=O)CN(CCCOC)C(=O)c1ccc(Br)cc1,C35336032_decoy,CASP3,Decoy,0,-7.92747,-4.94,-3.67,-6.381532937005385
COCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccccc1)C(=O)C(C)(C)C,C35350525_decoy,CASP3,Decoy,0,-7.66319,-5.28,-4.02,-5.903026776155172
COCCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccccc1)C(=O)c1ccc(C)cc1,C35350529_decoy,CASP3,Decoy,0,-7.97148,-8.09,-2.75,-8.139116663296534
CC[C@@H](C)N(Cc1cccn1Cc1ccccc1C)C(=O)CN(CCOC)C(=O)CC(C)(C)C,C35395430_decoy,CASP3,Decoy,0,-7.80147,-6.37,-4.05,-7.069219598721776
CCCCc1ccc(C(=O)N(CC(=O)c2c(C)c(C(=O)OCC)n(CC)c2C)C2CC2)cc1,C35542577_decoy,CASP3,Decoy,0,-8.0072,-5.98,-1.47,-6.482574388489024
CCCC[C@H](CC)C(=O)N(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(C)C,C35765977_decoy,CASP3,Decoy,0,-8.80087,-7.11,-2.91,-7.940247910757148
CCOCCCN(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccc(C)o1)C(=O)c1ccc(CC)cc1,C35766030_decoy,CASP3,Decoy,0,-8.88697,-5.81,-1.47,-6.6970856126953855
CCCC[C@H](CC)C(=O)N(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1ccco1)C(C)C,C35767518_decoy,CASP3,Decoy,0,-8.11972,-6.13,-2.37,-7.082130183474543
CCCCCC(=O)N(CC(=O)N(Cc1ccc2c(c1)OCO2)Cc1cccs1)C[C@@H]1CCCO1,C35771088_decoy,CASP3,Decoy,0,-8.50103,-5.4,-1.47,-7.1190879944522205
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1sccc1C)C(=O)CC(C)(C)C,C35773876_decoy,CASP3,Decoy,0,-9.67785,-6.67,-4.83,-7.385714211383181
CCCCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1sccc1C)C(C)=O,C35774949_decoy,CASP3,Decoy,0,-8.34202,-5.98,-3.76,-6.948083455946759
CCc1ccc(C(=O)N(CC(=O)N(CCc2ccc(OC)c(OC)c2)Cc2cccs2)C2CC2)cc1,C35795814_decoy,CASP3,Decoy,0,-9.92948,-6.36,-2.02,-8.561948131840717
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)C(=O)CCl,C35796336_decoy,CASP3,Decoy,0,-9.26579,-6.12,-2.29,-8.503989861618756
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1)C(=O)c1cccc(F)c1,C35796389_decoy,CASP3,Decoy,0,-8.83717,-7.35,-5.37,-8.017850395178288
COc1ccc(CCN(Cc2ccc(C)s2)C(=O)CN(CC(C)C)C(=O)C2CC2)cc1OC,C35797335_decoy,CASP3,Decoy,0,-8.74588,-6.49,-3.75,-8.840557223426345
C=CCN(CC(=O)N(CCc1ccc(OC)c(OC)c1)Cc1ccc(C)s1)C(=O)c1ccccc1F,C35798172_decoy,CASP3,Decoy,0,-8.0227,-6.35,-1.56,-7.010439093827068
CCOCCCN(CC(=O)c1c(C)c(C(=O)OCC)n(CC)c1C)S(=O)(=O)c1cccc2ccccc12,C35869523_decoy,CASP3,Decoy,0,-8.72472,-6.57,-3.16,-6.926706893713604
