SMILES,Molecule Name,Target Name,Type,label,LF_score,GN_score,DD_score, RMSD_Energy
c1ccc(NCc2ccc(CNc3ccccn3)cc2)nc1,CHEMBL237830_active,CXCR4,Active,1,-7.0329,-7.98,-2.89,-7.273183824430256
c1cc(CN2CCCNCCNCCCNCC2)ccc1CN1CCCNCCNCCCNCC1,CHEMBL18442_active,CXCR4,Active,1,-8.87989,-7.66,-3.71,-3.3241124123436347
c1cc2nc(c1)CCNCCN(Cc1ccc(CN3CCNCCc4cccc(n4)CCNCC3)cc1)CCNCC2,CHEMBL1202231_active,CXCR4,Active,1,-9.14436,-8.94,-1.96,-7.515737558582154
CC1(C)CN2C(CS/C(=N\C3CCCCC3)NC3CCCCC3)=CSC2=N1,CHEMBL460491_active,CXCR4,Active,1,-9.68586,-7.52,-3.41,-3.911337028313296
CC1(C)CN2C(CS/C(=N\C3CCCCCC3)NC3CCCCCC3)=CSC2=N1,CHEMBL518501_active,CXCR4,Active,1,-10.373,-8.6,-1.15,-9.771419666604473
C1=C(CS/C(=N\C2CCCCCC2)NC2CCCCCC2)N2CCN=C2S1,CHEMBL508054_active,CXCR4,Active,1,-9.37345,-7.29,-0.24,-10.326927738815412
CN(C)CCCc1c(CN(C)[C@H]2CCCc3cccnc32)ncc2ccccc12,CHEMBL1096504_active,CXCR4,Active,1,-9.22277,-8.02,-1.57,-8.721367931402874
CC(C)N1CCC[C@H](Cn2c(CN(C)[C@H]3CCCc4cccnc43)nc3ccccc32)C1,CHEMBL1092637_active,CXCR4,Active,1,-9.42942,-9.14,-2.11,-9.12030485449734
C1=C(CS/C(=N\C2CCCCCCC2)NC2CCCCCCC2)N2CCN=C2S1,CHEMBL454896_active,CXCR4,Active,1,-9.32273,-7.92,-4.06,-3.824049777498856
C1=C(CS/C(=N\C2CCCCC2)NC2CCCCCC2)N2CCN=C2S1,CHEMBL541728_active,CXCR4,Active,1,-8.92473,-7.37,-0.7,-8.047532892321383
Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O,CHEMBL129_active,CXCR4,Active,1,-6.4748,-7.86,-1.26,-6.658396732435415
C1=C(CS/C(=N\C2CCCCC2)NC2CCCCCCC2)N2CCN=C2S1,CHEMBL460298_active,CXCR4,Active,1,-8.95472,-7.69,-0.26,-8.464684606758711
c1ccc(CNCc2ccc(CN3CCCNCCNCCCNCC3)cc2)nc1,CHEMBL477121_active,CXCR4,Active,1,-7.63904,-7.76,-2.23,-6.268582625924078
C1=C(CS/C(=N\C2CCCCC2)NC2CCCCC2)N2CCN=C2S1,CHEMBL452864_active,CXCR4,Active,1,-9.07129,-7.15,-2.4,-3.7664886689064185
NCCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1088913_active,CXCR4,Active,1,-8.48678,-7.96,-1.66,-9.294841960564217
C1=C(CS/C(=N\C2CCCCC2)NC2C3CC4CC(C3)CC2C4)N2CCN=C2S1,CHEMBL461359_active,CXCR4,Active,1,-9.55823,-7.78,-3.39,-4.1036941000116745
CN(C)CC(=O)NCc1c(CN(C)[C@H]2CCCc3cccnc32)ncc2ccccc12,CHEMBL1094864_active,CXCR4,Active,1,-8.69615,-8.79,-3.1,-9.725302529681455
CN(Cc1nc2ccccc2n1CCCN)C1CCCc2cccnc21,CHEMBL577268_active,CXCR4,Active,1,-9.37549,-9.04,-2.05,-9.54799219344673
NCc1ccccc1CN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1093008_active,CXCR4,Active,1,-8.49469,-9.03,-1.19,-8.695972135753278
C1=C(CS/C(=N\C2CCCCC2)NC2CCCCC2)N2CCCN=C2S1,CHEMBL516630_active,CXCR4,Active,1,-9.77736,-7.28,-0.65,-9.205924080455544
c1cc(CN2CCCNCCNCCNCCC2)ccc1CN1CCCNCCNCCNCCC1,CHEMBL543895_active,CXCR4,Active,1,-10.0053,-7.31,-1.6,-7.092300212886572
NCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1088912_active,CXCR4,Active,1,-8.77562,-7.91,-3.32,-8.286738294506028
CCCCCCN/C(=N/C1CCCCC1)SCC1=CSC2=NCCN12,CHEMBL461358_active,CXCR4,Active,1,-8.36124,-6.21,-1.18,-8.057091460325134
NCCCCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1088916_active,CXCR4,Active,1,-8.43588,-7.44,-1.96,-8.248592855064715
CN1CCC(n2c(CN(C)C3CCCc4cccnc43)nc3ccccc32)CC1,CHEMBL1091591_active,CXCR4,Active,1,-8.77198,-8.36,-1.94,-7.66226797058979
NC/C=C\CN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1089844_active,CXCR4,Active,1,-9.07045,-7.7,-3.32,-9.777047076462
CN(C)CCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1092301_active,CXCR4,Active,1,-8.39301,-7.57,-3.98,-8.138779386943995
Nc1ccn([C@H]2CC[C@@H](CO)O2)c(=O)n1,CHEMBL853_active,CXCR4,Active,1,-6.43184,-7.03,-1.27,-6.583335343531685
NCc1ccc(CN(Cc2nc3ccccc3[nH]2)C2CCCc3cccnc32)cc1,CHEMBL1092324_active,CXCR4,Active,1,-8.35073,-8.57,-3.91,-9.908536465496647
NC/C=C/CN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1089845_active,CXCR4,Active,1,-9.13979,-8.28,-1.74,-9.601611233284796
C1=C(CS/C(=N\C2CCCCC2)NC2CCCC2)N2CCN=C2S1,CHEMBL460299_active,CXCR4,Active,1,-8.75226,-7.07,-2.08,-3.681395555983855
CNCCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1092302_active,CXCR4,Active,1,-8.6032,-6.95,-2.23,-8.495678737185324
c1ccc(CNCc2ccc(CN(Cc3nc4ccccc4[nH]3)C3CCCc4cccnc43)cc2)nc1,CHEMBL1089434_active,CXCR4,Active,1,-10.5035,-9.73,-3.09,-9.91184518610976
C1=C(CS/C(=N\C2CCCCC2)NC23CC4CC(CC(C4)C2)C3)N2CCN=C2S1,CHEMBL518041_active,CXCR4,Active,1,-10.2184,-7.51,-0.89,-9.56214814962165
CC(C)(C)C1CCC(N/C(=N/C2CCCCC2)SCC2=CSC3=NCCN23)CC1,CHEMBL462588_active,CXCR4,Active,1,-10.1768,-8.55,-0.64,-8.239153086115694
N#CCCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1092628_active,CXCR4,Active,1,-7.69007,-8.1,-1.77,-8.42775712612118
C1=C(CS/C(=N\C2CCCC2)NC2CCCC2)N2CCN=C2S1,CHEMBL454689_active,CXCR4,Active,1,-8.57491,-7.04,-1.21,-11.026708613552769
NCCCCCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1092596_active,CXCR4,Active,1,-9.22219,-8.1,-1.46,-9.602269531785986
CN(/C(=N/C1CCCCC1)SCC1=CSC2=NCCN12)C1CCCCC1,CHEMBL452868_active,CXCR4,Active,1,-9.30393,-7.08,-1.82,-8.759680001227863
NCC#CCN(Cc1nc2ccccc2[nH]1)C1CCCc2cccnc21,CHEMBL1089846_active,CXCR4,Active,1,-8.25034,-8.51,-2.06,-7.552318541223529
Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1,C04016812_decoy,CXCR4,Decoy,0,-9.28726,-7.89,-1.79,-8.952571454411217
O=C1[C@H]2[C@@H](C(=O)N1CCc1ccccc1)[C@@]1([NH2+][C@@H]2Cc2ccc(O)cc2)C(=O)Nc2ccccc21,C08790023_decoy,CXCR4,Decoy,0,-8.63783,-10.08,-1.7,-8.294122725349807
Cc1cc(Cl)cc2c1NC(=O)[C@]21[NH2+][C@@H](Cc2ccc(O)cc2)[C@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]21,C08791010_decoy,CXCR4,Decoy,0,-10.6817,-10.3,-2.78,-10.676692178272244
CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)C[NH+]1CCc2c(sc(N)c2C#N)C1,C09821180_decoy,CXCR4,Decoy,0,-8.10318,-8.69,-1.63,-7.831150930973413
CCC[NH+]1CCc2c(sc(NC(=O)CCCS(=O)(=O)c3ccc(F)cc3)c2C(N)=O)C1,C09914354_decoy,CXCR4,Decoy,0,-9.60209,-8.68,-2.2,-8.953522595604975
O=C1[C@H]2[C@@H](C(=O)N1CCc1ccccc1)[C@@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccccc21,C12885854_decoy,CXCR4,Decoy,0,-8.99731,-9.45,-2.79,-8.702607688465337
CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1([NH2+][C@@H]2Cc2c[nH]c3ccccc23)C(=O)Nc2ccc(C)cc21,C12886942_decoy,CXCR4,Decoy,0,-9.42466,-7.9,-1.6,-7.189394778469924
COc1cccc(NC(=O)c2sc3[nH+]c(N4CCCC4)c4c(c3c2N)CC(C)(C)OC4)c1,C13557158_decoy,CXCR4,Decoy,0,-9.02752,-11.29,-0.65,-8.765354194603773
C[NH2+]Cc1ccccc1-c1ccc(N2CCc3c(C(N)=O)nn(-c4ccc(OC)cc4)c3C2=O)cc1,C14969463_decoy,CXCR4,Decoy,0,-9.42705,-7.56,-1.0,-7.400694551001648
CC[NH+]1CCN([C@@H](c2cccs2)[C@H](C)NC(=O)C(=O)NCCc2c[nH]c3ccccc23)CC1,C20287997_decoy,CXCR4,Decoy,0,-9.27735,-8.21,-2.75,-7.675585207384502
Cc1ccc(NC(=O)NC(=O)[C@@H](C)S[C@H]2NN=C(C3=c4ccccc4=[NH+]C3)N2C2CC2)c(C)c1,C38769721_decoy,CXCR4,Decoy,0,-9.16972,-9.29,-1.85,-9.100288741730418
CSC1=C[C@@H]2C[C@@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467228_decoy,CXCR4,Decoy,0,-8.79,-8.32,-2.22,-7.746802224513758
CC(C)S(=O)(=O)C1=C[C@H]2C[C@H]3CO[P@](=O)(c4ccccc4O)N[NH+]3C[C@@H]2C=C1c1ccccc1O,C39467612_decoy,CXCR4,Decoy,0,-9.50893,-7.48,-1.34,-6.788629769912518
COc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4ccccc4C)CC34CC[NH2+]CC4)c2c1,C39598931_decoy,CXCR4,Decoy,0,-9.44752,-8.54,-1.61,-8.425249734390047
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cc(Cl)cc(Cl)c4)CC34CC[NH2+]CC4)c2c1,C39599038_decoy,CXCR4,Decoy,0,-10.5355,-9.32,-3.35,-10.224040383750287
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4cccc(Cl)c4F)CC34CC[NH2+]CC4)c2c1,C39599175_decoy,CXCR4,Decoy,0,-10.2586,-9.91,-2.99,-8.451042634840272
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)[C@@H]4CC=CCC4)CC34CC[NH2+]CC4)c2c1,C39599372_decoy,CXCR4,Decoy,0,-10.2751,-9.8,-1.22,-9.624173603990029
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2,C39631266_decoy,CXCR4,Decoy,0,-9.82956,-7.05,-1.48,-7.730898041146946
C[C@@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CC12CC[NH2+]CC2,C39631390_decoy,CXCR4,Decoy,0,-10.3412,-8.95,-2.15,-12.142528608166684
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2ccc(Br)cc2)CC12CC[NH2+]CC2,C39631496_decoy,CXCR4,Decoy,0,-9.10294,-9.1,-1.51,-7.923805484840368
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)cc1Cl,C39631979_decoy,CXCR4,Decoy,0,-12.2233,-8.41,-2.17,-10.177463048975342
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)c1F,C39655435_decoy,CXCR4,Decoy,0,-8.95672,-8.97,-1.26,-8.667143778085128
CCCC[C@H](C)C(=O)N1C[C@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676487_decoy,CXCR4,Decoy,0,-9.12497,-8.89,-3.42,-9.492918592308609
CNC(=O)[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39683852_decoy,CXCR4,Decoy,0,-7.75388,-9.1,-1.65,-10.216848591335356
Cc1cccc2c(CCNC(=O)[C@H]3CN(C(=O)[C@@H](Oc4ccccc4)C(C)C)CC34CC[NH2+]CC4)c[nH]c12,C39684236_decoy,CXCR4,Decoy,0,-8.87437,-8.87,-3.06,-8.478895966325034
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685744_decoy,CXCR4,Decoy,0,-9.11703,-8.85,-1.23,-9.16762676978498
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685750_decoy,CXCR4,Decoy,0,-9.93255,-9.17,-2.36,-8.875327156931895
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,C39685857_decoy,CXCR4,Decoy,0,-9.47226,-7.98,-1.2,-9.639416432783968
CC(C)[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685878_decoy,CXCR4,Decoy,0,-8.8407,-7.84,-2.38,-6.848915874925629
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@H]1NN[C@@H](c2ccc(F)cc2)[NH+]1CCC(=O)[O-],C39709385_decoy,CXCR4,Decoy,0,-8.34777,-8.61,-1.19,-8.819480716604758
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CC12CC[NH2+]CC2,C44713674_decoy,CXCR4,Decoy,0,-8.7772,-9.59,-0.97,-8.296208182192116
Cc1n[nH]c(C)c1[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C44714028_decoy,CXCR4,Decoy,0,-9.06935,-8.74,-1.78,-7.935425733756956
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3sc4c(c3C#N)CCCCC4)sc2[nH+]1,C29033420_decoy,CXCR4,Decoy,0,-10.4576,-11.12,-1.83,-9.345687305640784
COc1ccc(-[n+]2c(SCC(=O)Nc3ccc(Cl)c(C)c3)nc3n[nH]c(C)c3c2N)cc1,C33551431_decoy,CXCR4,Decoy,0,-9.97124,-7.77,-2.3,-8.445215911681256
CC[C@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(C)c(Cl)c1)C(=O)NCc1ccco1,C33672663_decoy,CXCR4,Decoy,0,-9.7025,-8.47,-2.13,-8.939443870026118
CCOc1ccc(NC(=O)CSc2nc3n[nH]c(C)c3c(N)[n+]2-c2cccc(Cl)c2)cc1,C33686757_decoy,CXCR4,Decoy,0,-9.66118,-8.92,-2.03,-8.954112375866254
C[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)N1CC[NH+](CCOc2ccc(Cl)cc2)CC1,C22791526_decoy,CXCR4,Decoy,0,-9.60645,-8.9,-4.2,-4.525945208154095
C[C@H](C(=O)Nc1ccc(F)c(F)c1F)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C59258662_decoy,CXCR4,Decoy,0,-8.44639,-9.73,-3.39,-7.777724704541997
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)N3NC=C(C(=O)Nc4cc5c(cc4[C@H](C)O)OCO5)C3=[NH+]2)cc1,C12847177_decoy,CXCR4,Decoy,0,-8.62175,-9.95,-1.45,-8.206289529527153
C/C(=N\NC(=[NH2+])S[C@H]1CC(=O)N(c2ccc(Br)cc2)C1=O)c1ccc(O)cc1,C59489279_decoy,CXCR4,Decoy,0,-8.62716,-7.08,-0.93,-6.6083216657392
C[C@H](O)c1cc2c(cc1NC(=O)C1=CNN3C1=[NH+][C@H](c1ccco1)C[C@@H]3C(F)(F)F)OCO2,C12468310_decoy,CXCR4,Decoy,0,-7.55962,-8.58,-0.73,-7.398143453175935
COc1cc(-c2c/c(=[NH+]\[C@H](Cc3c[nH]c[nH+]3)C(=O)[O-])c3cc(Cl)c(C)cc3o2)ccc1O,C17043337_decoy,CXCR4,Decoy,0,-11.3443,-8.53,-3.66,-4.502966210971329
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@@H]1C=C2NC(=C3CC3)C=C(C(F)(F)F)N2N1,C63547543_decoy,CXCR4,Decoy,0,-8.80984,-6.72,-1.92,-3.460317019463397
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@H]1C=C2NC(=C3CC3)C=C(C(F)(F)F)N2N1,C63547546_decoy,CXCR4,Decoy,0,-8.0972,-7.22,-0.7,-6.163262071277586
CCOCC[C@@H]1NN[C@H](NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(F)ccc4=[NH+]C3)C2)S1,C63557271_decoy,CXCR4,Decoy,0,-10.4392,-8.58,-1.78,-8.52267838091824
[H]/N=C(/Nc1nc(C)cc(C)n1)N(CCC1=c2ccccc2=[NH+]C1)C(=S)Nc1ccc(F)cc1,C63677518_decoy,CXCR4,Decoy,0,-9.36989,-9.91,-2.4,-9.032997783846184