C=CCN(Cc1cnc(S(=O)(=O)Cc2cccc(C(F)(F)F)c2)n1C1CC1)C(=S)NCC,C36040769_decoy,CASP3,Decoy,0,-9.37328,-5.55,-2.09,-5.437083385159374
CCC/C=C/[C@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C)C(=O)[C@@H](CC)CCCC,C36526887_decoy,CASP3,Decoy,0,-8.48353,-6.48,-3.63,-6.513443807532187
C/C=C/[C@@H](C(=O)NCS(=O)(=O)c1ccc(C)cc1)N(C(=O)[C@@H](CC)CCCC)C(C)(C)C,C36582768_decoy,CASP3,Decoy,0,-7.1417,-6.09,-4.54,-6.5404566612164405
CCOc1ccc(OCC(=O)OCc2csc(-c3ccc(OCC)c(OC)c3)n2)cc1,C39546856_decoy,CASP3,Decoy,0,-7.42541,-6.56,-2.33,-6.403685549351556
COCCCn1c(COc2ccc(OC)cc2)nnc1SCc1ccc([N+](=O)[O-])cc1,C39767931_decoy,CASP3,Decoy,0,-7.89555,-6.32,-2.39,-6.028750024561905
CCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OCc3ccccc3C)c(OCC)c2)SC1=S,C40938782_decoy,CASP3,Decoy,0,-10.2609,-7.95,-2.51,-8.685262497927052
C=CCn1c(SCC(=O)N(CC(=O)OCC)c2ccccc2)nnc1-c1ccccc1OC,C10242866_decoy,CASP3,Decoy,0,-7.89067,-6.14,-3.13,-6.807805898702018
CC[C@@H](C)N(C(=O)CSc1nncn1C)[C@H]1CCS(=O)(=O)C1,C05126525_decoy,CASP3,Decoy,0,-6.9892,-4.98,-2.22,-5.89399458669843
CCN(C(=O)c1cn(CC)c2nc(C)ccc2c1=O)[C@H]1CCS(=O)(=O)C1,C06881111_decoy,CASP3,Decoy,0,-6.72519,-6.36,-0.71,-6.799227968000803
C[C@H]1CCCCN1C(=O)CSc1nnc([C@H]2CCS(=O)(=O)C2)o1,C08072734_decoy,CASP3,Decoy,0,-7.56136,-7.15,-1.62,-5.878460986877036
C[C@@H](Sc1cccc[n+]1[O-])C(=O)N1CCN(C(=O)c2ccco2)CC1,C03355364_decoy,CASP3,Decoy,0,-6.14835,-6.15,-2.56,-5.753329207694792
CCN(C(=O)[C@@H](C)Sc1nncn1C1CC1)[C@@H]1CCS(=O)(=O)C1,C09983266_decoy,CASP3,Decoy,0,-7.74838,-5.5,-0.52,-6.321670186270161
CC(C)n1cc(C(=O)N2CCC[C@H](c3ncncc3-c3ccncc3)C2)cn1,C12088569_decoy,CASP3,Decoy,0,-6.67747,-7.75,-0.67,-7.692257770974972
CCn1cc(C(=O)N2CCC[C@H](c3ncncc3-c3ccncc3)C2)c(C)n1,C12117205_decoy,CASP3,Decoy,0,-6.34123,-6.56,-0.96,-5.921496524295974
C[C@@H](Sc1nnc2n1CCCCC2)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1,C12997582_decoy,CASP3,Decoy,0,-7.82475,-6.68,-0.77,-6.483965291214769
CC(C)n1ncc2c(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)cc(C3CC3)nc21,C13004637_decoy,CASP3,Decoy,0,-7.71424,-6.5,-1.33,-7.092635978527839
COc1ccc(N2C[C@H](n3cncc3-c3cn(C)nc3C)CC2=O)cc1,C19719461_decoy,CASP3,Decoy,0,-6.84339,-5.64,-1.82,-5.330632218681981
Cc1nnc(CN(C)C(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)o1,C23620190_decoy,CASP3,Decoy,0,-6.43437,-5.81,-2.43,-5.033556057414819
O=C(/C=C/c1ccc(-n2ccnc2)cc1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1,C24082483_decoy,CASP3,Decoy,0,-7.35792,-7.81,-1.08,-6.0322610108426975