COc1ccc(NC(=O)CS[C@@H]2N/C(=C\C(=O)NCCC3=c4ccccc4=[NH+]C3)CS2)cc1,C63687969_decoy,CXCR4,Decoy,0,-10.1558,-7.96,-3.73,-4.890014029016449
O=C(/C=C1/CS[C@H](SCC(=O)Nc2ccc(Cl)cc2)N1)NCCC1=c2ccccc2=[NH+]C1,C64652821_decoy,CXCR4,Decoy,0,-11.3813,-8.38,-4.71,-4.879737436049129
CNS(=O)(=O)c1ccc(NC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(=O)c2cccs2)cc1,C64707690_decoy,CXCR4,Decoy,0,-10.4482,-8.88,-4.41,-9.475597725678886
CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1[C@H](O)c4ccc(O)c5c4[C@@]3(CC[NH+]1CC1CC1)[C@H]2O5,C65742812_decoy,CXCR4,Decoy,0,-10.6085,-8.83,-2.56,-4.244303966362869
NC(=[NH2+])c1ccc(OCCCOc2ccc(C(N)=[NH2+])cc2Br)c(Br)c1,C01665651_decoy,CXCR4,Decoy,0,-13.3056,-5.33,-2.43,-9.277501994266382
CNC(=[NH+]C)c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C(NC)=[NH+]C)cc3)cc2)cc1,C01684446_decoy,CXCR4,Decoy,0,-9.82484,-6.63,-2.75,-6.966668659666152
Cc1cc(C2=[NH+]CCN2)ccc1NC(=O)c1ccc(C(=O)Nc2ccc(C3=[NH+]CCN3)cc2C)cc1,C01692399_decoy,CXCR4,Decoy,0,-8.637,-6.4,-2.5,-3.3339643744877807
O=C(Nc1ccc(C(=O)Nc2cccc(C3=[NH+]CCN3)c2)cc1)Nc1ccc(C2=[NH+]CCN2)cc1,C01694044_decoy,CXCR4,Decoy,0,-11.7334,-7.44,-1.65,-4.696634854298366
O=C(/C=C\c1ccc(/C=C/C(=O)Nc2cccc(C3=[NH+]CCN3)c2)cc1)Nc1cccc(C2=[NH+]CCN2)c1,C04759185_decoy,CXCR4,Decoy,0,-11.5148,-8.79,-2.89,-5.244290550596896
CN1CC[NH+]=C1c1ccc(NC(=O)Nc2ccc(NC(=O)Nc3ccc(C4=[NH+]CCN4C)cc3)cc2)cc1,C01713828_decoy,CXCR4,Decoy,0,-7.0236,-9.06,-2.16,-4.039455790750158
COc1ccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c(C[NH2+]C2CC(C)(C)CC(C)(C)C2)c1,C11873039_decoy,CXCR4,Decoy,0,-9.47615,-8.11,-2.14,-10.783224604182186
CN/C(=[NH+]\C)c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(/C(NC)=[NH+]/C)cc3)c(Cl)c2)cc1,C17323171_decoy,CXCR4,Decoy,0,-11.6259,-6.13,-2.44,-4.110225149904689
CN/C(=[NH+]\C)c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(/C(NC)=[NH+]/C)cc3)c([N+](=O)[O-])c2)cc1,C17324830_decoy,CXCR4,Decoy,0,-8.81423,-6.08,-1.83,-3.5074418075888807
C[C@@H]1C[NH+]=C(c2ccc(NC(=O)Nc3ccc(C(=O)Nc4ccc(C5=[NH+]C[C@H](C)N5)cc4)cc3)cc2)N1,C17325299_decoy,CXCR4,Decoy,0,-7.81647,-7.19,-1.9,-3.442019646227327
C[C@H]1C[NH+]=C(c2ccc(NC(=O)Nc3ccc(C(=O)Nc4ccc(C5=[NH+]C[C@H](C)N5)cc4)cc3)cc2)N1,C17325301_decoy,CXCR4,Decoy,0,-8.10154,-7.1,-5.59,-6.296046774689004
C[C@@H]1C[NH+]=C(c2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccc(C5=[NH+]C[C@H](C)N5)cc4)cc3)cc2)N1,C17353365_decoy,CXCR4,Decoy,0,-8.37756,-6.26,-1.89,-5.542267854709737
C[C@@H]1C[NH+]=C(c2ccc(NC(=O)Nc3ccc(NC(=O)c4ccc(C5=[NH+]C[C@H](C)N5)cc4)cc3)cc2)N1,C17353362_decoy,CXCR4,Decoy,0,-8.78027,-6.68,-2.24,-4.602921158188316
C[C@H]1C[NH+]=C(c2ccc(NC(=O)Nc3ccc(NC(=O)c4ccc(C5=[NH+]C[C@H](C)N5)cc4)cc3)cc2)N1,C17353363_decoy,CXCR4,Decoy,0,-9.28514,-6.93,-3.26,-3.474971560452162
C[C@@H]1C[NH+]=C(c2ccc(NC(=O)C3CCC(C(=O)Nc4ccc(C5=[NH+]C[C@H](C)N5)cc4)CC3)cc2)N1,C17375572_decoy,CXCR4,Decoy,0,-10.1401,-6.15,-2.11,-7.089549055413589
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCCOCC1,C32239411_decoy,CXCR4,Decoy,0,-7.40884,-5.0,-3.95,-2.871140616773343
CC(C)C[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCCOCC1,C32239413_decoy,CXCR4,Decoy,0,-7.83603,-6.68,-4.37,-3.7238775570461273
[NH3+][C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)/[NH+]=c1/ccc2c(C(F)(F)F)cc(O)oc-2c1,C35051138_decoy,CXCR4,Decoy,0,-9.30202,-8.51,-3.11,-4.5520586336516695
COC(=O)[C@H]1[NH+]=c2cccc(OC)c2=C1NC(=O)C[NH+]1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C38669789_decoy,CXCR4,Decoy,0,-10.557,-8.07,-2.37,-9.995850888222602
COC(=O)[C@@H]1[NH+]=c2cccc(OC)c2=C1NC(=O)C[NH+]1CCC(C(N)=O)([NH+]2CCCCC2)CC1,C38669791_decoy,CXCR4,Decoy,0,-9.70221,-8.7,-2.78,-8.933465462404573
CC1=C[C@@H](C(=O)N2C[C@@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674876_decoy,CXCR4,Decoy,0,-9.66594,-10.28,-3.1,-8.964069631301108
CC1=C[C@@H](C(=O)N2C[C@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)NN1C,C39674878_decoy,CXCR4,Decoy,0,-9.30514,-9.84,-2.01,-9.564862172449317
O=C(N/N=C(\[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C40151297_decoy,CXCR4,Decoy,0,-9.78639,-8.27,-3.7,-4.394277522923542
O=C(N/N=C(\[C@@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C40151299_decoy,CXCR4,Decoy,0,-9.05484,-8.99,-2.08,-8.523838414684455
O=C(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)c1ccccc1Cl,C40151330_decoy,CXCR4,Decoy,0,-9.72525,-7.81,-1.27,-8.879728866098537
O=C(N/N=C(\[C@@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)[C@@H](O)[C@H](O)CO)c1ccc([N+](=O)[O-])cc1,C40151339_decoy,CXCR4,Decoy,0,-8.86897,-7.91,-3.7,-4.027792605895838
[NH3+][C@H](COc1cncc(-c2ccc3c(c2)[C@@H](c2ccco2)C(=O)N3)c1)CC1=c2ccccc2=[NH+]C1,C52566213_decoy,CXCR4,Decoy,0,-9.57524,-9.15,-1.3,-9.198322993572411
C[C@H]1CC=C([C@@H]2C(=O)Nc3ccc(-c4cncc(OC[C@@H]([NH3+])CC5=c6ccccc6=[NH+]C5)c4)cc32)O1,C52566255_decoy,CXCR4,Decoy,0,-8.9555,-9.7,-2.28,-4.934460319517842
Cc1n[nH]c2ncc(-c3cc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)cnc3-c3ccoc3)cc12,C52569905_decoy,CXCR4,Decoy,0,-8.62532,-10.36,-0.98,-9.804052275520826
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)cnc3-c3ccoc3)nc12,C52569906_decoy,CXCR4,Decoy,0,-8.09488,-10.17,-1.91,-8.284936768594811
Cc1n[nH]c2ccc(-c3cc(OC[C@@H]([NH3+])CC4=c5cccnc5=[NH+]C4)cnc3-c3ccoc3)cc12,C52569912_decoy,CXCR4,Decoy,0,-9.18699,-10.32,-1.34,-12.119083896012414
Cc1occc1-c1nc(N)c(OC[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)cc1-c1cc2c(C)n[nH]c2cn1,C52569918_decoy,CXCR4,Decoy,0,-9.23418,-9.06,-3.22,-7.65387209352149
Nc1nccc(Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc2)n1,C52627706_decoy,CXCR4,Decoy,0,-9.11059,-9.77,-1.95,-8.633913015048211
CC(C)(CC1=CN=CC1)[C@@H]1C(=O)Nc2ccc(-c3cncc(OC[C@@H]([NH3+])CC4=c5ccccc5=[NH+]C4)c3)cc21,C52634393_decoy,CXCR4,Decoy,0,-11.7033,-10.51,-3.25,-10.810916065619756
CC1(C)CC(NC(=O)CN2CCN(CC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)CC2)CC(C)(C)[NH2+]1,C22917039_decoy,CXCR4,Decoy,0,-8.73576,-7.21,-4.05,-3.7129867474046936
COc1ccc(S(=O)(=O)N[C@@H]2Nc3ccc(C(=O)NC4[NH+]=c5ccccc5=[NH+]4)cc3S2)cc1,C63280069_decoy,CXCR4,Decoy,0,-9.02805,-10.67,-1.25,-8.425064024088524
Cc1ccc2c(c1)=[NH+][C@@H](S[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1)[NH+]=2,C63626002_decoy,CXCR4,Decoy,0,-10.1887,-7.24,-1.36,-4.844611461371863
Cc1ccc2c(c1)=[NH+][C@H](S[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1)[NH+]=2,C63626005_decoy,CXCR4,Decoy,0,-9.71091,-7.2,-1.81,-6.878428853878249
CCOC(=O)C1=C(C)N[C@@H](C)[C@@H]1S(=O)(=O)NCC(=O)Nc1ccc(C2[NH+]=c3ccccc3=[NH+]2)cc1,C63635498_decoy,CXCR4,Decoy,0,-8.11714,-7.18,-2.05,-6.016670427975145
Cc1ccc(C2=[NH+][C@H](c3ccccc3S(=O)(=O)NC[C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)ON2)cc1,C63763488_decoy,CXCR4,Decoy,0,-10.2181,-10.56,-1.21,-8.497690033527395
NC(=O)Cc1ccc(OCC2=[NH+][C@H](C(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)ON2)cc1,C63782754_decoy,CXCR4,Decoy,0,-9.2596,-9.35,-1.03,-7.508133411864414
O=C1[NH+]=c2ccc(S(=O)(=O)Nc3ccc(C(=O)NNC(=O)c4cccc(Cl)c4)cc3)cc2=[NH+]1,C40075251_decoy,CXCR4,Decoy,0,-9.1507,-9.77,-2.17,-4.8733110323356525
O=C1[NH+]=c2ccc(S(=O)(=O)Nc3cc(Sc4ncn[nH]4)c(O)c4ccccc34)cc2=[NH+]1,C38797329_decoy,CXCR4,Decoy,0,-8.90929,-9.84,-2.02,-4.086805475593139
COc1ccccc1[C@@H]1Nc2cc(N)cc(C(=O)N[C@@H](C)[C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)c2[NH+]1C,C64002385_decoy,CXCR4,Decoy,0,-8.80402,-9.71,-3.44,-8.35237321009518
C[n+]1c(NNC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)=[NH+]C(=O)[NH+]=4)cc2)sc2ccccc21,C64173251_decoy,CXCR4,Decoy,0,-9.2846,-9.37,-3.85,-4.358601957367895
C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)cc1)c1ccc(S(N)(=O)=O)cc1,C64338097_decoy,CXCR4,Decoy,0,-10.7434,-7.77,-3.6,-4.305000669835148
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)[C@@H]1[NH+]=C(Cn3nc(-c4ccc(F)cc4)ccc3=O)NO1)[NH+]=2,C64610808_decoy,CXCR4,Decoy,0,-7.54436,-9.82,-1.33,-8.394963107914188
Cc1ccc2c(c1)=[NH+][C@H](CNC(=O)[C@@H]1[NH+]=C(Cn3nc(-c4ccc(F)cc4)ccc3=O)NO1)[NH+]=2,C64610809_decoy,CXCR4,Decoy,0,-7.91993,-9.76,-2.51,-3.985529391066448
Cn1c(SCC(=O)NCCC2[NH+]=c3ccccc3=[NH+]2)nnc1[C@@H]1[NH+]=C(c2ccc(F)cc2)NO1,C65099886_decoy,CXCR4,Decoy,0,-9.67712,-8.27,-2.23,-7.445141771527732
Cc1ccc(C2=[NH+][C@@H](c3nnc(SCC(=O)NCCC4[NH+]=c5ccccc5=[NH+]4)n3C)ON2)cc1,C65100000_decoy,CXCR4,Decoy,0,-7.66893,-9.55,-2.88,-3.9825466959325873
Cc1cc(N)c2cc(OCCCCOc3ccc4[nH+]c(C)cc(N)c4c3)ccc2[nH+]1,C01848318_decoy,CXCR4,Decoy,0,-7.48887,-7.93,-1.86,-7.362933570807455
CC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(Br)cc2Cl)o1,C13735320_decoy,CXCR4,Decoy,0,-9.55122,-6.65,-1.67,-12.82588470802174
C[NH+]1C[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C1CCN(C(=O)C(C)(C)[NH3+])CC1,C19080881_decoy,CXCR4,Decoy,0,-8.13665,-9.7,-2.52,-4.5913195214335865
C[NH+](CCO)CC/[NH+]=c1\cc2oc3ccccc3nc-2c2c(O)c3ccccc3c(O)c12,C20229078_decoy,CXCR4,Decoy,0,-10.1781,-7.33,-1.31,-3.809634588155757
C[C@@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2Cl)o1,C20875693_decoy,CXCR4,Decoy,0,-10.1069,-7.15,-2.4,-10.505521332935412
Cc1cc(-c2ccc(C[NH2+]CC[NH2+]CCO)o2)ccc1Br,C20875838_decoy,CXCR4,Decoy,0,-8.96918,-7.0,-1.7,-11.17065750009276
O[C@H]1CCCC[C@H]1[NH+]1CCC(CCC2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)CC1,C28235428_decoy,CXCR4,Decoy,0,-9.36157,-8.94,-3.5,-4.048631984919102
O=C/C(NNC(=O)c1ccccc1)=C1\[NH+]=c2cc(Cl)ccc2=[NH+]C1=O,C05286306_decoy,CXCR4,Decoy,0,-9.00211,-8.04,-3.99,-3.796376414857292
CC[NH+](C1CCCC1)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C35765578_decoy,CXCR4,Decoy,0,-9.55663,-7.35,-1.64,-11.168084235442157
COc1cc([C@H]2C/C(=N\NC3[NH+]=c4ccccc4=[NH+]3)c3ccc(C)cc3O2)ccc1O,C38779643_decoy,CXCR4,Decoy,0,-9.0198,-10.28,-0.83,-9.115627550373636
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](C)Cc1ccoc1C,C43261573_decoy,CXCR4,Decoy,0,-9.21307,-6.01,-1.66,-8.21947849554014
C[C@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[NH+](C(C)(C)C)CC1,C43261695_decoy,CXCR4,Decoy,0,-8.97045,-6.32,-1.09,-6.878169307603517
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](C2CC2)CC1,C43261896_decoy,CXCR4,Decoy,0,-8.81311,-7.05,-0.22,-8.171597045604049
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[NH+](C2CC2)CC1,C43286810_decoy,CXCR4,Decoy,0,-8.73324,-5.93,-1.59,-7.845754487008754
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)CC(=O)NC(C)C,C43287588_decoy,CXCR4,Decoy,0,-9.82912,-6.41,-1.68,-9.750097535130518
CC[C@H]([NH3+])[C@@H](c1ccncc1)[NH+](C)Cc1csc(Br)c1,C43354379_decoy,CXCR4,Decoy,0,-9.14718,-7.23,-1.36,-8.873776865632786
COc1ccccc1C[NH+](C)[C@H](c1cc(Br)cs1)[C@@H](C)[NH3+],C43286504_decoy,CXCR4,Decoy,0,-8.41907,-5.75,-1.48,-7.631230903924468
C[NH+](Cc1ccc(Cl)cc1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362047_decoy,CXCR4,Decoy,0,-9.89705,-7.04,-2.09,-11.451273857070252
[NH3+]C1CCC([NH2+]Cc2cc(Br)ccc2OC(F)F)CC1,C51694084_decoy,CXCR4,Decoy,0,-7.83478,-8.29,-3.25,-9.19012983076609
Nc1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627747_decoy,CXCR4,Decoy,0,-7.52811,-7.98,-0.7,-7.002417847507174
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[NH+]([C@@H](C)CC)CC1,C55063823_decoy,CXCR4,Decoy,0,-9.39806,-6.53,-1.07,-8.451224051142724
CC1(C)CC(NCCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1,C55202162_decoy,CXCR4,Decoy,0,-9.27243,-7.69,-1.24,-8.382464308678585
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CCC[C@@H]1C[NH+](C)C,C61642070_decoy,CXCR4,Decoy,0,-9.04039,-6.39,-1.74,-8.444964921920668
CCOc1ccc2c(c1)S[C@H](NC(=O)CS[C@@H]1[NH+]=c3ccc(C)cc3=[NH+]1)N2,C63075055_decoy,CXCR4,Decoy,0,-8.74314,-8.94,-3.62,-8.900532292277715
CCOc1ccc2c(c1)S[C@H](NC(=O)CS[C@H]1[NH+]=c3ccc(C)cc3=[NH+]1)N2,C63075060_decoy,CXCR4,Decoy,0,-9.68998,-8.95,-0.69,-8.68432847439581
C=CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccc(C)cc1,C63162942_decoy,CXCR4,Decoy,0,-9.16893,-9.2,-1.02,-9.222397129280749
C=CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccc(Cl)cc1,C63162959_decoy,CXCR4,Decoy,0,-8.7476,-7.55,-1.27,-6.694548862244426
O=C(NC(=S)Nc1cc(C2[NH+]=c3ccccc3=[NH+]2)ccc1Cl)c1cccs1,C63314359_decoy,CXCR4,Decoy,0,-10.077,-8.86,-1.31,-8.20599643122689
CCN1NC(C)=C(NC(=O)CS[C@@H]2[NH+]=c3cc(C)cc(C)c3=[NH+]2)[C@H]1C,C63340102_decoy,CXCR4,Decoy,0,-8.86566,-7.49,-3.87,-7.997056622402507
CCOc1ccc2c(c1)=[NH+][C@H](SCC(=O)N[C@H]1Nc3cc(OC)ccc3S1)[NH+]=2,C63426868_decoy,CXCR4,Decoy,0,-9.43359,-6.92,-3.07,-3.905541567999724
Cc1cccc([C@@H]2NN[C@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2Cc2ccco2)c1,C63446103_decoy,CXCR4,Decoy,0,-9.18102,-10.11,-3.39,-10.076768925772024
Cc1ccc([C@@H]2NN[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2Cc2ccco2)cc1,C63448330_decoy,CXCR4,Decoy,0,-9.17298,-8.17,-3.52,-7.608817770314455
COc1ccc2c(c1)S[C@H](NC(=O)CSC1[NH+]=c3ccccc3=[NH+]1)N2,C63677118_decoy,CXCR4,Decoy,0,-8.64117,-8.91,-1.95,-4.036024458176602
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1NN[C@H](SCc2ccc(Cl)c(Cl)c2)O1,C63720176_decoy,CXCR4,Decoy,0,-9.70185,-6.83,-2.0,-3.996620934146135
NN1C(SCC2[NH+]=c3ccccc3=[NH+]2)=NN[C@@H]1c1ccc(Cl)cc1,C63744007_decoy,CXCR4,Decoy,0,-9.16042,-9.21,-1.38,-10.169443394182752
Cc1sc2nc(CSCC(=O)NC3[NH+]=c4ccccc4=[NH+]3)[nH]c(=O)c2c1C,C63795325_decoy,CXCR4,Decoy,0,-8.61377,-8.59,-0.75,-7.090603501554064
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)C1(N2CN[NH2+]N2)CCCCC1,C63795997_decoy,CXCR4,Decoy,0,-9.50153,-9.81,-1.15,-9.300388504324928
COc1ccc([C@@H](C[NH2+][C@H](C)CC(N)=O)C2=c3ccccc3=[NH+]C2)cc1,C63919928_decoy,CXCR4,Decoy,0,-7.96575,-7.56,-1.12,-8.67702622720723
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@@H](SC/C=C/c2ccccc2)O1,C63985333_decoy,CXCR4,Decoy,0,-8.88765,-8.34,-3.06,-7.496563518382865
COc1ccc2c(c1)=C[C@@H](C[NH2+]C[C@@H]1CN(c3cccc(F)c3)N[C@H]1c1ccc(C)o1)[NH+]=2,C64061627_decoy,CXCR4,Decoy,0,-8.73652,-9.01,-1.84,-8.00434216437141
C[C@@H](NC(=O)Nc1ccccc1C(F)(F)F)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C64127703_decoy,CXCR4,Decoy,0,-7.38295,-9.81,-2.15,-4.213546155301301
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2c(Cl)cccc2Cl)O1,C64428653_decoy,CXCR4,Decoy,0,-9.99132,-9.5,-2.96,-4.252558324844832
CCN1c2ccccc2N2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]12,C65042622_decoy,CXCR4,Decoy,0,-7.4862,-9.0,-1.62,-7.546087443512616
COc1ccc(CC(=O)NCC(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc1Cl,C65305698_decoy,CXCR4,Decoy,0,-8.04715,-9.21,-4.6,-4.258100059943894
C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305782_decoy,CXCR4,Decoy,0,-7.07461,-7.88,-1.63,-6.262483461941346
COc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)c1,C65305807_decoy,CXCR4,Decoy,0,-7.37339,-8.8,-2.08,-4.241350794131688
CC[C@@H](C)[C@@H](NC(=O)Cc1cccc(OC)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305873_decoy,CXCR4,Decoy,0,-8.60129,-8.1,-1.26,-10.318763103539752
CC[C@@H](C)[C@@H](NC(=O)c1ccc(OC)cc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305973_decoy,CXCR4,Decoy,0,-8.76975,-7.74,-1.3,-7.864354666442497
CCC[C@H](NC(=O)Cc1cccc(OC)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65306003_decoy,CXCR4,Decoy,0,-7.61934,-8.04,-1.7,-7.451029214040043
CCC[NH2+][C@@H]1CCc2nc(C[C@H]3c4sc(N)nc4CC[C@@H]3[NH2+]CCC)sc2C1,C65739976_decoy,CXCR4,Decoy,0,-11.8211,-6.48,-3.06,-4.95082506258326
COc1ccccc1N1CC[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNS(=O)(=O)c2ccc(Cl)cc2)CC1,C08635630_decoy,CXCR4,Decoy,0,-9.53624,-9.84,-2.54,-7.625410332836858
OCCN(CCNc1[nH+]cc(C(F)(F)F)cc1Cl)c1[nH+]cc(C(F)(F)F)cc1Cl,C03116603_decoy,CXCR4,Decoy,0,-8.74456,-8.94,-1.7,-8.642120759756704
CC[NH+]1CCN(C(=O)[C@@H](C)[NH2+]C[C@@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)CC1,C09205618_decoy,CXCR4,Decoy,0,-9.1347,-9.39,-2.74,-9.584623374500008
Cc1cc(N2CC[NH+](C)CC2)[nH+]c2ccc(NC(=O)CCC(=O)N[C@@H](C)CCc3ccccc3)cc12,C09776960_decoy,CXCR4,Decoy,0,-9.89115,-8.75,-1.96,-7.9264105883749245
O=C1CC[C@H](CC[NH2+]CCOc2ccc(F)cc2)N1CC1([NH+]2CCOCC2)CCCCC1,C12207796_decoy,CXCR4,Decoy,0,-8.83061,-7.37,-2.42,-4.05023063884055
CC[NH+](CC)[C@@H](NC(=O)N[C@@H]([NH+](CC)CC)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,C03114922_decoy,CXCR4,Decoy,0,-10.4321,-5.92,-2.5,-4.357813419970307
CC[NH+](CC)CCC[C@H](C)NC(=O)CSc1nc(Cl)cc(N2CC[NH+](C)CC2)n1,C35247938_decoy,CXCR4,Decoy,0,-10.7415,-7.04,-1.46,-8.442995284408397
CC[NH+]1CCN(c2c(C[NH+](CCOC)Cc3cc(C)ccc3O)c(C)nn2-c2ccc(F)cc2)CC1,C35954614_decoy,CXCR4,Decoy,0,-9.75004,-8.22,-2.33,-8.670064604567594
CCOC(=O)[C@@H]1[NH+]=c2ccc(F)cc2=C1NC(=O)C[NH+]1CCN(c2ccc(Cl)cc2)CC1,C38592135_decoy,CXCR4,Decoy,0,-9.85703,-8.64,-2.84,-9.117292917950737
COC(=O)[C@H]1[NH+]=c2ccc(Cl)cc2=C1NC(=O)[C@H](C)[NH+]1CCN(c2cccc(OC)c2)[C@H](C)C1,C38609981_decoy,CXCR4,Decoy,0,-9.56838,-9.99,-1.43,-9.255663614307077
COC(=O)[C@H]1[NH+]=c2cc(OC)ccc2=C1NC(=O)C[NH+]1CCN(c2cccc(C)c2C)CC1,C38661501_decoy,CXCR4,Decoy,0,-10.3842,-9.64,-2.86,-4.895128503059575
COC(=O)[C@@H]1[NH+]=c2cc(OC)ccc2=C1NC(=O)CCN1CC[NH+](C2CCCCC2)CC1,C38664286_decoy,CXCR4,Decoy,0,-8.83893,-7.93,-0.27,-10.170876054758835
COC(=O)[C@@H]1[NH+]=c2cccc(OC)c2=C1NC(=O)C[NH+]1CCN(c2ccc(C)cc2C)CC1,C38684970_decoy,CXCR4,Decoy,0,-8.78628,-8.01,-3.79,-3.736563916080344
COC(=O)[C@@H]1[NH+]=c2cccc(OC)c2=C1NC(=O)C[NH+]1CCN(c2cc(C)ccc2C)CC1,C38685181_decoy,CXCR4,Decoy,0,-9.46581,-10.36,-2.42,-9.1769110754086
COc1ccc(C2=CN=[NH+][C@H]2c2ccc(OCC[NH+]3CCN(c4ccc(F)cc4)CC3)cc2O)cc1,C38782320_decoy,CXCR4,Decoy,0,-9.55879,-7.99,-3.35,-6.489004295682798
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)C1=C[C@@H](c2ccccc2OCc2ccc(Cl)cc2)[NH+]=N1,C38906324_decoy,CXCR4,Decoy,0,-8.91088,-9.34,-4.18,-4.200985422770086
CCOC(=O)c1cccc(N[C@H]2[NH+]=c3ccccc3=[NH+]/C2=N\S(=O)(=O)c2ccc(F)cc2)c1,C38965888_decoy,CXCR4,Decoy,0,-9.1557,-10.02,-3.37,-9.515121488363231
CCOC(=O)[C@@H]1[NH+]=c2ccccc2=C1NC(=O)CC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1,C39012000_decoy,CXCR4,Decoy,0,-9.38571,-9.39,-2.39,-8.379513563986707
COC(=O)[C@@H]1[NH+]=c2cc(OC)ccc2=C1NC(=O)C[NH+]1CCN(c2ccc(Cl)cc2)CC1,C39012463_decoy,CXCR4,Decoy,0,-9.87074,-8.01,-0.79,-8.730979338057482
COc1ccc(C[NH2+]C23CC4CC(CC(C4)C2)C3)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C23374181_decoy,CXCR4,Decoy,0,-9.6022,-7.79,-1.71,-9.918991355467677
C[C@H]([C@@H]1NN=C(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2C)N1c1ccc(Cl)cc1)[NH+](C)C,C39620482_decoy,CXCR4,Decoy,0,-9.50683,-9.12,-2.09,-9.206852868271152
CCc1ccc2c(c1)=C[C@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)[NH+](Cc1ccccc1)Cc1cccnc1)C(=O)[NH+]=2,C39710531_decoy,CXCR4,Decoy,0,-8.84599,-8.32,-1.95,-8.647776932155406
CCc1ccc2c(c1)=C[C@@H]([C@@H]([C@@H]1N=NNN1C(C)(C)C)[NH+](Cc1ccco1)Cc1cccs1)C(=O)[NH+]=2,C39710558_decoy,CXCR4,Decoy,0,-9.17358,-8.78,-1.96,-9.208486922350438
Cc1ccc2c(c1C)=[NH+]C(=O)[C@@H]([C@H]([C@@H]1N=NNN1C(C)(C)C)[NH+](Cc1ccc(F)cc1)Cc1ccco1)C=2,C39710778_decoy,CXCR4,Decoy,0,-9.10234,-8.49,-0.96,-8.90551260274239
Cc1cc2c(cc1C)=[NH+]C(=O)[C@H]([C@@H]([C@@H]1N=NNN1C(C)(C)C)[NH+](Cc1ccccc1)Cc1cccnc1)C=2,C39711258_decoy,CXCR4,Decoy,0,-9.67265,-9.24,-3.39,-5.37832658276368
COc1cccc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)c1OCC(=O)Nc1ccc(F)cc1,C39934859_decoy,CXCR4,Decoy,0,-8.44433,-7.81,-2.82,-7.518995138503622
CCOc1cc(C[NH2+]CCCn2cc[nH+]c2)cc(Cl)c1OCc1ccc(F)cc1Cl,C40719800_decoy,CXCR4,Decoy,0,-9.6897,-7.37,-3.51,-4.365314328977667
CCOc1cc(C[NH2+]CCCn2cc[nH+]c2)cc(Cl)c1OCc1c(F)cccc1Cl,C40719802_decoy,CXCR4,Decoy,0,-9.73697,-6.86,-0.94,-8.913106351673374
C[NH+](C)CCOc1ccc(-c2cncc(-c3cc4cc(O)ccc4n3CC[NH+](C)C)c2)cc1,C40848197_decoy,CXCR4,Decoy,0,-9.57295,-8.49,-3.84,-8.997198476489105
CC[NH+](CC)CCN1C(=O)[C@H](Cc2ccccc2)[NH2+]C12CCN(C(=S)Nc1ccc(OC)cc1)CC2,C36027032_decoy,CXCR4,Decoy,0,-11.1672,-9.0,-2.7,-8.898862152912814
O=C(Nc1ccc(N2CCC([NH2+][C@@H](CCn3cc[nH+]c3)c3ccccc3)CC2)cc1)c1ccccc1F,C39387707_decoy,CXCR4,Decoy,0,-9.50052,-8.39,-3.67,-7.768942242611653
COc1cc(C[NH2+]CC[NH2+]C[C@H](C)O)cc(Cl)c1OCc1ccc(Cl)cc1Cl,C23469522_decoy,CXCR4,Decoy,0,-9.68614,-6.39,-1.64,-7.499937382263504
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)cc1,C63108161_decoy,CXCR4,Decoy,0,-9.50808,-9.02,-3.27,-8.346506821871609
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccccc1Cl,C63437610_decoy,CXCR4,Decoy,0,-9.87341,-7.97,-1.05,-7.208744378709333
COc1ccc2c(c1)=C(CCNC(=O)[C@H]1C=C3[NH+]=C(c4ccco4)C=C(C(F)(F)F)N3N1)C[NH+]=2,C63547134_decoy,CXCR4,Decoy,0,-7.89286,-9.5,-1.15,-7.045302435853854
CC1CCC(C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C(=O)NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)CC1,C63626084_decoy,CXCR4,Decoy,0,-9.7623,-8.43,-3.06,-8.130134801290142
CCCCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(C3[NH+]=c4ccccc4=[NH+]3)cc2)cc1,C63667486_decoy,CXCR4,Decoy,0,-7.9706,-7.83,-3.69,-6.460107138775862
CC1=C(CCC2=[NH+]C3=c4ccccc4=[NH+][C@@H](SCC(=O)c4ccc(Cl)cc4)N3N2)[C@H](C)N=N1,C63708355_decoy,CXCR4,Decoy,0,-9.79159,-7.46,-1.13,-6.557489256630535
COc1cc(OC)cc(C(=O)Nc2ccc(SC[C@@H]3[NH+]=c4ccccc4=[NH+]C3=O)cc2)c1,C63751728_decoy,CXCR4,Decoy,0,-8.19285,-7.51,-2.21,-6.680318510513066
CC[C@@H](C)Nc1c[nH+]c2c(c1)[C@@H](NC(C)=O)[C@@H](C(=O)OC)N2CCC1=c2ccccc2=[NH+]C1,C63993514_decoy,CXCR4,Decoy,0,-8.95505,-8.06,-1.62,-12.742908702185035
COc1cccc(Cn2nc(C(=O)NC3CC3)c3c2CCN(CC2[NH+]=c4ccccc4=[NH+]2)C3)c1,C63993960_decoy,CXCR4,Decoy,0,-9.66495,-8.29,-2.29,-9.563223763655182
COC(=O)[C@@H]1[C@H](NC(C)=O)c2cc(N[C@H](C)CC(C)C)c[nH+]c2N1CCC1=c2ccccc2=[NH+]C1,C63994238_decoy,CXCR4,Decoy,0,-9.56712,-8.2,-1.4,-9.6545079375643
CC1=c2cc(Cl)ccc2=[NH+][C@H]1C(=O)NC[C@H](C)Oc1cccc(C[NH+](C)Cc2ccoc2)c1,C64120654_decoy,CXCR4,Decoy,0,-8.81896,-9.05,-1.58,-8.498487603613738
Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH2+]C[C@@H](C1=c2ccccc2=[NH+][C@@H]1c1ccccc1)c1ccccc1,C64155871_decoy,CXCR4,Decoy,0,-9.25497,-9.29,-1.65,-9.415621067707452
COC(=O)c1ccc(CN2C[C@H](SC3[NH+]=c4ccccc4=[NH+]3)C[C@H]2C(=O)NC(C)C)cc1,C64158013_decoy,CXCR4,Decoy,0,-8.85485,-7.52,-1.79,-7.661630816136538
CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NC[C@H](c1cccs1)[NH+]1CCC(C)CC1,C64220426_decoy,CXCR4,Decoy,0,-10.9803,-8.85,-1.66,-5.058193542382882
CC(C)OCCCN1[C@H](C)[C@@H](C)[C@@H](C2[NH+]=c3ccccc3=[NH+]2)[C@H]1NC(=O)c1ccccc1F,C64600412_decoy,CXCR4,Decoy,0,-9.79247,-6.67,-4.47,-6.680595043123436
CNC(=O)c1cn(CCCc2ccccc2)cc(C(=O)N[C@@H](C)[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)c1=O,C64640421_decoy,CXCR4,Decoy,0,-9.36724,-9.17,-4.79,-4.244360241520285
COc1cc(C[C@H]2CC(C[NH2+]CCCC3=c4ccccc4=[NH+][C@H]3C)=NO2)c(OC)c2c1OCO2,C64670846_decoy,CXCR4,Decoy,0,-8.82929,-8.18,-1.23,-7.714199940348316
C[C@H](CCNC(=O)[C@H](C)C1CCN(C(=O)[C@@H]2C=c3cc(Cl)ccc3=[NH+]2)CC1)[NH+]1CCCCCC1,C64744028_decoy,CXCR4,Decoy,0,-9.38717,-9.39,-2.17,-7.805097382248703
C[C@H](CCc1ccccc1)[NH2+]C[C@H](O)C[NH2+][C@@H](C)[C@@H]1COc2ccccc2O1,C04023819_decoy,CXCR4,Decoy,0,-8.01772,-8.69,-1.36,-8.00121636298747
CC(C)C[NH2+]CC(=O)Nc1ccc(-c2ccc(NC(=O)C[NH2+]CC(C)C)cc2)cc1,C04792051_decoy,CXCR4,Decoy,0,-8.51611,-6.36,-2.27,-7.494237051395962
Oc1ccccc1C[NH2+]CCCCCC[NH2+]Cc1ccccc1O,C02343991_decoy,CXCR4,Decoy,0,-8.19238,-7.2,-3.17,-9.118404512374635
O[C@H](C[NH2+]C1CCCCC1)CSC[C@H](O)C[NH2+]C1CCCCC1,C04989800_decoy,CXCR4,Decoy,0,-8.91423,-6.13,-2.04,-7.649260376251207
CCOC(=O)c1c(NC(=O)C[NH2+]CCC[NH+]2CCOCC2)sc2c1CCCC2,C05864031_decoy,CXCR4,Decoy,0,-9.90981,-7.71,-1.71,-9.461887511765733
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OCc1ccc(F)cc1,C08253975_decoy,CXCR4,Decoy,0,-8.60642,-7.35,-1.96,-8.312742931757054