Cc1ccc(N2C[C@@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc1,C24969277_decoy,CASP3,Decoy,0,-6.51623,-5.48,-0.47,-4.816909885984008
C=C[n+]1ccn(-c2nc3ccccc3nc2[N-]S(=O)(=O)c2ccc(C)cc2)c1,C03198102_decoy,CASP3,Decoy,0,-6.41356,-6.7,-3.13,-6.113269004265608
Cc1csc(/C(C#N)=N/OC(=O)[C@]23CC[C@](C)(C(=O)O2)C3(C)C)n1,C33960731_decoy,CASP3,Decoy,0,-8.46068,-5.77,-2.5,-7.275195626859577
Cc1ccc(C(=O)N2CCN(C[C@H]3CN(C(=O)c4ccoc4)CCO3)CC2)cc1,C35864397_decoy,CASP3,Decoy,0,-6.80352,-6.38,-2.08,-5.53553468861047
CCC(=O)N1CCN([C@H](C(=O)N2CCN(C(C)=O)CC2)C2CCCC2)CC1,C36250364_decoy,CASP3,Decoy,0,-7.1366,-6.4,-0.75,-5.173717611949904
COc1nn(C)cc1C(=O)N1CCN(C(=O)[C@@H]2C[C@@H]2c2cccs2)CC1,C38490380_decoy,CASP3,Decoy,0,-8.20033,-5.59,-2.09,-5.972299300322451
CC(C)c1nnc(C2CCN(C(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)CC2)o1,C38518196_decoy,CASP3,Decoy,0,-7.19753,-6.48,-0.44,-5.101677771373301
CCOC(=O)c1nn(C)c2c1CN(C(=O)C1=C[C@@H]3N=CC=C3C=C1)CC2,C39344580_decoy,CASP3,Decoy,0,-7.439,-5.72,-0.72,-6.981074117036637
Cc1ccc(CN(C)C(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)o1,C48370280_decoy,CASP3,Decoy,0,-6.40351,-7.26,-2.26,-5.588047632058726
COc1ccccc1N1C(=O)C[C@@H](N2CCN(c3nccs3)CC2)C1=O,C22729668_decoy,CASP3,Decoy,0,-6.93905,-6.09,-2.27,-5.443372553787435
N#CCCN(CCC#N)C(=O)Cn1cnc2sc3c(c2c1=O)CCC3,C31628241_decoy,CASP3,Decoy,0,-7.77232,-5.03,-0.6,-5.353994855925127
Cc1noc(C2CCN(C(=O)[C@H]3CC(=O)N(CC(F)(F)F)C3)CC2)n1,C59588160_decoy,CASP3,Decoy,0,-6.49859,-5.39,-0.4,-4.825636757949252
Cc1nnc([C@H](CC(=O)N(C)[C@H]2CCS(=O)(=O)C2)c2ccccc2)o1,C62089347_decoy,CASP3,Decoy,0,-7.11187,-7.54,-0.87,-6.125825538855399
O=C(CC[C@@H]1CCS(=O)(=O)C1)N1CCC(C(=O)N2CCOCC2)CC1,C62149185_decoy,CASP3,Decoy,0,-7.56952,-5.44,-0.27,-5.618767827173377
O=C(CCc1csc(-c2ccccn2)n1)N1CCO[C@@H]2CS(=O)(=O)C[C@@H]21,C62452059_decoy,CASP3,Decoy,0,-7.07666,-6.66,-2.85,-5.408249271848556
CC(C)Oc1ccc(C(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)cn1,C63756437_decoy,CASP3,Decoy,0,-7.16916,-6.84,-1.09,-6.386655412413213
Fc1cccc(-n2cc(C3=N[C@H]4C(=N3)C=NN4Cc3ccncc3)cn2)c1,C63844672_decoy,CASP3,Decoy,0,-6.50647,-6.6,-0.68,-4.8448190076356
Cc1nnc(SCC(=O)N2CCN(C(=O)[C@@H]3CCCO3)CC2)s1,C63882805_decoy,CASP3,Decoy,0,-6.39815,-5.18,-1.95,-5.0656201441098965
CCN(C(=O)c1nc(C)n(-c2ccccc2Cl)n1)[C@@H]1CCS(=O)(=O)C1,C63898037_decoy,CASP3,Decoy,0,-7.46506,-6.88,-0.59,-5.144669390980629