CCOc1cc(C[NH2+]CCC[NH2+]C)ccc1OCc1ccc(Cl)cc1,C08254523_decoy,CXCR4,Decoy,0,-8.76141,-6.96,-1.36,-7.975587087242664
Cn1cc(CC[NH2+]Cc2cc(Cl)ccc2OC[C@H](O)C[NH+]2CCCCCC2)cn1,C11704250_decoy,CXCR4,Decoy,0,-10.3713,-7.64,-1.95,-9.715007383052484
CSCC[C@H]([NH3+])C(=O)NCC1([NH+]2CCC(C)CC2)CCCCC1,C11954908_decoy,CXCR4,Decoy,0,-10.4792,-6.23,-3.33,-4.175143970976492
COc1ccc(C[NH2+]CCC2=CCCCC2)c(OC[C@@H](O)C[NH+]2CCCC2)c1,C12301983_decoy,CXCR4,Decoy,0,-8.81698,-7.8,-2.15,-4.348642366913513
COCC[NH+]1CCC(CNC(=O)C[C@@H]2C(=O)NCC[NH+]2CCC(C)C)CC1,C12590185_decoy,CXCR4,Decoy,0,-9.34098,-6.5,-1.53,-8.0972364647582
COc1cc(C[NH2+]Cc2cc(F)cc(F)c2)ccc1OC[C@@H](O)C[NH+](C)C(C)C,C12744494_decoy,CXCR4,Decoy,0,-7.51996,-6.86,-3.73,-6.549899458051343
OCC[NH2+]CCC[NH2+]Cc1ccc(-c2cc(Cl)cc(Cl)c2)o1,C13733146_decoy,CXCR4,Decoy,0,-9.46753,-6.48,-2.13,-10.330512068470249
Cc1ccc(COc2ccc(Cl)cc2C[NH2+]CCC[NH2+]CCO)cc1,C13733239_decoy,CXCR4,Decoy,0,-9.22761,-7.65,-2.27,-10.460081184174047
OCC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(Br)cc2Cl)o1,C13733242_decoy,CXCR4,Decoy,0,-9.71644,-6.65,-0.76,-10.506371867835176
C[NH+](CCO)[C@@H](C[NH3+])c1ccc(OCCCc2ccccc2)cc1,C32088779_decoy,CXCR4,Decoy,0,-8.12107,-6.18,-2.09,-6.914973360113823
OCC[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1,C38240438_decoy,CXCR4,Decoy,0,-8.73783,-6.92,-1.18,-10.448115842472813
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C2(CC[NH2+]CC2)C1,C39634848_decoy,CXCR4,Decoy,0,-9.16731,-7.59,-2.25,-8.39833652348207
COc1ccc([C@@H](C[NH2+]C[C@@H](O)COc2ccc3ccccc3c2)[NH+]2CCCC2)cc1,C25764581_decoy,CXCR4,Decoy,0,-9.91088,-8.63,-1.15,-9.983794185365705
COc1cc(C(C)=O)ccc1OC[C@@H](O)C[NH2+]CC1([NH+]2CCCCC2)CCCCC1,C39945131_decoy,CXCR4,Decoy,0,-9.69093,-8.52,-4.03,-10.486564728260989
C[NH2+]CCC[NH2+]Cc1ccc(OCc2ccc(F)cc2Cl)cc1,C40719525_decoy,CXCR4,Decoy,0,-7.04595,-6.41,-0.83,-6.126486687468219
OCC[NH2+]CCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(F)cc1Cl,C40720894_decoy,CXCR4,Decoy,0,-9.81545,-7.43,-2.2,-9.848131769924503
COc1ccc(Br)cc1[C@@H](C[NH3+])[NH+](CC1CC1)C(C)C,C42580582_decoy,CXCR4,Decoy,0,-8.09561,-6.79,-4.43,-9.627226119404789
CC(C)CN(CC[NH+](C)C)[C@H](C[NH3+])c1ccc(Cl)c(Cl)c1,C42744968_decoy,CXCR4,Decoy,0,-9.35522,-6.04,-4.4,-8.967281908109262
CCCC[NH+](CCO)[C@@H](c1ccc(Br)cc1)[C@H]([NH3+])CC,C42954623_decoy,CXCR4,Decoy,0,-7.91152,-6.42,-2.72,-8.442742166919569
CCC(CC)[NH+](CCO)[C@H](C[NH3+])c1ccc(Br)cc1,C42955331_decoy,CXCR4,Decoy,0,-8.3385,-6.21,-2.01,-8.467782836640435
CCCC[NH+](CCO)[C@H](c1cccc(Br)c1)[C@@H](C)[NH3+],C43021374_decoy,CXCR4,Decoy,0,-8.77156,-7.1,-1.19,-9.939206802279536
CC(C)[NH+](CCCO)[C@H](c1cccc(Br)c1)[C@@H](C)[NH3+],C43021743_decoy,CXCR4,Decoy,0,-8.06072,-6.75,-2.67,-9.115389902520649
CCCC[NH+](CC(N)=O)[C@@H](c1ccccc1Br)[C@H]([NH3+])CC,C43093505_decoy,CXCR4,Decoy,0,-7.87008,-6.89,-1.73,-8.479339686642938
CC[C@H]([NH3+])[C@H](c1ccc(Cl)s1)[NH+](CC)CC(=O)NC(C)C,C43253645_decoy,CXCR4,Decoy,0,-9.06294,-6.7,-1.86,-8.5490133264879
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](CC(N)=O)CC(C)C,C43287678_decoy,CXCR4,Decoy,0,-7.91292,-6.15,-3.4,-8.008032415062175
C[C@H]([NH3+])Cc1cc(Cl)cc(Cl)c1OCCC[NH+]1CCCC1,C49334193_decoy,CXCR4,Decoy,0,-9.39727,-7.02,-1.63,-9.802046275185804
COc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)ccc1OCc1ccc(C)cc1,C20367378_decoy,CXCR4,Decoy,0,-7.33716,-7.22,-0.52,-8.506195700886513
C[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](CCO)Cc1ccccc1,C50513916_decoy,CXCR4,Decoy,0,-8.58186,-6.09,-1.86,-7.436232876083378
CC(C)C[C@H](C[NH2+]Cc1ccc(O)c(Br)c1)[NH+](C)C,C57395386_decoy,CXCR4,Decoy,0,-8.82864,-6.87,-1.66,-7.781253907062177
CC[C@H](C)/[NH+]=C(/N)NC[C@H](c1ccc(OC)cc1)[NH+]1CCCCC1,C58171454_decoy,CXCR4,Decoy,0,-9.29595,-6.51,-1.4,-8.557121717439783
OCC[NH2+]CC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl,C23255802_decoy,CXCR4,Decoy,0,-10.243,-7.47,-1.8,-9.802123176224754
Cc1ccc(COc2ccc(Cl)cc2C[NH2+]CC[NH2+]CCO)cc1,C20875181_decoy,CXCR4,Decoy,0,-8.47076,-6.36,-1.95,-8.618349201342829
COc1cccc(C[NH2+]CC[NH2+]C[C@@H](C)O)c1OCc1ccc(F)cc1Cl,C20876266_decoy,CXCR4,Decoy,0,-8.66399,-7.61,-3.22,-8.971889233347332
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N/N=C(\c1ccccc1)[C@@H](O)c1ccccc1,C63330694_decoy,CXCR4,Decoy,0,-6.97218,-7.91,-1.4,-6.090169542738053
CCc1ccccc1NC(=O)CS[C@@H]1N=N[C@@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684153_decoy,CXCR4,Decoy,0,-8.91158,-10.03,-3.99,-8.932348400541676
O=C(NCCC[NH2+]C1CCCCC1)NC1CC[NH+](CC(F)F)CC1,C64256185_decoy,CXCR4,Decoy,0,-7.9846,-6.15,-3.56,-6.380322938132412
Cc1cc2n([nH+]1)C[C@@H](C[NH2+]C[C@@H](O)COc1c(C)cccc1C)CN2,C58299024_decoy,CXCR4,Decoy,0,-8.96204,-7.71,-1.36,-9.081619234904686
COc1ccccc1CCC(=O)N[C@@H](CC(C)C)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305831_decoy,CXCR4,Decoy,0,-8.55692,-7.34,-1.54,-7.61469899897659
CCC[C@H](Nc1nc(CC[NH3+])nc2sc(C)c(C)c12)c1[nH+]ccn1C,C65381375_decoy,CXCR4,Decoy,0,-9.35178,-7.29,-0.69,-11.137421809066652
CC[NH+](CC)CCCC[NH2+]Cc1c[nH]nc1-c1ccc(OC)cc1,C65934581_decoy,CXCR4,Decoy,0,-8.66517,-7.0,-0.86,-10.330762866202411
COc1ccc(CCNC(=[NH2+])NC[C@H](c2ccc(C)cc2)[NH+](C)C)cc1,C66243776_decoy,CXCR4,Decoy,0,-8.66255,-8.38,-2.11,-8.252188041183997
COc1ccccc1[C@@H](CNC(=[NH2+])Nc1ccccc1)[NH+]1CCCCC1,C66244077_decoy,CXCR4,Decoy,0,-9.2891,-7.77,-1.72,-8.873289652201114
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122469_decoy,CXCR4,Decoy,0,-8.18839,-6.99,-1.31,-7.350532431888633
CC1CC[NH+](C[C@H](O)CNC(=O)NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)CC1,C67621226_decoy,CXCR4,Decoy,0,-8.91301,-8.14,-2.15,-7.930420199924769
COC(=O)CNC1=[NH+][C@@](OC)(c2ccc(Cl)cc2)c2ccccc21,C02168140_decoy,CXCR4,Decoy,0,-8.55347,-7.93,-1.15,-9.664110750760798
Cc1ccc(OCC[NH+](C)Cc2nc3sc4c(c3c(=O)[nH]2)CCC4)cc1,C09641127_decoy,CXCR4,Decoy,0,-8.19735,-8.75,-3.75,-3.9208024833172272
Cc1cc(C)c(S(=O)(=O)NC[C@@H](c2cccn2C)[NH+](C)C)c(C)c1,C11897885_decoy,CXCR4,Decoy,0,-7.12309,-8.16,-1.25,-9.003698886789806
C#CCN(C)C(=O)C[C@@H]1CC[NH2+]C[C@@H]1Cc1cc(-c2ccc(F)cc2)on1,C12481870_decoy,CXCR4,Decoy,0,-8.64375,-7.15,-3.16,-7.459133076536585
Cc1cccc(-n2cc(C[NH2+]Cc3cnn(C)c3)c(-c3cccc(F)c3)n2)c1,C12709546_decoy,CXCR4,Decoy,0,-8.06647,-8.76,-1.9,-7.592344428463026
Cc1nn([C@H](C)CC(=O)NC2(C[NH+]3CCCC3)CCCCC2)c(C)c1C,C19556201_decoy,CXCR4,Decoy,0,-8.42491,-7.24,-1.55,-3.690986664397982
CCOC(=O)c1ccc2[nH]c(C)c(C[NH+]3CCCC[C@@H]3CC)c(=O)c2c1,C19792068_decoy,CXCR4,Decoy,0,-8.02237,-8.24,-3.19,-7.520696825195565
CC(C)C[NH+]1CCN(Cc2cc3c(cc2Cl)OCO3)C[C@@H]1CCO,C20537954_decoy,CXCR4,Decoy,0,-9.84959,-7.18,-3.24,-3.969379019253405
CCc1nnc(NC(=O)c2ccc([C@@H]3CCC[NH+]3CC(C)C)s2)s1,C20778012_decoy,CXCR4,Decoy,0,-10.4494,-7.24,-2.48,-4.256101638741839
COc1ccc2cc(-c3n[nH]cc3C[NH+](C)Cc3ccncc3C)ccc2c1,C23191741_decoy,CXCR4,Decoy,0,-7.4257,-9.81,-3.13,-8.44268600409785
CC[C@H](CNC(=O)c1c(C)nn(-c2ccc(F)cc2)c1Cl)[NH+]1CCCC1,C24800816_decoy,CXCR4,Decoy,0,-8.95751,-9.1,-1.13,-7.946533389967898
COc1ccc(/C=C/C(=O)NCc2cc[nH+]c(N3CCCC3)c2)cc1F,C30012536_decoy,CXCR4,Decoy,0,-7.79389,-8.19,-2.76,-7.002274473055717
CC(C)[NH+](CCNC(=O)c1cc2c(nc3sccn32)s1)C(C)C,C32244615_decoy,CXCR4,Decoy,0,-9.0834,-6.36,-2.84,-7.23208618870141
O[C@@H](CCC[NH+]1CCN(c2nccc3occc23)CC1)c1ccc(F)cc1,C34186879_decoy,CXCR4,Decoy,0,-9.36786,-9.1,-1.26,-7.532437135035749
CC[NH+](CC)Cc1nc2scc(-c3ccccc3OC)c2c(=O)[nH]1,C36204170_decoy,CXCR4,Decoy,0,-8.02502,-5.75,-0.95,-6.629422994981034
CCC[NH2+][C@@H](C(=O)OC)c1cc(Br)c2c(c1)OCCO2,C37513325_decoy,CXCR4,Decoy,0,-8.11583,-6.82,-1.65,-11.662708919888985
C[NH+](CCOc1ccccc1)Cc1nc2cc(Cl)ccc2c(=O)[nH]1,C13598289_decoy,CXCR4,Decoy,0,-7.93339,-8.97,-0.76,-9.371949629922652
Cc1ccc([C@H](CNS(=O)(=O)c2ccc(Cl)nc2)[NH+](C)C)cc1,C36193050_decoy,CXCR4,Decoy,0,-8.84142,-7.91,-2.04,-11.073563522248948
CC1CC[NH+]([C@H](CNS(=O)(=O)c2cccs2)c2ccco2)CC1,C36090491_decoy,CXCR4,Decoy,0,-7.95838,-7.65,-1.96,-3.787038820495917
COc1ccc(Cl)cc1S(=O)(=O)NCC(C)(C)[NH+]1CCCC1,C36091303_decoy,CXCR4,Decoy,0,-8.72919,-7.23,-2.8,-8.702375572730892
COC(=O)[C@H]([NH2+]CC(C)C)c1cc(Br)c2c(c1)OCCO2,C37965997_decoy,CXCR4,Decoy,0,-8.73168,-6.91,-1.05,-11.085730598680923
Cc1nc(Cl)sc1S(=O)(=O)NC[C@@H](C(C)C)[NH+]1CCCC1,C40805659_decoy,CXCR4,Decoy,0,-9.18216,-6.2,-2.2,-3.4206273481424185
C[C@H](CNC(=O)Cc1cc(-c2ccc(Cl)cc2)on1)[NH+]1CCCC1,C41111045_decoy,CXCR4,Decoy,0,-8.41291,-7.85,-0.83,-7.587640938518793
CCc1nc(C)c2c(C)c(C(=O)NCC(C)(C)C[NH+](C)C)sc2n1,C41893743_decoy,CXCR4,Decoy,0,-8.44508,-7.9,-3.18,-9.782223478223845
COC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)CC1,C42567537_decoy,CXCR4,Decoy,0,-8.45567,-7.46,-3.13,-7.401285090093419
Cc1ccc(-c2nc(CC(=O)NC[C@@H](C)[NH+]3CCCC[C@@H]3C)cs2)o1,C43085968_decoy,CXCR4,Decoy,0,-8.39043,-7.77,-3.61,-7.166079888961953
COc1cccc(N2CC[NH+]([C@H](C(=O)NC(C)(C)C)C(C)C)CC2)c1,C45911482_decoy,CXCR4,Decoy,0,-8.1219,-6.97,-1.17,-7.948330169509601
O=S(=O)(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1c(F)cccc1F,C47031352_decoy,CXCR4,Decoy,0,-8.04554,-8.0,-1.55,-7.633471535505956
COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)[NH+](C)Cc1cscn1,C48302824_decoy,CXCR4,Decoy,0,-9.05791,-6.28,-0.66,-7.3491507201939426
COC(=O)c1ccc(NC(=O)C[NH+]2CCC[C@@H]2c2ccsc2)cc1,C48366988_decoy,CXCR4,Decoy,0,-7.8073,-7.76,-3.97,-7.54344948247953
COc1ccc2sc(C(=O)NCCCn3cc[nH+]c3)c(Cl)c2c1,C49755067_decoy,CXCR4,Decoy,0,-8.42559,-7.33,-2.08,-10.000224402464882
CCCNC(=O)[C@H]1CCCN(Cc2coc(-c3ccc(C)cc3)[nH+]2)C1,C50995857_decoy,CXCR4,Decoy,0,-8.87726,-7.95,-1.79,-8.604495503635935
CC[C@@H](C(=O)Nc1cc(C)on1)[NH+](C)Cc1cc(Br)cs1,C52847922_decoy,CXCR4,Decoy,0,-9.71259,-6.09,-1.33,-8.913957274013766
CCOC(=O)C1CC[NH+]([C@H](C)C(=O)Nc2ccc(F)c(F)c2F)CC1,C07386399_decoy,CXCR4,Decoy,0,-8.36557,-7.59,-1.3,-10.493626248565295
CCCC[NH+](C)Cc1c(O)cc(C)c2c1O/C(=C\c1cccnc1)C2=O,C41584013_decoy,CXCR4,Decoy,0,-8.33531,-8.05,-2.69,-4.008737658402071
C[C@H]1[C@@H](NC(=O)COC(=O)CC2=c3ccccc3=[NH+]C2)CCC[C@@H]1C,C63778329_decoy,CXCR4,Decoy,0,-7.35372,-8.79,-0.98,-9.34219510571604
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)CC2=c3ccccc3=[NH+]C2)cc1,C63843937_decoy,CXCR4,Decoy,0,-8.13792,-8.4,-2.48,-8.60388489928653
Cc1cccc(C)c1OCCNC(=O)C[C@@H]1C=c2ccccc2=[NH+]C1=O,C64098349_decoy,CXCR4,Decoy,0,-7.54376,-8.25,-1.4,-7.813995209127148
Cc1ccc([C@@H](CNC(=O)N2CCN(CC(F)F)CC2)[NH+](C)C)cc1,C64228618_decoy,CXCR4,Decoy,0,-7.37348,-7.66,-2.11,-7.505002156938486
COc1c(C[NH2+]C[C@@H]2CCN(c3ccc(Cl)cc3)C2)c(C)nn1C,C58307260_decoy,CXCR4,Decoy,0,-8.64207,-7.92,-1.31,-7.603908010997051
CCCCNC(=O)[C@H]1CC[C@H](C)[NH+](Cc2c(C)nn(C)c2Cl)C1,C66155723_decoy,CXCR4,Decoy,0,-7.82219,-6.12,-1.96,-6.819407808907538
COCCC[NH+](C)[C@@H](C)c1nc2sc3c(c2c(=O)[nH]1)CC[C@@H](C)C3,C66380147_decoy,CXCR4,Decoy,0,-8.44806,-6.6,-1.34,-3.4736328118629283
CC[NH+](CC)C1CCN(C(=O)c2cc(F)ccc2NC(=O)[C@@H]2C[C@H]2C)CC1,C66395098_decoy,CXCR4,Decoy,0,-8.12603,-7.68,-1.21,-7.831514176322493
C=CC[NH+](CC(=O)Nc1c(C)cc(C)cc1Cl)[C@@H]1CCS(=O)(=O)C1,C66561239_decoy,CXCR4,Decoy,0,-8.32794,-6.64,-1.87,-3.624884579379436
CCN(C1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1)S(C)(=O)=O,C66859463_decoy,CXCR4,Decoy,0,-9.4563,-8.26,-1.26,-10.042930865485015
Cc1ccc2[nH+]c(CNc3ccccc3S[C@H](C)CC#N)cc(=O)n2c1,C66860979_decoy,CXCR4,Decoy,0,-8.65783,-6.96,-1.44,-7.51380680176489
CCN(C(=O)C(=O)N[C@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1)c1ccc(F)cc1,C67438115_decoy,CXCR4,Decoy,0,-8.5372,-8.17,-1.85,-8.70570867012154
CNC(=O)c1ccc(C[NH+](C)Cc2ncc(-c3ccc(F)cc3)o2)cc1,C12332150_decoy,CXCR4,Decoy,0,-6.75674,-8.05,-1.57,-6.601955927400533
COc1cc(C[NH2+][C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc2c1OCO2,C67505829_decoy,CXCR4,Decoy,0,-8.17511,-7.86,-0.89,-7.355752091075848
CCC1CC[NH+](C[C@@]2(O)CCCN(Cc3cc(OC)ccc3F)C2=O)CC1,C67563182_decoy,CXCR4,Decoy,0,-8.30758,-8.68,-1.06,-8.116526736404499
COc1ccc(C[NH2+]C2CCOCC2)cc1OC[C@@H](O)C[NH+](C)C(C)C,C12470136_decoy,CXCR4,Decoy,0,-9.01828,-7.44,-1.54,-10.038205558969436
CC[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(Br)cc2C)o1,C13735326_decoy,CXCR4,Decoy,0,-8.89784,-7.15,-1.15,-11.691702025731438
CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1cc(Br)ccc1O,C19905823_decoy,CXCR4,Decoy,0,-8.16089,-7.0,-2.05,-9.262089308210015
COc1cc(NCCCCC[NH2+]C(C)C)c2[nH+]ccc(C)c2c1,C01600859_decoy,CXCR4,Decoy,0,-8.55043,-7.17,-1.88,-7.894861891009423
CCCCCCOc1ccc([C@@H](C[NH3+])N2CC[NH+](C)CC2)cc1,C32072977_decoy,CXCR4,Decoy,0,-8.17394,-6.91,-3.36,-7.027592767189495
CCCCCOc1cc([C@@H](C[NH3+])[NH+]2CCCCC2)ccc1OC,C32077490_decoy,CXCR4,Decoy,0,-8.10613,-6.91,-2.8,-8.19924415782548
CCCCCOc1cc(OC)ccc1[C@@H](C[NH3+])[NH+]1CCCCC1,C32077492_decoy,CXCR4,Decoy,0,-7.79952,-6.61,-1.72,-7.709566351228281
CCCCCCOc1cc(OC)ccc1[C@H](C[NH3+])[NH+]1CCCC1,C32077499_decoy,CXCR4,Decoy,0,-7.92023,-6.51,-1.72,-8.039954071761453
CC[NH+]([C@@H](C[NH3+])c1cc(Br)ccc1OC)C(C)(C)C,C32089149_decoy,CXCR4,Decoy,0,-7.80611,-6.39,-1.7,-8.337940933091236
CCCCOc1cc([C@@H](C[NH3+])[NH+](CC)C(C)(C)C)ccc1OC,C33461771_decoy,CXCR4,Decoy,0,-7.93511,-6.41,-2.75,-7.870088246929656
CCC[NH2+][C@@H](Cc1[nH]cc[nH+]1)c1ccc(Br)cc1C,C36830291_decoy,CXCR4,Decoy,0,-7.49173,-6.1,-0.72,-7.338475865748189
CC[NH+](CC(C)C)[C@@H](C[NH3+])c1cc(Br)ccc1OC,C37111219_decoy,CXCR4,Decoy,0,-8.25869,-6.82,-1.54,-10.0767648067856
CC[NH+](CC)C[C@@H](O)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl,C37856132_decoy,CXCR4,Decoy,0,-8.12279,-6.23,-3.14,-7.750774870416585
CC(C)[NH+](CCNS(=O)(=O)CC[C@H]1CCCC[NH2+]1)C(C)C,C37661790_decoy,CXCR4,Decoy,0,-9.57909,-6.56,-3.39,-8.707635246980056
O[C@H](C[NH2+]C[C@@H]1CC[NH+](C2CC2)C1)c1cccc(Br)c1,C37904532_decoy,CXCR4,Decoy,0,-8.52558,-7.32,-1.3,-9.861296532332132
CC[C@H](C)CC(=O)N1C[C@H](C(=O)NCC[NH+](CC)CC)C2(CC[NH2+]CC2)C1,C39627092_decoy,CXCR4,Decoy,0,-9.14674,-7.29,-4.29,-8.568188397578666
CCC(CC)C(=O)N1C[C@H](C(=O)NCCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39678968_decoy,CXCR4,Decoy,0,-8.35045,-5.8,-1.52,-6.599058581570764
C[NH+](C)[C@@H](C[NH2+]C[C@@H](O)COCc1cccs1)c1ccccc1,C22876264_decoy,CXCR4,Decoy,0,-9.20044,-7.74,-1.38,-9.284988184792262
CC[NH+](CC)CCOc1c(Br)cccc1CC[NH3+],C42412642_decoy,CXCR4,Decoy,0,-7.84113,-6.43,-1.52,-11.504576097013675
CCCCC[NH+](C(C)C)[C@H](C[NH3+])c1ccc(Br)o1,C42555095_decoy,CXCR4,Decoy,0,-8.39337,-5.67,-0.43,-7.292014947714553
COc1ccc(Br)cc1[C@H](C[NH3+])[NH+](C)[C@H](C)CC(C)C,C42577562_decoy,CXCR4,Decoy,0,-7.93609,-6.95,-2.37,-9.322859843958032
CC(C)CN(CC[NH+](C)C)[C@H](C[NH3+])c1ccc(Br)cc1,C42744956_decoy,CXCR4,Decoy,0,-8.60501,-6.47,-1.25,-9.293804138186127
CC[C@H]([NH3+])[C@H](c1ccccc1Br)[NH+](CC)CCOC,C43092914_decoy,CXCR4,Decoy,0,-7.14688,-6.47,-2.19,-9.11659232642378
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[NH+](CC2CC2)CC1,C43253456_decoy,CXCR4,Decoy,0,-9.63546,-7.11,-1.18,-8.03438069444397
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CCC(C[NH+](C)C)CC1,C43253651_decoy,CXCR4,Decoy,0,-8.5893,-6.63,-2.92,-7.734618273293525
CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1cc(Br)ccc1O,C44517532_decoy,CXCR4,Decoy,0,-8.47629,-6.9,-2.72,-8.09882639136191
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)cc1)[NH+](C)Cc1csc(C)n1,C44595101_decoy,CXCR4,Decoy,0,-9.32194,-6.89,-1.97,-8.521158638935454
CC[NH+](CC)[C@H](CNC(=O)N[C@@H](C)Cn1cc[nH+]c1)CC(C)C,C45538344_decoy,CXCR4,Decoy,0,-7.87816,-6.57,-3.53,-3.804238663457968
CC[NH+](CC)[C@@H](CNC(=O)N[C@@H](C)Cn1cc[nH+]c1)CC(C)C,C45538347_decoy,CXCR4,Decoy,0,-8.08274,-7.11,-1.74,-8.77318483605598
C[NH+](CCCOc1cccc(C[NH3+])c1)Cc1ccc(Cl)s1,C48971581_decoy,CXCR4,Decoy,0,-8.50536,-6.91,-3.84,-7.780791923399983
C[NH+](CCCOc1ccccc1C[NH3+])Cc1ccc(Cl)s1,C48971585_decoy,CXCR4,Decoy,0,-7.57499,-6.91,-3.09,-7.353113392838875
CCC[NH+](CC1CC1)[C@H](C[NH3+])c1ccc(OC)c(Br)c1,C48991448_decoy,CXCR4,Decoy,0,-9.16834,-6.34,-1.28,-10.242841170573149
Cc1ccccc1Oc1ccc([C@H](O)C[NH2+]CC[NH+](C)C)cc1,C32232931_decoy,CXCR4,Decoy,0,-7.88816,-5.85,-3.24,-5.899194047042474
COc1cccc(C[NH+](C)[C@@H](c2ccc(Cl)s2)[C@H](C)[NH3+])c1,C43253228_decoy,CXCR4,Decoy,0,-8.13243,-7.54,-1.34,-7.503533010678916
COc1ccccc1C[NH+](C)[C@@H](c1ccc(Cl)s1)[C@H](C)[NH3+],C43253236_decoy,CXCR4,Decoy,0,-7.70257,-7.32,-1.4,-8.202859179912542
CC(C)[NH+](C)CC[NH2+]C[C@H](O)COCc1ccc(Cl)cc1,C54112747_decoy,CXCR4,Decoy,0,-7.89107,-6.16,-1.96,-6.714874974906869
CC[C@@H]([NH2+]CC[NH+](C(C)C)C(C)C)c1cc(Br)ccc1O,C21516342_decoy,CXCR4,Decoy,0,-8.52153,-6.74,-3.62,-8.471456493764649
CC(C)[NH+](CC[NH2+]Cc1cc(Cl)cc(Cl)c1O)C(C)C,C21804685_decoy,CXCR4,Decoy,0,-9.08086,-7.24,-1.95,-9.055587614473964
CC[C@H]([NH2+]C[C@H]1CCC[NH+]1CC)c1cc(Br)ccc1O,C19960316_decoy,CXCR4,Decoy,0,-7.96244,-6.66,-1.2,-9.745479005365258
CCC[NH+]1CCN([C@@H](c2ccc(Cl)s2)[C@H]([NH3+])CC)CC1,C43251922_decoy,CXCR4,Decoy,0,-9.36194,-6.48,-0.64,-9.946214851396311
CC[C@H]([NH3+])[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C[NH+](C)C,C61642014_decoy,CXCR4,Decoy,0,-8.83743,-5.93,-3.34,-3.386187871786639
CC(C)[NH+](C)CCCC[NH2+]Cc1ccc(O)c(Br)c1,C62702811_decoy,CXCR4,Decoy,0,-8.54687,-6.32,-1.89,-6.778043056830654
CC[NH+](CC)[C@@H]1CCN([C@@H](c2ccc(Cl)s2)[C@@H](C)[NH3+])C1,C62977183_decoy,CXCR4,Decoy,0,-9.36307,-6.45,-1.92,-8.109736054414984
C[C@@H](CCCC(C)(C)O)CC1=Nc2cc3c(cc2=[NH+]1)NC(=O)[NH+]=3,C63845451_decoy,CXCR4,Decoy,0,-7.13411,-7.49,-1.63,-3.5113149981743788
CCC1=C(C[NH+](CC)CC)C[C@@H](C(=O)NCCc2c[nH]c[nH+]2)O1,C63846174_decoy,CXCR4,Decoy,0,-8.95307,-6.44,-0.66,-8.095891804401042
CC[C@@H](C)[C@H](NC(=O)Cc1cccc(F)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305887_decoy,CXCR4,Decoy,0,-7.86657,-8.99,-2.53,-4.014997746159146
CCN/C(NC[C@@H](c1ccc(OC)cc1)[NH+]1CCCC1)=[NH+]\CC,C66242515_decoy,CXCR4,Decoy,0,-8.98697,-6.9,-1.13,-10.03572891836148
Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66390687_decoy,CXCR4,Decoy,0,-7.65004,-8.05,-1.73,-3.756857539978376
Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc(N3CC[NH+](C)CC3)c(F)c2)c1,C66390712_decoy,CXCR4,Decoy,0,-7.71921,-8.01,-2.76,-3.9600720016173776
C=CCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(C[NH+](C)CCCC)CC1,C66960694_decoy,CXCR4,Decoy,0,-8.35586,-6.47,-0.94,-7.850198763215134
CC(C)c1ccc(OCC[C@H](C[NH3+])N2CC[NH+](C)CC2)cc1,C19665543_decoy,CXCR4,Decoy,0,-7.71093,-7.78,-2.09,-7.840285094829286
CCOc1cc([C@H](C[NH3+])[NH+](C)C(C)C)ccc1OC(F)F,C21516896_decoy,CXCR4,Decoy,0,-7.75323,-7.21,-2.78,-9.244469822578829
COc1ccc2cc([C@@H](C[NH3+])[NH+]3CCC(C)CC3)ccc2c1,C22052211_decoy,CXCR4,Decoy,0,-8.09219,-7.22,-1.37,-6.360435305932638
CC(C)([NH3+])c1cn(CC2CC[NH+]([C@H]3CCSC3)CC2)nn1,C23145363_decoy,CXCR4,Decoy,0,-8.82533,-6.48,-0.68,-7.00964060097939
CCCOc1cc(OC)ccc1[C@@H](C[NH3+])[NH+]1C[C@H](C)C[C@@H](C)C1,C32077456_decoy,CXCR4,Decoy,0,-7.76082,-7.36,-1.78,-8.250890060143343
CCCCOc1cc([C@@H](C[NH3+])[NH+]2CCC(C)CC2)ccc1OC,C32077472_decoy,CXCR4,Decoy,0,-8.25887,-7.27,-2.98,-8.306081395717532
CCCCOc1c(Cl)cc([C@@H](C[NH3+])[NH+]2CCCC2)cc1OC,C32087752_decoy,CXCR4,Decoy,0,-8.61423,-6.45,-4.13,-8.068326628535054
CCCOc1c(Cl)cc([C@H](C[NH3+])[NH+]2CCCCC2)cc1OC,C33463563_decoy,CXCR4,Decoy,0,-8.8881,-6.65,-1.55,-8.127070120109398
CCCC[C@@H](CC)C(=O)N1CCC[NH+](C[C@@H](C)C[NH3+])CC1,C37038726_decoy,CXCR4,Decoy,0,-8.41806,-6.56,-2.44,-8.581325463152849
C[NH+](C1CCCC1)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37084147_decoy,CXCR4,Decoy,0,-9.03151,-7.26,-2.71,-9.26411581581169
CC[C@@H](C)[NH+](C)[C@@H](C[NH3+])c1ccc(OC)c(OC(F)F)c1,C37109682_decoy,CXCR4,Decoy,0,-7.2869,-7.29,-2.73,-9.599714057397168
CC[C@H](C)[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37109795_decoy,CXCR4,Decoy,0,-8.95543,-7.27,-2.89,-4.177585066491005
C[C@@H](C[NH3+])C[NH+]1CCN(c2ncc(Cl)cc2Cl)CC1,C37674182_decoy,CXCR4,Decoy,0,-8.8853,-7.12,-0.6,-8.17442592428995
O[C@H](C[NH2+]C[C@@H]1CC[NH+](C2CC2)C1)c1cc(Cl)ccc1Cl,C37904562_decoy,CXCR4,Decoy,0,-9.16924,-6.49,-1.16,-8.896855726359584
CC[C@@H](C)[NH+](CC)[C@@H](C[NH3+])c1ccc(OC)c(Br)c1,C38052116_decoy,CXCR4,Decoy,0,-8.62115,-6.73,-0.75,-12.564959469266066
CC1(C)C[C@H]2C[C@](C)(C[NH+]2CCCC(=O)N2CCC([NH3+])CC2)C1,C33461458_decoy,CXCR4,Decoy,0,-8.57998,-6.66,-0.88,-9.12894853755326
CCCOc1c(C[NH2+]CC2CC[NH2+]CC2)cc(Cl)cc1OC,C40719437_decoy,CXCR4,Decoy,0,-8.56965,-6.4,-1.96,-8.739845264539118
CCC[NH2+]C[C@H](O)C[NH+](C)Cc1cc(Br)cs1,C42399023_decoy,CXCR4,Decoy,0,-8.83167,-5.54,-2.02,-8.360937403320527
C[C@H]1CC[C@@H](C[NH3+])C[NH+]1CCOc1ccc(Br)cc1,C42427540_decoy,CXCR4,Decoy,0,-8.41926,-6.42,-1.74,-7.016116626871735
COc1ccc([C@H](C[NH3+])[NH+](CC(C)C)C(C)C)cc1Br,C42579446_decoy,CXCR4,Decoy,0,-9.13331,-6.23,-1.56,-11.460209743445988
CC[C@@H]([NH3+])[C@@H](c1ccc(Cl)cc1)[NH+](C)CC(=O)N(C)C,C42944980_decoy,CXCR4,Decoy,0,-7.81118,-6.01,-2.34,-8.202077685525772
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)cc1)[NH+](C)Cc1cc(C)on1,C42945396_decoy,CXCR4,Decoy,0,-8.63035,-7.63,-0.76,-10.264382069012273
CC[C@H]([NH3+])[C@H](c1ccc(Cl)cc1)[NH+](C)Cc1ccoc1C,C42945815_decoy,CXCR4,Decoy,0,-8.18383,-7.75,-0.97,-9.8234098877024
CC[C@@H]([NH3+])[C@@H](c1cccc(Br)c1)[NH+](C)CCOC,C43021244_decoy,CXCR4,Decoy,0,-8.52001,-7.07,-1.7,-9.874880912998622
CC[C@@H]([NH3+])[C@@H](c1ccc(C)s1)N1CC[NH+](C(C)(C)C)CC1,C43241877_decoy,CXCR4,Decoy,0,-8.57328,-7.32,-4.16,-8.634197184383087
CC[C@H]([NH3+])[C@@H](c1ccc(C)s1)[NH+](CC)Cc1ccncc1,C43242315_decoy,CXCR4,Decoy,0,-7.8269,-7.28,-1.08,-9.429566267995364
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[NH+](C2CC2)CC1,C43253444_decoy,CXCR4,Decoy,0,-8.85861,-6.37,-0.33,-8.179238778015137
Cc1ccc([C@@H]([C@H](C)[NH3+])[NH+](C)Cc2ccccc2Br)o1,C43364666_decoy,CXCR4,Decoy,0,-7.9126,-7.32,-0.74,-8.234715576348188
CC[C@H]([NH3+])[C@@H](c1ccc(C)o1)[NH+](Cc1ccsc1)C1CC1,C43364780_decoy,CXCR4,Decoy,0,-8.76963,-6.22,-2.28,-8.16640977019601
CC[C@H]([NH3+])[C@H](c1ccc(C)o1)[NH+](Cc1cccs1)C(C)C,C43364932_decoy,CXCR4,Decoy,0,-8.39499,-6.06,-1.48,-8.023515497539943
CC[C@H]([NH3+])[C@@H](c1ccc(F)cc1)[NH+](C)Cc1csc(C)n1,C44595093_decoy,CXCR4,Decoy,0,-8.07875,-6.58,-1.68,-8.493591559485145
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)Cc1csc(C)n1,C44595259_decoy,CXCR4,Decoy,0,-11.1394,-6.55,-2.71,-10.99700731961672
Oc1c(Cl)cc(Cl)cc1C[NH2+]CCCCn1cc[nH+]c1,C45094642_decoy,CXCR4,Decoy,0,-8.82919,-7.37,-1.55,-7.936351928277202
Cc1cccc(C[NH+](C)[C@H](C[NH3+])c2ccc(Br)o2)c1,C48870750_decoy,CXCR4,Decoy,0,-8.20783,-7.29,-4.2,-4.066255701807456
C[NH+](Cc1ccccc1Cl)[C@@H](C[NH3+])c1ccc(Br)o1,C48878633_decoy,CXCR4,Decoy,0,-9.32086,-5.7,-2.22,-7.1734909034307135
CC(C)CC[NH+](C)[C@H](C[NH3+])c1cc(Cl)c2c(c1)OCCO2,C48923072_decoy,CXCR4,Decoy,0,-9.08211,-7.01,-1.91,-8.537035055741825
CC(C)(C)[NH+]1CCN([C@H](C[NH3+])c2ccc(Cl)c(Cl)c2)CC1,C48926975_decoy,CXCR4,Decoy,0,-8.57366,-7.68,-1.54,-7.110509049373803
[NH3+]C[C@H](c1ccc(Cl)cc1Cl)N1CC[NH+](C2CC2)CC1,C48991532_decoy,CXCR4,Decoy,0,-9.45848,-6.98,-0.84,-7.67848184538771
CC[C@@H]([NH3+])Cc1cc(Cl)ccc1OCCn1cc[nH+]c1C,C49331401_decoy,CXCR4,Decoy,0,-7.80665,-6.91,-0.5,-8.963072142440364
C[C@H](CC[NH+](C)C)[NH2+]C[C@@H](O)c1ccc(C(F)(F)F)cc1,C49557302_decoy,CXCR4,Decoy,0,-6.86672,-7.61,-2.24,-7.485568831199751
O=S(=O)(C[C@H]1CCCC[NH2+]1)N[C@@H]1CC[NH+]2CCCC[C@H]12,C49631561_decoy,CXCR4,Decoy,0,-8.71822,-7.45,-2.05,-3.31515310816161
COc1ccccc1C[NH+](C)[C@H](C[NH3+])c1cc(C)sc1C,C49687421_decoy,CXCR4,Decoy,0,-7.77245,-6.59,-3.31,-7.666060963450008
C[C@H](c1cccs1)[NH+](C)CCCOc1ccccc1C[NH3+],C49726228_decoy,CXCR4,Decoy,0,-8.31938,-7.37,-1.85,-3.8123848221211456