CCc1nnc(C2=C[C@@H](S(=O)(=O)N3CCCc4ccccc43)C=N2)o1,C64923952_decoy,CASP3,Decoy,0,-7.6298,-5.78,-1.75,-5.910914158278594
O=C(Cc1cccc(F)c1)N1CCN(C(=O)[C@H]2C=C(c3ccncc3)N=N2)CC1,C64965107_decoy,CASP3,Decoy,0,-7.07963,-6.88,-2.56,-5.89590415799899
CCN(CC)S(=O)(=O)[C@H]1C(C)=NC(c2nnc(C3CCC3)o2)=C1C,C65186461_decoy,CASP3,Decoy,0,-7.06772,-6.53,-1.7,-5.412537919999664
CCC(=O)N1CCc2cc(N3C[C@H](C(=O)N4CCN(C(C)C)CC4)CC3=O)ccc21,C65195438_decoy,CASP3,Decoy,0,-6.21787,-7.25,-1.3,-5.012408147337529
CCCn1ncc(N2CCC(C(=O)N3CCN(C)CC3)CC2)cc1=O,C65311336_decoy,CASP3,Decoy,0,-7.01588,-5.36,-1.96,-5.182224078722648
C[C@]1(n2cc(C3=CCN(Cc4ncccn4)CC3)cn2)CCS(=O)(=O)C1,C65398949_decoy,CASP3,Decoy,0,-7.11172,-6.09,-1.01,-5.326760373905423
O=C(CS(=O)(=O)Cc1cccc(Br)c1)N1CCCn2ncnc21,C65895718_decoy,CASP3,Decoy,0,-7.6461,-6.44,-1.65,-5.090564402672918
C=CCCO[C@H](C)C(=O)N1CCN(C(=O)[C@@H]2CCS(=O)(=O)C2)CC1,C66309600_decoy,CASP3,Decoy,0,-6.7881,-6.07,-1.33,-5.363619598091778
C=CCCO[C@@H](C)C(=O)N1CCN(C(=O)[C@H]2CCS(=O)(=O)C2)CC1,C66309604_decoy,CASP3,Decoy,0,-6.68915,-5.55,-1.73,-5.570690014425453
Cc1ncsc1CN(C)C(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1,C66419879_decoy,CASP3,Decoy,0,-7.80083,-5.71,-0.4,-5.78816126461781
CN(C)c1nn(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c(=S)s1,C66447689_decoy,CASP3,Decoy,0,-8.1829,-4.99,-0.99,-6.860857230991622
Cc1cc(C(=O)N2CCN(Cn3nc(N(C)C)sc3=S)CC2)c(C)o1,C66448451_decoy,CASP3,Decoy,0,-6.73611,-4.97,-1.93,-5.878171085347704
C[C@@H](c1cccnc1)N1C(=O)C[C@@H](N2CCN(C(=O)c3ccsc3)CC2)C1=O,C66584881_decoy,CASP3,Decoy,0,-9.25888,-6.07,-2.44,-6.586188868553999
CCCC(=O)N1CSC[C@H]1C(=O)N1CCN(C(=O)c2ccoc2C)CC1,C66628667_decoy,CASP3,Decoy,0,-7.68165,-6.59,-2.1,-6.736422730202464
CC1CCC(N2C[C@@H](C(=O)N3CCC(N(C)S(C)(=O)=O)CC3)CC2=O)CC1,C66829646_decoy,CASP3,Decoy,0,-6.61397,-5.61,-2.12,-4.575930600566408
CC(C)[C@@H](C(=O)N(C)CC(=O)N1CCOCC1)N1C[C@H](C)O[C@@H](C)C1,C66896939_decoy,CASP3,Decoy,0,-6.37614,-6.29,-1.92,-5.424883847327611
O=C([C@@H]1CCCCN1S(=O)(=O)C[C@@H]1CCCCO1)N1CCOCC1,C66935942_decoy,CASP3,Decoy,0,-6.60954,-6.69,-0.45,-5.608557169435724
CCCO[C@@H]1CCCN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)C1,C67109823_decoy,CASP3,Decoy,0,-6.48997,-5.43,-0.43,-5.337165053858961
CCc1ncc(CN(C)CC(=O)N2CCN(C(=O)N(C)C)CC2)s1,C67402245_decoy,CASP3,Decoy,0,-5.66876,-5.22,-1.77,-5.123736818822706