CC(C)[NH+](CC[NH2+]C[C@H](O)c1ccc(Cl)cc1)C(C)C,C37859473_decoy,CXCR4,Decoy,0,-8.00761,-5.93,-1.97,-6.675123082276124
CC[C@H](C)[NH+]1CCN([C@@H](C[NH3+])c2ccc(Cl)c(F)c2)CC1,C55064446_decoy,CXCR4,Decoy,0,-8.81446,-6.9,-2.02,-8.199029348956657
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2ccc(Br)cc2)CC1,C55063881_decoy,CXCR4,Decoy,0,-8.61282,-6.73,-1.93,-4.11425297849379
CC[C@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2CCN(CC(F)(F)F)CC2)C1,C61940920_decoy,CXCR4,Decoy,0,-7.58665,-4.67,-0.34,-4.6991065781374735
CC[C@@H]([NH3+])[C@@H](N1CCC(C[NH+]2CCCC2)CC1)C(F)(F)F,C62038033_decoy,CXCR4,Decoy,0,-6.7292,-6.16,-1.59,-6.552979141155924
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[C@H]([NH+](C)C)C1,C62963991_decoy,CXCR4,Decoy,0,-8.57694,-6.68,-1.82,-9.719435605456988
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)CC1,C67122288_decoy,CXCR4,Decoy,0,-8.31677,-7.41,-2.54,-3.7252736347645934
C[NH+]1CCN([C@@H](CC[NH3+])COc2ccc(Cl)cc2)CC1,C19663443_decoy,CXCR4,Decoy,0,-7.42539,-6.85,-2.1,-7.745973682469327
Cc1cc(C)c(OC[C@@H](CC[NH3+])N2CC[NH+](C)CC2)cc1C,C19663565_decoy,CXCR4,Decoy,0,-8.29414,-7.17,-1.06,-8.335722388218773
CC(C)c1ccc(OCC[C@@H](C[NH3+])N2CC[NH+](C)CC2)cc1,C19665540_decoy,CXCR4,Decoy,0,-7.78388,-7.93,-2.22,-7.366030329623013
[NH3+]C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCCCCCC1,C20265250_decoy,CXCR4,Decoy,0,-6.50763,-6.87,-2.77,-6.568083240038854
Cc1cc(OC[C@H](C[NH3+])N2CC[NH+](C)CC2)ccc1Cl,C20401437_decoy,CXCR4,Decoy,0,-7.98984,-6.55,-0.91,-7.517662060265162
C[NH+]1CCN([C@@H](C[NH3+])c2ccc(OC(F)(F)F)cc2)CC1,C21013524_decoy,CXCR4,Decoy,0,-7.22727,-7.58,-1.44,-3.710757251708568
CCCC[NH+](C)[C@@H](C[NH3+])c1cc(Cl)c(OC)c(OC)c1,C32066835_decoy,CXCR4,Decoy,0,-8.18577,-6.65,-1.19,-10.856706593888855
CC[NH+](CC)[C@@H](C[NH3+])c1ccc(OC)c(Br)c1,C32066876_decoy,CXCR4,Decoy,0,-8.04487,-6.3,-3.49,-9.115352683733306
CC[NH+]([C@H](C[NH3+])c1cc(Cl)c(OC)c(OC)c1)C(C)(C)C,C32071344_decoy,CXCR4,Decoy,0,-8.14974,-6.65,-0.86,-8.933464491417634
CC(C)C[NH+](CC(C)C)[C@@H](C[NH3+])c1ccc2c(c1)OCCO2,C32075179_decoy,CXCR4,Decoy,0,-8.2334,-7.21,-1.43,-8.42808396301221
CCCCOc1cc([C@H](C[NH3+])[NH+]2CCCCCC2)ccc1OC,C32077476_decoy,CXCR4,Decoy,0,-8.11906,-7.18,-1.58,-9.52500932262654
CCC(CC)[NH+](C)[C@H](C[NH3+])c1cc(Br)ccc1OC,C36788797_decoy,CXCR4,Decoy,0,-7.75167,-6.38,-1.82,-10.828094343903318
COc1cc(C[NH3+])cc(Br)c1OCC[NH+](C)C,C36814845_decoy,CXCR4,Decoy,0,-8.49575,-6.02,-1.15,-8.040032866107763
CC[NH+](CC)CCOc1ccc(Br)cc1C[C@@H](C)[NH3+],C37725234_decoy,CXCR4,Decoy,0,-7.74183,-6.32,-1.97,-8.718010550768843
CC[NH+](CC)C[C@H](O)C[NH2+][C@@H](C)c1cccc(Br)c1,C38012407_decoy,CXCR4,Decoy,0,-8.38508,-6.71,-2.17,-7.179616151364847
CCC[NH+](CC)[C@@H](C[NH3+])c1ccc(OC)c(Br)c1,C38052102_decoy,CXCR4,Decoy,0,-8.55315,-6.42,-2.11,-9.501233008156536
CCC[NH+](C(C)C)[C@@H](C[NH3+])c1ccccc1OC(F)(F)F,C37095765_decoy,CXCR4,Decoy,0,-6.48566,-7.35,-2.26,-9.181839725349748
CCC[NH+](C(C)C)[C@@H](C[NH3+])c1cc(Cl)c2c(c1)OCO2,C37095867_decoy,CXCR4,Decoy,0,-8.65348,-7.19,-2.93,-4.038373468528847
CC1(C)C[C@H]2C[C@](C)(C[NH+]2[C@@H](C[NH3+])c2cccc([N+](=O)[O-])c2)C1,C32076687_decoy,CXCR4,Decoy,0,-8.01381,-7.56,-2.28,-3.928221236589358
COc1cc(Cl)cc(C[NH2+]CC2CC[NH2+]CC2)c1OC(C)C,C40719560_decoy,CXCR4,Decoy,0,-8.9651,-7.38,-1.37,-9.447122754321652
CC(C)C[NH+](C1CC1)[C@@H](C[NH3+])c1cc(Cl)c2c(c1)OCO2,C42555397_decoy,CXCR4,Decoy,0,-8.74122,-7.1,-2.08,-10.230807650197592
CC(C)C[NH+](C(C)C)[C@@H](C[NH3+])c1cc(Cl)c2c(c1)OCO2,C42579288_decoy,CXCR4,Decoy,0,-8.92537,-7.11,-1.36,-11.531058658515237
CC(C)CN(CC[NH+](C)C)C(=O)c1ccc(C#CC[NH3+])s1,C42797947_decoy,CXCR4,Decoy,0,-8.38552,-6.4,-0.5,-7.548946645591349
CC[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](C)Cc1ccco1,C42953154_decoy,CXCR4,Decoy,0,-8.07409,-5.81,-1.75,-7.373339224608108
COc1ccc([C@H]([C@@H](C)[NH3+])[NH+](C)Cc2csc(Br)c2)cc1,C42961738_decoy,CXCR4,Decoy,0,-8.02931,-5.92,-2.66,-7.03861420286985
CC[C@@H]([NH3+])[C@@H](c1cccc(OC)c1)[NH+](C)Cc1ccsc1,C43026589_decoy,CXCR4,Decoy,0,-9.28134,-7.86,-2.09,-11.32814721618696
CC[C@@H]([NH3+])[C@H](c1cnn(C)c1)[NH+](Cc1ccsc1)C1CC1,C43129027_decoy,CXCR4,Decoy,0,-7.91891,-6.06,-0.52,-7.659678573673985
CC[C@@H]([NH3+])[C@@H](c1sccc1C)N1CC[NH+](C(C)(C)C)CC1,C43248431_decoy,CXCR4,Decoy,0,-8.06626,-6.09,-1.8,-7.244021516851016
CCC[NH+](CC(=O)N(C)C)[C@@H](c1sccc1C)[C@H]([NH3+])CC,C43248724_decoy,CXCR4,Decoy,0,-6.8875,-5.98,-1.61,-7.733056380709787
Cc1ccsc1[C@@H]([C@H](C)[NH3+])N(CC[NH+](C)C)CC(C)C,C43249048_decoy,CXCR4,Decoy,0,-6.70192,-6.42,-0.87,-9.18246522734968
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)n1cc[nH+]c1C,C43287875_decoy,CXCR4,Decoy,0,-7.61579,-6.04,-1.62,-7.154235584700131
CC1CCC(OC[C@H](O)C[NH2+]C[C@H]2CCC[NH+](C)C2)CC1,C44536338_decoy,CXCR4,Decoy,0,-8.57663,-7.03,-1.94,-6.35683702535914
Cc1ccccc1C[NH+](C)[C@@H](C[NH3+])c1ccc(Br)o1,C48872086_decoy,CXCR4,Decoy,0,-8.04404,-7.09,-2.03,-7.72258551183724
COc1ccc([C@@H](C[NH3+])[NH+](C)CCC(C)C)cc1Br,C48923038_decoy,CXCR4,Decoy,0,-9.56874,-6.21,-3.93,-9.129936093115935
C[C@@H](CC[NH+](C)C)[NH2+]C[C@H](O)c1ccc(C(F)(F)F)cc1,C49557299_decoy,CXCR4,Decoy,0,-7.06197,-7.35,-1.77,-7.197736560715503
C[C@@H]1C[C@@H]1c1ccc([C@@H](C[NH3+])[NH+](C)[C@@H](C)c2cccs2)o1,C49726505_decoy,CXCR4,Decoy,0,-8.61471,-6.97,-1.55,-7.941632687937902
COc1ccccc1C[NH+](C)[C@@H](c1cc(Br)cs1)[C@@H](C)[NH3+],C43286510_decoy,CXCR4,Decoy,0,-8.97797,-7.3,-1.57,-11.021724318084964
C[NH+](C)C(C)(C)C[NH2+]C[C@@H](O)c1cccc(Br)c1,C43411401_decoy,CXCR4,Decoy,0,-7.97414,-6.01,-1.85,-7.5635786285102276
O[C@@H](C[NH2+][C@H]1CC[NH+](C2CC2)C1)c1cc(Cl)ccc1Cl,C44721968_decoy,CXCR4,Decoy,0,-8.88192,-7.89,-3.77,-4.049684772165092
C[NH+](Cc1ccoc1)Cc1c(C[NH3+])sc2cccc(F)c12,C52545597_decoy,CXCR4,Decoy,0,-8.02247,-7.44,-1.23,-9.288404350574638
CCC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C[NH+]1CCN(CCO)CC1,C53860259_decoy,CXCR4,Decoy,0,-8.65135,-7.25,-1.21,-9.264166053528877
CC(C)[NH+](CC[NH2+]C[C@H](O)c1ccc(F)cc1F)C(C)C,C37874299_decoy,CXCR4,Decoy,0,-7.98333,-6.98,-1.34,-11.915972268919203
C[NH+](Cc1ccc(Br)cc1)Cc1occc1C[NH3+],C52371773_decoy,CXCR4,Decoy,0,-6.45626,-6.42,-4.22,-6.075094973066489
CC[C@@H]1CC[C@H]([NH3+])[C@H](C[NH+]2CCN(CC(F)(F)F)CC2)C1,C61947658_decoy,CXCR4,Decoy,0,-7.50593,-6.78,-1.85,-6.717408865621166
CC[NH+](CC)C[C@@H]1[C@H]([NH3+])c2cccc(C(C)C)c2OC1(C)C,C62187758_decoy,CXCR4,Decoy,0,-8.05387,-7.56,-1.93,-8.827361212335804
CC[NH+](CC)C[C@H]1[C@@H]([NH3+])c2cccc(C(C)C)c2OC1(C)C,C62187766_decoy,CXCR4,Decoy,0,-8.13095,-7.94,-1.55,-9.860045095358888
C[C@H]([NH3+])[C@@H](c1cccc(Br)c1)N1CC[C@H]([NH+](C)C)C1,C62964081_decoy,CXCR4,Decoy,0,-8.59689,-7.64,-0.19,-9.448003368793875
C[C@H]([NH3+])[C@H](c1ccccc1Br)N1CC[C@H]([NH+](C)C)C1,C62964103_decoy,CXCR4,Decoy,0,-7.88048,-7.59,-3.24,-10.37766076861474
CC[NH+](CC)[C@@H]1CCN([C@@H](C[NH3+])c2ccc(Cl)s2)C1,C62977109_decoy,CXCR4,Decoy,0,-9.1589,-6.17,-0.6,-9.016389478590703
CC1CC[NH+](C[C@@H](O)C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)CC1,C67122291_decoy,CXCR4,Decoy,0,-8.35141,-7.39,-4.28,-3.9470053049078935
CCC(C)(C)C1CCC(C[NH3+])(N2CCC[NH+](C)CC2)CC1,C20217726_decoy,CXCR4,Decoy,0,-8.11564,-7.23,-0.45,-9.19964433849304
CS[C@H]1Nc2sc3c(c2[C@H]([NH+]2CCC(C)CC2)N1)CC[NH+](C)C3,C27531161_decoy,CXCR4,Decoy,0,-8.72867,-7.52,-1.05,-8.058044445385798
CC(C)[C@H](C(=O)N1CCC([NH3+])CC1)[NH+](C)C1CCCCC1,C32056510_decoy,CXCR4,Decoy,0,-7.92548,-6.51,-4.13,-3.36370174844031
C[C@H](C(=O)N1CCC([NH3+])CC1)[NH+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2,C32075458_decoy,CXCR4,Decoy,0,-8.95645,-6.85,-0.57,-6.780085633529828
C[C@@H]1CCC[C@H](C)[NH+]1CC(C)(C)C(=O)N1CCC([NH3+])CC1,C33449044_decoy,CXCR4,Decoy,0,-7.3244,-7.04,-1.61,-7.316845257049305
CCC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H]([NH+](C)C2CCOCC2)C1,C36320544_decoy,CXCR4,Decoy,0,-8.38924,-7.13,-0.33,-9.038104192168287
CCC(C)(C)[C@@H]1CC[C@@H](C[NH3+])[C@H](N2CCC[NH+](C)CC2)C1,C37158659_decoy,CXCR4,Decoy,0,-7.92564,-7.58,0.14,-9.939999191817796
CC[NH+]1CCC([C@@H](C)[NH2+]C2CC(C)(C)NC(C)(C)C2)CC1,C37221213_decoy,CXCR4,Decoy,0,-8.03068,-7.41,-0.42,-7.288459527458857
CCC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H]([NH+]2CCC(OC)CC2)C1,C37265691_decoy,CXCR4,Decoy,0,-9.12425,-7.09,-2.35,-8.606371189106797
C[NH+]1CCN([C@@H](C[NH3+])c2cc(Cl)c3c(c2)OCO3)CC1,C37324509_decoy,CXCR4,Decoy,0,-8.99895,-7.58,-1.57,-11.32293822087829
[NH3+]C[C@H](c1cc(Cl)c2c(c1)OCCO2)[NH+]1CCCCC1,C37324568_decoy,CXCR4,Decoy,0,-9.05209,-7.21,-4.3,-3.5410324327648826
[NH3+]C[C@H](c1cc(Br)c2c(c1)OCO2)[NH+]1CCCCCC1,C37324695_decoy,CXCR4,Decoy,0,-8.40126,-7.81,-0.54,-9.689954916347588
CC[C@H](C)[NH2+]Cc1[nH]c(-c2ccc(Br)cc2)c(C)[nH+]1,C37618030_decoy,CXCR4,Decoy,0,-8.20546,-6.94,-0.66,-7.310645452780121
CC[NH+](CC)CC1CCN(C(=O)C2CCC([NH3+])CC2)CC1,C37826256_decoy,CXCR4,Decoy,0,-8.074,-6.47,-1.18,-7.192699137689894
CC1(C)C[C@H]2C[C@](C)(C[NH+]2CCC(=O)N2CCC([NH3+])CC2)C1,C33453425_decoy,CXCR4,Decoy,0,-8.77902,-6.96,-1.26,-7.460665812623077
[NH3+]CC1([NH+]2CCC[C@H]3CCCC[C@@H]32)CCS(=O)(=O)CC1,C42332364_decoy,CXCR4,Decoy,0,-8.35198,-7.98,-5.15,-3.207685377906326
OC1CC[NH+]([C@@H]2CC[NH+](C34CC5CC(CC(C5)C3)C4)C[C@H]2O)CC1,C14963550_decoy,CXCR4,Decoy,0,-9.87948,-7.54,-2.47,-3.3777105478589595
CC[C@H]([NH3+])[C@@H](c1cccs1)N1CCC(C[NH+](C)C)CC1,C43105946_decoy,CXCR4,Decoy,0,-8.3466,-6.58,-2.12,-8.342615133269655
CC[C@H]([NH3+])[C@@H](c1ccsc1)N1CC[NH+](C(C)(C)C)CC1,C43123329_decoy,CXCR4,Decoy,0,-8.59015,-7.14,-0.81,-7.75770397415468
CC[C@@H]([NH3+])[C@H](c1ccsc1)N1CCC(C[NH+](C)C)CC1,C43123697_decoy,CXCR4,Decoy,0,-8.10595,-6.33,-1.98,-7.419838367249963
Cc1ccc([C@H]([C@@H](C)[NH3+])N2CC[NH+](C(C)(C)C)CC2)s1,C43241863_decoy,CXCR4,Decoy,0,-8.31426,-6.35,-0.96,-7.619233602884384
Cc1ccc([C@H]([C@H](C)[NH3+])N2CC[NH+](C(C)(C)C)CC2)s1,C43241870_decoy,CXCR4,Decoy,0,-8.7535,-7.3,-3.87,-4.324724999318714
Cc1ccsc1[C@H]([C@@H](C)[NH3+])N1CC[NH+](C(C)(C)C)CC1,C43248427_decoy,CXCR4,Decoy,0,-7.36208,-5.1,-0.99,-6.239603761473271
CC[C@H]([NH3+])[C@@H](c1sccc1C)[NH+](C)Cc1cscn1,C43249078_decoy,CXCR4,Decoy,0,-7.63354,-6.88,-1.77,-7.857570029525352
CC[C@@H]([NH3+])[C@@H](c1ccsc1)[NH+](C)Cc1csc(C)n1,C44595206_decoy,CXCR4,Decoy,0,-7.70496,-6.67,-1.38,-7.570718466766368
CCC[C@@H]1CC[C@@H](C[NH3+])[C@H]([NH+]2CCN(C(C)(C)C)CC2)C1,C48926543_decoy,CXCR4,Decoy,0,-8.84031,-6.7,-2.01,-7.030444578115434
CC[C@H](C)[NH+]1CCN([C@H](c2sccc2C)[C@@H](C)[NH3+])CC1,C55063811_decoy,CXCR4,Decoy,0,-8.18729,-6.35,-1.07,-7.471189516681925
CC[C@@H]([NH3+])[C@@H](c1cccs1)N1CC[NH+]([C@@H](C)CC)CC1,C55064035_decoy,CXCR4,Decoy,0,-8.26247,-6.44,-1.98,-10.401119441937318
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2ccc(F)c(F)c2)CC1,C55064828_decoy,CXCR4,Decoy,0,-8.63986,-6.66,-3.09,-8.891178237659867
CCCC1CCC(C[NH3+])(N2CC[NH+]([C@@H](C)CC)CC2)CC1,C55064830_decoy,CXCR4,Decoy,0,-8.19407,-6.18,-0.55,-7.246698065253093
CCC[C@@H]1CC[C@@H]([NH3+])[C@H](CN2CC[NH+](CC(C)C)CC2)C1,C55081944_decoy,CXCR4,Decoy,0,-9.64794,-7.02,-2.32,-8.753921781239116
CC(C)(C)[NH+]1CCN(C(=O)[C@H]2CCC[C@@H](CC[NH3+])C2)CC1,C55163079_decoy,CXCR4,Decoy,0,-7.79115,-7.8,-1.53,-7.028783354123602
C[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)N1CCC[NH+](C)CC1,C42952597_decoy,CXCR4,Decoy,0,-8.00972,-6.98,-1.45,-8.576753791221941
Cc1ccsc1[C@@H]([C@H](C)[NH3+])N1CCC(C[NH+](C)C)CC1,C43248664_decoy,CXCR4,Decoy,0,-7.77327,-6.3,-2.1,-4.221289949203388
C[C@H]([NH3+])[C@H](c1cc(Br)cs1)N1CCC[NH+](C)CC1,C43284985_decoy,CXCR4,Decoy,0,-8.64081,-6.89,-0.83,-7.73259947773084
CC[C@@H](C)[NH+]1CCN([C@@H](C[NH3+])c2ccc(Cl)cc2)CC1,C55064005_decoy,CXCR4,Decoy,0,-8.11279,-6.29,-0.95,-6.674433290121085
CC(C)[C@H]1CC[C@@H]([NH3+])[C@H](N2CCN(CC[NH+](C)C)CC2)C1,C61643804_decoy,CXCR4,Decoy,0,-8.1933,-6.97,-1.52,-3.505067347626948
CC[C@@H](C)[NH+]1CCN(c2ccc([C@@H](C)[NH3+])cc2Cl)CC1,C61698213_decoy,CXCR4,Decoy,0,-8.73316,-7.19,-0.59,-7.615694860043096
C[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CCn2cc[nH+]c2C1,C62246379_decoy,CXCR4,Decoy,0,-8.77409,-6.69,-1.3,-8.151103789020299
CCC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H](N2CC[C@H]([NH+](C)C)C2)C1,C62964396_decoy,CXCR4,Decoy,0,-8.52777,-6.74,-0.67,-9.299241039698694
CC[NH+](CC)[C@H]1CCN(C2(C[NH3+])CCC(C(C)C)CC2)C1,C62978230_decoy,CXCR4,Decoy,0,-8.12932,-6.88,-0.7,-7.373189276235087
CC[NH+](CC)[C@H]1CCN([C@@H](C[NH3+])c2ccc(F)cc2F)C1,C62978282_decoy,CXCR4,Decoy,0,-7.88,-6.61,-0.87,-6.893129753724843
Cc1cc([C@H](C[NH3+])N2CC[C@H]([NH+]3CCCCC3)C2)c(C)s1,C62978609_decoy,CXCR4,Decoy,0,-7.96455,-6.68,-2.52,-6.877887414893894
[NH3+]CC1([NH+]2CC[C@@H](N3CCOCC3)C2)CCCCCCC1,C62978749_decoy,CXCR4,Decoy,0,-7.88262,-7.46,-0.58,-9.591466912404286
CC[NH+](CC)[C@H]1CCN(C(=O)CCC2CCC([NH3+])CC2)C1,C62985477_decoy,CXCR4,Decoy,0,-8.27085,-6.95,-2.17,-7.008332927437703
Cc1ccc2c(c1)=[NH+][C@H](C1=C(N)N(c3ccccc3C)CC1=O)[NH+]=2,C63515076_decoy,CXCR4,Decoy,0,-7.43776,-10.28,-2.39,-6.822796691382442
Cc1ccc(N2CC(=O)C([C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)cc1,C63515077_decoy,CXCR4,Decoy,0,-7.18154,-9.94,-1.36,-7.07325557939896
CC1=c2cccc(C)c2=[NH+][C@@H]1CN1CC[C@@H]([NH+]2CCC(O)CC2)[C@H](O)C1,C64103062_decoy,CXCR4,Decoy,0,-10.2264,-8.88,-1.15,-9.00210724183701
Nc1ccccc1-c1nc(-c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)cs1,C64175218_decoy,CXCR4,Decoy,0,-8.19118,-8.81,-2.34,-3.411213626983167
CC1(C)CC(NC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)CC(C)(C)[NH2+]1,C66173777_decoy,CXCR4,Decoy,0,-8.23395,-6.8,-1.06,-6.653476296302287
CCc1[nH]c(CN2CC[NH+](C3CCCC3)[C@@H](CCO)C2)c(C)[nH+]1,C22913858_decoy,CXCR4,Decoy,0,-8.81358,-7.3,-1.08,-8.734654576860578
CCCCC1CCC([C@@H]([NH3+])c2c(C)[nH+]c3ccc(C)cn23)CC1,C31918633_decoy,CXCR4,Decoy,0,-9.35091,-8.25,-3.03,-7.95106211979893
CCCOc1ccc([C@H](C[NH3+])N2CC[NH+](C)CC2)cc1OC,C32068909_decoy,CXCR4,Decoy,0,-7.8991,-6.73,-2.41,-8.174548072990763
CCCC[NH+](CC)[C@H](C[NH3+])c1cc(Cl)c(OC)c(OC)c1,C32071336_decoy,CXCR4,Decoy,0,-8.17757,-5.96,-2.06,-3.761510137572492
CCCC[NH+](C)[C@H](C[NH3+])c1ccc(OC)c(Br)c1,C32071445_decoy,CXCR4,Decoy,0,-8.53129,-6.45,-0.7,-8.67315096055441
O=S(=O)(CC[C@H]1CCCC[NH2+]1)N[C@H]1C[NH+]2CCC1CC2,C37661896_decoy,CXCR4,Decoy,0,-8.90298,-6.29,-1.06,-7.814632108610352
CCCC[NH+](CC)[C@@H](C[NH3+])c1cc(OC)c(OC)cc1Br,C37754901_decoy,CXCR4,Decoy,0,-8.20901,-6.19,-1.73,-3.710198262316514
C[NH+](C)CC(C)(C)C[NH2+]C[C@H](O)COc1cccc(Br)c1,C37847747_decoy,CXCR4,Decoy,0,-8.65374,-6.25,-2.39,-7.884691492331844
CC[NH+](CC)CCC[NH2+]C[C@@H](O)c1cc(Cl)ccc1Cl,C37879951_decoy,CXCR4,Decoy,0,-8.69029,-6.59,-1.15,-9.975860021228565
COc1ccc([C@@H](C[NH3+])[NH+](C)CC(C)C)cc1Br,C38052111_decoy,CXCR4,Decoy,0,-7.79755,-5.97,-1.44,-8.86920613788486
CC(C)COC[C@@H](O)C[NH2+]C[C@]1([NH+](C)C)CCC[C@@H](C)C1,C40669130_decoy,CXCR4,Decoy,0,-8.95009,-6.4,-2.49,-9.69510049918289
CC[C@H]([NH3+])Cc1cccc(Br)c1OCC[NH+](C)C,C42412890_decoy,CXCR4,Decoy,0,-8.01224,-6.48,-1.41,-8.23580950178822
CSc1ccc([C@@H](C[NH3+])N(CC[NH+](C)C)CC(C)C)cc1,C42744793_decoy,CXCR4,Decoy,0,-8.4685,-5.79,-2.0,-8.414268595109016
CC[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](CC)CCOC,C42954636_decoy,CXCR4,Decoy,0,-8.45029,-5.48,-0.83,-8.61886886226622
CC[C@H]([NH3+])[C@@H](c1cccc(Cl)c1)[NH+](C)Cc1ccoc1C,C43015250_decoy,CXCR4,Decoy,0,-8.4813,-8.13,-0.55,-9.88073112257896
C[C@@H]([NH3+])[C@@H](c1cccc(Br)c1)[NH+](Cc1ccco1)C1CC1,C43021918_decoy,CXCR4,Decoy,0,-8.83847,-6.57,-2.42,-8.626162982020652
CC[C@@H]([NH3+])[C@@H](c1ccccc1Br)[NH+](CC)Cc1ccco1,C43092615_decoy,CXCR4,Decoy,0,-8.10749,-6.21,-2.86,-7.912560291002461
CC[C@@H]([NH3+])[C@H](c1ccccc1Br)[NH+](C)Cc1ccoc1C,C43092671_decoy,CXCR4,Decoy,0,-8.72276,-6.79,-4.12,-8.27327576968525
CC[C@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](CC)CC1,C43258876_decoy,CXCR4,Decoy,0,-7.67017,-6.72,-2.03,-7.962837102995104
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)Cc1cscn1,C43263177_decoy,CXCR4,Decoy,0,-8.41462,-6.41,-1.88,-9.8749121376715
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)Cc1cnn(C)c1,C43286776_decoy,CXCR4,Decoy,0,-9.70459,-6.94,-1.53,-10.32259023535728
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)n1cc[nH+]c1C(C)C,C43287998_decoy,CXCR4,Decoy,0,-8.58576,-6.72,-0.49,-7.995416308300306
CCc1[nH+]ccn1[C@H](c1cc(Br)cs1)[C@H]([NH3+])CC,C43288148_decoy,CXCR4,Decoy,0,-8.59017,-6.38,-1.95,-8.307820354947324
[NH3+]C[C@@H](c1ccc(Cl)c(F)c1)[NH+](Cc1ccco1)C1CC1,C43390643_decoy,CXCR4,Decoy,0,-8.63154,-6.83,-3.98,-8.126232821946573
CCCN(CC[NH+](C)C)[C@@H](c1ccc(Br)s1)[C@H]([NH3+])CC,C45663653_decoy,CXCR4,Decoy,0,-8.45295,-5.23,-1.45,-8.515959249303847
CCCN(CC[NH+](C)C)[C@H](c1cc(Br)cs1)[C@H]([NH3+])CC,C45663658_decoy,CXCR4,Decoy,0,-8.58618,-5.45,-1.26,-8.376598131448622
C[C@H](CC[NH+](C)C)[NH2+]C[C@@H](O)COc1ccc(Cl)cc1,C49557154_decoy,CXCR4,Decoy,0,-8.11017,-6.18,-1.75,-7.7643087427035615
C[C@@H](CC[NH+](C)C)[NH2+]C[C@@H](O)COc1ccc(Cl)c(Cl)c1,C49557177_decoy,CXCR4,Decoy,0,-9.66571,-6.28,-1.67,-8.115106158616223
C[C@H](CC[NH+](C)C)[NH2+]C[C@@H](O)COc1ccc(Cl)c(Cl)c1,C49557178_decoy,CXCR4,Decoy,0,-8.33592,-6.36,-2.34,-3.687163749732804
Cc1cc(OC[C@H](O)C[NH2+][C@@H](C)CC[NH+](C)C)ccc1Cl,C49557191_decoy,CXCR4,Decoy,0,-8.19957,-6.17,-3.38,-7.401360719886399
C[C@@H]1CCCC[NH+]1CCCNS(=O)(=O)C[C@@H]1CCC[NH2+]1,C49641060_decoy,CXCR4,Decoy,0,-8.52816,-6.47,-2.79,-3.5086555051890254
C[C@H]1CCCC[NH+]1CCCNS(=O)(=O)C[C@@H]1CCC[NH2+]1,C49641061_decoy,CXCR4,Decoy,0,-8.10026,-5.44,-1.03,-6.3323400522815785
C[C@@H](c1cccs1)[NH+](C)[C@@H](C[NH3+])c1ccc(Br)o1,C49726387_decoy,CXCR4,Decoy,0,-8.27187,-6.55,-1.6,-12.391975381120265
COc1cccc(C[NH+](C)[C@H](c2ccc(C)s2)[C@H](C)[NH3+])c1,C43241618_decoy,CXCR4,Decoy,0,-7.65811,-6.91,-0.97,-7.601739402821031
C[NH+](C)C(C)(C)C[NH2+]C[C@H](O)c1cc(Cl)ccc1Cl,C43411435_decoy,CXCR4,Decoy,0,-8.51033,-7.47,-1.8,-9.387680118194488
C[NH+](Cc1cscn1)[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C50362404_decoy,CXCR4,Decoy,0,-9.52815,-6.36,-0.9,-9.475554032319463
CCC[C@@](C)(C[NH2+]C(C)(C)C)C[NH+]1CCN(CCO)CC1,C51206363_decoy,CXCR4,Decoy,0,-7.66573,-6.52,-0.83,-8.276841252925239
CC[NH+](C)CC[NH2+]C[C@H](O)COc1ccc(Br)cc1,C54112238_decoy,CXCR4,Decoy,0,-8.31869,-5.92,-1.63,-6.607354209871356
CC[C@@H]([NH3+])[C@@H](c1ccc(C)s1)N1CC[NH+]([C@@H](C)CC)CC1,C55063721_decoy,CXCR4,Decoy,0,-8.196,-6.26,-1.02,-6.976929868629314
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2ccc(Cl)c(F)c2)CC1,C55064451_decoy,CXCR4,Decoy,0,-8.64108,-7.0,-1.21,-7.6967994004422815
C[NH+](C)CC[NH2+]C[C@H](O)COc1c(Cl)cccc1Cl,C37851881_decoy,CXCR4,Decoy,0,-7.96384,-6.55,-1.98,-8.435147620070639
C[C@@H](C[NH2+]C[C@@H](O)COCc1ccccc1Cl)[NH+](C)C,C44317111_decoy,CXCR4,Decoy,0,-8.36523,-6.88,-1.78,-8.556161642845886
CC[NH+](CC)C[C@H]1[C@H]([NH3+])c2cccc(C(C)C)c2OC1(C)C,C62187761_decoy,CXCR4,Decoy,0,-7.89183,-7.62,-1.85,-8.771683933761258
C[NH+](C)[C@H]1CCN([C@@H](C[NH3+])c2ccc(C(F)(F)F)cc2)C1,C62964765_decoy,CXCR4,Decoy,0,-6.42119,-7.04,-0.81,-5.996420401568349
CC[NH+](CC)[C@@H]1CCN([C@@H](c2ccc(Cl)cc2)[C@@H](C)[NH3+])C1,C62977069_decoy,CXCR4,Decoy,0,-8.92657,-6.44,-1.67,-8.224051206000768
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[C@H]([NH+]2CCCC2)C1,C62977453_decoy,CXCR4,Decoy,0,-9.60105,-7.32,-0.6,-8.695113793017585
CC[NH+](CC)[C@H]1CCN([C@@H](C[NH3+])c2ccc(SC)cc2)C1,C62978354_decoy,CXCR4,Decoy,0,-8.99216,-5.64,-0.96,-6.565629971975485
Cc1cc(C[C@@H](C)[NH2+]CC2=CN=[NH+][C@@H]2c2ccc(F)cc2)n[nH]1,C63870363_decoy,CXCR4,Decoy,0,-8.34777,-8.39,-2.69,-3.9575506862935055
CCn1nc(C)c(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)c1C,C67122532_decoy,CXCR4,Decoy,0,-7.94435,-6.58,-0.77,-6.858643972931043
C[C@H](C[NH2+]Cc1c[nH]nc1-c1cccs1)Cn1cc[nH+]c1,C67500568_decoy,CXCR4,Decoy,0,-8.01711,-6.07,-2.82,-7.362203708941363
CCCC[NH+](C)[C@H](C[NH3+])c1ccccc1OC(F)(F)F,C19274501_decoy,CXCR4,Decoy,0,-7.46705,-7.69,-1.73,-9.501030184592995
CC(C)C[NH+](CC(C)C)[C@H](C[NH3+])c1ccc(N(C)C)cc1,C32055974_decoy,CXCR4,Decoy,0,-7.97073,-6.49,-3.46,-8.4244876877581
C[NH+](C)CC(C)(C)C[NH2+]C[C@H](O)c1ccc(F)c(F)c1,C37875672_decoy,CXCR4,Decoy,0,-7.59744,-6.99,-1.77,-8.584210532297515
C[NH+](C)C[C@@H](O)C[NH2+]CCc1ccc(Cl)cc1Cl,C37877900_decoy,CXCR4,Decoy,0,-8.15764,-6.9,-1.57,-7.953836939446722
[NH3+]CC[C@@H](N1CCC([NH+]2CCCCC2)CC1)C(F)(F)F,C40693685_decoy,CXCR4,Decoy,0,-7.02664,-5.28,-0.56,-6.136321189391167
C[NH+]1CCN(C[C@H](C[NH3+])c2ccc(F)c(Cl)c2)CC1,C41667179_decoy,CXCR4,Decoy,0,-9.02569,-7.3,-1.71,-8.656562313001142
CC(C)[NH+](CCn1ccc2c1CC(C)(C)C[C@@H]2[NH3+])C(C)C,C41727930_decoy,CXCR4,Decoy,0,-7.23207,-6.76,-2.58,-6.609101839927959
CC(C)C[NH+](CC(C)C)[C@H](C[NH3+])c1ccc2c(c1)CCO2,C42033656_decoy,CXCR4,Decoy,0,-8.00016,-7.35,-1.03,-10.12936319540538
CCOc1ccc([C@@H](C)[NH3+])cc1C[NH+](C)[C@H](C)CC(C)C,C42580782_decoy,CXCR4,Decoy,0,-8.20813,-7.31,-2.4,-10.04881744452591
CC[C@H](C)[NH+](CCOC)Cc1ccc(F)cc1C#CC[NH3+],C42590490_decoy,CXCR4,Decoy,0,-8.03987,-7.0,-1.5,-8.764107710706526
Cc1ccc(C[NH+](C)[C@H](c2ccc(Cl)cc2)[C@@H](C)[NH3+])o1,C42944988_decoy,CXCR4,Decoy,0,-7.22311,-7.69,-0.76,-8.378873542884474
C[C@H]([NH3+])[C@@H](c1ccc(Cl)cc1)N1CC[NH+](C2CC2)CC1,C42946074_decoy,CXCR4,Decoy,0,-8.37369,-7.07,-0.45,-8.573859546737955
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)n1cc[nH+]c1,C42955831_decoy,CXCR4,Decoy,0,-7.39335,-5.66,-1.69,-6.789724549922499
COc1ccc([C@@H]([C@@H](C)[NH3+])[NH+](C)[C@H]2CCC[C@@H](C)C2)cc1,C42961630_decoy,CXCR4,Decoy,0,-8.46468,-7.53,-0.62,-8.252942126551007
CC[C@H]([NH3+])[C@@H](c1cccc(Br)c1)n1cc[nH+]c1,C43022046_decoy,CXCR4,Decoy,0,-8.46748,-7.55,-1.49,-10.69799369155842
COc1cccc([C@@H]([C@@H](C)[NH3+])[NH+](C)[C@H]2CCC[C@H](C)C2)c1,C43027847_decoy,CXCR4,Decoy,0,-7.85146,-7.81,-2.54,-3.780687835961187
CC[C@@H]([NH3+])[C@H](c1ccccc1Cl)[NH+](CC)[C@@H](C)COC,C43052933_decoy,CXCR4,Decoy,0,-8.10875,-6.26,-1.64,-8.613010300656294
CC[C@H]([NH3+])[C@@H](c1cccs1)[NH+](Cc1ccco1)C1CC1,C43106793_decoy,CXCR4,Decoy,0,-7.94496,-5.91,-2.0,-9.070143784391504
CC[C@H]([NH3+])[C@@H](c1ccc(C)s1)[NH+](C)Cc1ccc(C)o1,C43240079_decoy,CXCR4,Decoy,0,-7.92913,-7.38,-1.39,-8.01980520877046
CC[C@H]([NH3+])[C@H](c1ccc(C)s1)[NH+](C)Cc1ccc(C)o1,C43240085_decoy,CXCR4,Decoy,0,-8.25696,-6.13,-2.08,-7.665652959477148
CC[C@@H]([NH3+])[C@H](c1ccco1)[NH+](Cc1cccs1)C(C)C,C43335886_decoy,CXCR4,Decoy,0,-8.59454,-6.26,-2.17,-8.266551693729026
CC(C)CC[NH+](C)[C@@H](C[NH3+])c1ccc(OC(F)F)cc1,C48923102_decoy,CXCR4,Decoy,0,-6.58569,-6.27,-1.34,-6.589581719358196
CC(C)(C)C1CCC(C[NH3+])(N2CC[NH+](C3CC3)CC2)CC1,C48991875_decoy,CXCR4,Decoy,0,-8.20341,-6.11,-0.57,-7.290212689551359
CSc1ccc([C@H](C[NH3+])N2CC[NH+](C3CC3)CC2)cc1,C48991904_decoy,CXCR4,Decoy,0,-8.37798,-6.25,-1.67,-7.278202380052385
CCC(C)(C)[C@@H]1CC[C@H]([NH3+])[C@H](N2CC[NH+](C3CC3)CC2)C1,C48992742_decoy,CXCR4,Decoy,0,-8.8893,-6.51,-0.43,-7.617138670215655
CCC1CCC([NH+](C)C2(C[NH3+])C[C@H]3CC[C@@H](C2)N3C)CC1,C49024010_decoy,CXCR4,Decoy,0,-8.36916,-7.79,-3.48,-3.437047326839848
CCC(C)(C)[C@H]1CC[C@H](C[NH3+])[C@H]([NH+](CCOC)C2CC2)C1,C49026935_decoy,CXCR4,Decoy,0,-8.44699,-6.27,-2.35,-8.50737818675155
C[C@@H](CC[NH+](C)C)[NH2+]Cc1cc(Cl)cc(Cl)c1O,C49553311_decoy,CXCR4,Decoy,0,-8.70595,-7.23,-1.27,-10.20405780462702
CC(C)C[NH+](C(C)C)[C@@H](C[NH3+])c1ccc2c(c1)CCN2C,C50287317_decoy,CXCR4,Decoy,0,-8.8434,-7.86,-2.12,-8.523022201527388
C[C@H]([NH3+])[C@@H](c1ccsc1)N1CC[NH+](C2CCCC2)CC1,C52060232_decoy,CXCR4,Decoy,0,-8.98583,-7.25,-1.3,-3.548743603854097
CCC[NH2+][C@H]1CC[C@H](CCC)C[C@H]1C[NH+]1CCC(O)CC1,C53860578_decoy,CXCR4,Decoy,0,-7.9223,-6.64,-1.25,-8.591670176766328
CC(C)(C)[C@@H]1CC[C@H]([NH3+])[C@H](CN2CC[NH+](C3CC3)CC2)C1,C53880559_decoy,CXCR4,Decoy,0,-9.0643,-7.38,-1.52,-8.088943853788797
CC[NH+](C)CC[NH2+]C[C@H](O)c1cccc(C(F)(F)F)c1,C54112117_decoy,CXCR4,Decoy,0,-6.67876,-6.62,-1.31,-6.198422698519368
CC[C@@H](C)[NH+]1CCN([C@@H](c2ccc(C)cc2)[C@@H](C)[NH3+])CC1,C55063592_decoy,CXCR4,Decoy,0,-8.37579,-6.44,-0.17,-7.623355088082767
CC[C@H](C)[NH+]1CCN([C@@H](c2ccc(C)cc2)[C@@H](C)[NH3+])CC1,C55063593_decoy,CXCR4,Decoy,0,-8.12051,-7.05,-1.29,-7.66789439350296
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2ccc(C)cc2C)CC1,C55064865_decoy,CXCR4,Decoy,0,-9.10784,-8.12,-0.82,-12.475028121562428
CC[C@H]([NH3+])[C@H](c1ccc(F)cc1)N1CCC[C@@H]1C[NH+](C)C,C61641921_decoy,CXCR4,Decoy,0,-7.89604,-7.78,-1.74,-9.59792172180582
C[NH+](C)C[C@H]1CCCN1[C@@H](C[NH3+])c1ccc(Cl)c(F)c1,C61642848_decoy,CXCR4,Decoy,0,-8.38706,-6.89,-0.48,-9.328547753748555
CC(C)c1ccc([C@H]([NH3+])CN2CCC[C@@H]2C[NH+](C)C)cc1,C61643473_decoy,CXCR4,Decoy,0,-8.00534,-7.28,-1.02,-7.789624922188159
CC(C)c1ccc([C@@H]([NH3+])CN2CCC[C@@H]2C[NH+](C)C)cc1,C61643474_decoy,CXCR4,Decoy,0,-7.62873,-6.36,-1.24,-6.366913857236268
Cc1oc(C[NH3+])cc1C[NH+](C)[C@H](C)c1ccc(Cl)cc1,C62019463_decoy,CXCR4,Decoy,0,-7.88339,-7.09,-1.32,-7.534744380462489
CCc1ccc2c(c1)[C@H]([NH3+])[C@@H](C[NH+](CC)CC)C(C)(C)O2,C62187902_decoy,CXCR4,Decoy,0,-9.22871,-7.37,-1.34,-8.123792313850297
CC[NH+](CC)C[C@H]1[C@H]([NH3+])c2cc(C)cc(C)c2OC1(C)C,C62188011_decoy,CXCR4,Decoy,0,-8.33843,-8.07,-0.8,-10.000997410369587
CC[NH+](CC)C[C@@H]1[C@@H]([NH3+])c2c(C)cc(C)cc2OC1(C)C,C62188099_decoy,CXCR4,Decoy,0,-8.38136,-7.57,-1.51,-8.811985053063756
CCC[C@H]1CC[C@@H](C[NH3+])[C@H](N2CCC[NH+]3CCC[C@@H]3C2)C1,C62940168_decoy,CXCR4,Decoy,0,-8.89114,-7.28,-0.95,-8.062913558848619
CCC1(CC)CC[NH+]([C@@H](C[NH3+])c2ccccc2OC)CC1,C62951685_decoy,CXCR4,Decoy,0,-8.26452,-6.69,-1.81,-7.525217646668148
CCC1(CC)CC[NH+]([C@@H](C[NH3+])c2ccc(OC)cc2)CC1,C62951770_decoy,CXCR4,Decoy,0,-7.92939,-6.01,-1.63,-6.963243298471311
CCC1(C)CC[NH+]([C@H](C[NH3+])c2ccc3c(c2)CCO3)CC1,C62952349_decoy,CXCR4,Decoy,0,-8.45614,-7.39,-0.42,-8.344958116438017
C[C@H]([NH3+])[C@H](c1ccsc1)N1CC[C@H]([NH+]2CCCCC2)C1,C62977765_decoy,CXCR4,Decoy,0,-9.10475,-6.55,-0.23,-6.909216620862354
CCc1ccc([C@@H](C[NH3+])N2CC[C@H]([NH+](CC)CC)C2)s1,C62978223_decoy,CXCR4,Decoy,0,-8.58369,-6.64,-2.84,-7.587815547747194
C[NH2+][C@@H](C)C(=O)N[C@@H]1C=C(C(=O)N[C@@H](Cc2ccc(OC)cc2)C(N)=O)C[C@@H](O)[C@@H]1O,C03838819_decoy,CXCR4,Decoy,0,-9.15782,-8.54,-1.96,-4.504910439920644
C[NH2+][C@H](C(=O)N[C@H]1C[C@@](O)(C(=O)N[C@H](CC(C)C)C(N)=O)C[C@@H](O)[C@@H]1O)C(C)C,C03840175_decoy,CXCR4,Decoy,0,-9.18799,-7.94,-4.33,-4.499564149479947
C[n+]1ccc(Nc2ccc(NC(=O)c3ccc(Nc4cc[n+](C)c5ccc(N)cc45)cc3N)cc2)cc1,C01704486_decoy,CXCR4,Decoy,0,-8.81777,-9.65,-2.61,-6.822850834654838
CNC(=[NH2+])c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C(=[NH2+])NC)cc3)c(N)c2)cc1,C04821858_decoy,CXCR4,Decoy,0,-9.51461,-6.56,-3.66,-3.734121790607378
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3OC(=O)CC[NH3+],C05351504_decoy,CXCR4,Decoy,0,-9.83036,-9.11,-1.78,-4.463832624341584
COC(=O)[C@@H](Cc1c[nH]c2ccc(F)cc12)NC(=O)[C@@H]([NH3+])Cc1c[nH]c2ccccc12,C01605773_decoy,CXCR4,Decoy,0,-8.63545,-8.29,-1.27,-8.256263689732654
Cc1ccc(Nc2nc(N)nc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)n2)cc1,C06831115_decoy,CXCR4,Decoy,0,-7.72028,-8.09,-2.66,-3.860423960036072
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@@H]12,C08034271_decoy,CXCR4,Decoy,0,-11.1775,-10.16,-2.51,-4.290248264884547
CNC(=[NH2+])c1ccc(NC(=[NH2+])c2ccc(NC(=O)c3ccc(C(=[NH2+])NC)cc3)cc2)cc1,C08616457_decoy,CXCR4,Decoy,0,-13.7033,-8.26,-2.88,-5.561764142204226
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCCOc2ccc(N)cc2)c1,C08627515_decoy,CXCR4,Decoy,0,-10.0251,-7.76,-2.79,-8.953175747286828
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCOc2ccc([N+](=O)[O-])cc2)c1,C08649719_decoy,CXCR4,Decoy,0,-9.23505,-8.71,-3.29,-4.146937299042331
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@@H]3[C@@H](O)[C@@H]12,C08836062_decoy,CXCR4,Decoy,0,-9.06386,-10.07,-0.64,-8.82718072938693
C[C@@H]([NH2+]CC(=O)NCC(=O)Nc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1,C08850304_decoy,CXCR4,Decoy,0,-8.43767,-8.59,-1.84,-7.596088874696228
OCC(CO)(CO)[NH2+]C[C@@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C10384381_decoy,CXCR4,Decoy,0,-10.0437,-7.92,-1.21,-9.872355737839491
COC(=O)c1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC(N)=[NH2+])cc2)cc1,C10012569_decoy,CXCR4,Decoy,0,-11.0576,-8.42,-0.99,-4.987475581088667
CC(=O)[C@@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@@H]2C[C@@H]([NH3+])[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O,C11678097_decoy,CXCR4,Decoy,0,-9.28463,-10.03,-3.07,-9.125625930862777
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(c3ccc(C(N)=O)cc3)C(=O)[C@H]21,C12880057_decoy,CXCR4,Decoy,0,-10.1232,-6.92,-0.84,-6.446695661419824
C[NH+](C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@@H]12,C08586064_decoy,CXCR4,Decoy,0,-10.571,-7.74,-1.39,-6.608316930980172
[NH2+]=c1[nH]n2c([nH]c(=[NH2+])c3c(=[NH2+])[nH][nH]c32)c1/N=N/c1ccc(Br)cc1,C16958749_decoy,CXCR4,Decoy,0,-10.4097,-6.65,-2.15,-3.8129367755336
CN1Cc2c(N3CCOCC3)[nH+]c3sc(C(=O)NN)c(N)c3c2CC1(C)C,C20264237_decoy,CXCR4,Decoy,0,-9.4354,-8.67,-1.52,-9.899469276294449
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C21982914_decoy,CXCR4,Decoy,0,-9.49125,-11.56,-1.44,-10.157847588929664
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@@H]2O[C@@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C21985990_decoy,CXCR4,Decoy,0,-8.10757,-8.05,-3.47,-3.762845427519943
Cc1cc(O)oc2cc(=[NH+]C(=O)[C@@H](CCCNC(N)=[NH2+])NC(=O)c3ccccc3)ccc1-2,C25761661_decoy,CXCR4,Decoy,0,-10.2026,-10.42,-1.05,-8.87349528284814
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc1,C30498799_decoy,CXCR4,Decoy,0,-7.47625,-8.19,-1.56,-7.721972555030502
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)O)[NH+](C)C1,C31357046_decoy,CXCR4,Decoy,0,-8.57922,-8.7,-2.68,-9.531463758601578
NS(=O)(=O)c1ccc(CCNC(=O)c2coc([C@@H]([NH3+])Cc3ccc(O)cc3)n2)cc1,C33635499_decoy,CXCR4,Decoy,0,-10.4511,-9.66,-1.8,-9.616044049756631
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C35636346_decoy,CXCR4,Decoy,0,-9.33991,-8.33,-1.74,-7.216782385282693
COc1ccc(-c2nc3n(c(=[NH2+])c2C#N)NC(=[NH2+])/C3=N\Nc2ccc3c(c2)OCO3)cc1,C17173069_decoy,CXCR4,Decoy,0,-10.5343,-7.5,-2.98,-6.851301511937702
Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3sc4c(c3C(N)=O)CCC4)sc2[nH+]1,C36645734_decoy,CXCR4,Decoy,0,-9.79768,-9.39,-2.23,-4.5924417537129285
NC(=O)C[C@H]([NH3+])C(=O)Nc1c(Br)cc(Br)cc1Br,C37626072_decoy,CXCR4,Decoy,0,-9.37409,-6.53,-1.64,-8.156391304042778
COC(=O)c1cc(Br)cc(Br)c1NC(=O)[C@@H]([NH3+])CC(N)=O,C37769946_decoy,CXCR4,Decoy,0,-9.2699,-6.38,-1.64,-8.796260960641876
CC(C)[C@@]12CN3C[C@@](C(C)C)(C[NH+](C1)[C@H]3[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C2=O,C19323209_decoy,CXCR4,Decoy,0,-9.66865,-7.2,-1.62,-4.054054345226769
OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C36369753_decoy,CXCR4,Decoy,0,-10.4599,-10.06,-1.3,-14.31719175842042
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCN(C(=O)[C@@H]([NH3+])CC(C)C)CCOCC1,C39988461_decoy,CXCR4,Decoy,0,-8.49257,-8.1,-4.23,-4.214956213312626
CC(C)C[C@@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@H]([NH3+])CC(C)C)CCOCC1,C39988465_decoy,CXCR4,Decoy,0,-8.16315,-7.91,-2.9,-3.789028537686666
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@@H](O)[C@H](O)CO,C40151164_decoy,CXCR4,Decoy,0,-8.12433,-8.17,-2.7,-3.656847389985512
O=C(N/N=C(\[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccccc1Cl,C40151219_decoy,CXCR4,Decoy,0,-8.7444,-8.13,-1.86,-8.979121506751028
COc1ccc(C(=O)N/N=C(\[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)[C@@H](O)[C@H](O)CO)cc1,C40151256_decoy,CXCR4,Decoy,0,-8.40488,-9.23,-1.39,-4.117461195303581
CC1(C)CC(NC(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C42895946_decoy,CXCR4,Decoy,0,-8.30502,-8.16,-3.98,-4.14701252068461
CC1(C)CC(NC(=O)N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC(C)(C)[NH2+]1,C42895952_decoy,CXCR4,Decoy,0,-7.94091,-8.24,-2.03,-6.723864870061017
CCC[C@H]([NH3+])c1nc(C(=O)Nc2ccc(C(=O)c3ccc(N)cc3)cc2)cs1,C43226469_decoy,CXCR4,Decoy,0,-8.68294,-7.31,-2.94,-6.946186294948119
C[C@@]1(O)c2c(Cl)ccc(O)c2C(=O)[C@@H]2[C@@H](O)[C@@]3(O)C(=O)[C@@H](C(N)=O)[C@H](O)[C@@H]([NH3+])[C@H]3C[C@H]21,C43769457_decoy,CXCR4,Decoy,0,-10.7676,-10.93,-3.55,-3.5166962499625525
C[C@@H](O)[C@@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44019211_decoy,CXCR4,Decoy,0,-10.2988,-9.44,-1.01,-9.175830436315168
CCC[C@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C44699300_decoy,CXCR4,Decoy,0,-8.94475,-6.21,-1.62,-7.709825645013709
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](O)[C@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C44960179_decoy,CXCR4,Decoy,0,-8.75319,-7.73,-2.03,-6.5831756560401296
CC1(C)CC(NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC(C)(C)[NH2+]1,C45860797_decoy,CXCR4,Decoy,0,-8.10991,-7.47,-2.58,-7.317549120184232
NC(=O)c1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627780_decoy,CXCR4,Decoy,0,-9.02568,-7.53,-1.8,-6.829803235691719
Cc1c(C)c(S(=O)(=O)N/[NH+]=C/NCCC[C@@H]([NH3+])C(=O)[O-])c(C)c2c1OC(C)(C)C2,C55161959_decoy,CXCR4,Decoy,0,-8.43706,-9.68,-2.9,-4.603087563809672
[H]/N=C(/N)NC(=[NH2+])S[C@H]1CC(=O)N(c2ccc(I)cc2)C1=O,C59491083_decoy,CXCR4,Decoy,0,-7.65188,-6.87,-1.75,-3.3719608606915434
NC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1,C64169694_decoy,CXCR4,Decoy,0,-8.28527,-10.67,-0.52,-8.956629519958822
Cc1c(CSC(N)=[NH2+])c(C)c(CSC(N)=[NH2+])c(C)c1CSC(N)=[NH2+],C04377411_decoy,CXCR4,Decoy,0,-9.27226,-7.02,-3.35,-9.514661843504872
Cc1cc(O)oc2c/c(=[NH+]/C(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)C[NH3+])ccc1-2,C25667243_decoy,CXCR4,Decoy,0,-10.7434,-8.81,-0.9,-12.310648097062346
C[C@H]([NH3+])C(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)/[NH+]=c1/ccc2c(C(F)(F)F)cc(O)oc-2c1,C35051128_decoy,CXCR4,Decoy,0,-10.5566,-7.92,-2.84,-8.638615425589215
C[C@H](NC(=O)[C@@H]([NH3+])CCCC[NH3+])C(=O)/[NH+]=c1/ccc2c(C(F)(F)F)cc(O)oc-2c1,C35051130_decoy,CXCR4,Decoy,0,-8.76665,-9.06,-2.32,-4.496692948774141
[NH2+]=C(NO)c1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627660_decoy,CXCR4,Decoy,0,-9.54701,-8.93,-2.8,-8.458677750757252
NC(=[NH2+])c1ccc(-c2cncc(OC[C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)c2)cc1,C52627670_decoy,CXCR4,Decoy,0,-10.2671,-9.4,-2.87,-8.112638720177705
Cc1ccc(-c2n[nH]cc2C[NH+](C)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1C,C12434304_decoy,CXCR4,Decoy,0,-9.01744,-9.15,-0.81,-10.314097999559367
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]Cc2ccccc2O)C[C@@]1(C)CO,C19113044_decoy,CXCR4,Decoy,0,-8.84602,-7.32,-1.11,-9.013860463269848
CC(=O)/[NH+]=c1/ccc2c(C[NH2+][C@H](C)c3ccc(F)cc3F)cc(O)oc-2c1,C34884265_decoy,CXCR4,Decoy,0,-8.94515,-9.62,-2.41,-7.987726007555917
CCOc1c(Br)cc(C[NH2+]CCCC[NH3+])cc1Br,C37715423_decoy,CXCR4,Decoy,0,-8.39001,-6.53,-1.07,-8.316162323291184
Cc1ccc2c(c1)=[NH+][C@@H](C1=C(N)N(c3ccc(C(=O)OC(C)C)cc3)CC1=O)[NH+]=2,C38819115_decoy,CXCR4,Decoy,0,-7.5117,-9.24,-3.34,-6.6699359027278895
CCC[NH+](C(C)C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C37095861_decoy,CXCR4,Decoy,0,-9.40166,-6.88,-0.76,-13.231588453328795
C[C@@H](O)C[NH2+]CC[NH2+]Cc1ccc(-c2ccc(Br)cc2)o1,C32511582_decoy,CXCR4,Decoy,0,-8.2539,-6.9,-0.92,-8.86290208217023
C[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)N1CC[NH+](C(C)(C)C)CC1,C42954420_decoy,CXCR4,Decoy,0,-8.5361,-6.51,-0.65,-7.87641013476396
CC[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](CC(N)=O)CC(C)C,C42955596_decoy,CXCR4,Decoy,0,-8.09964,-6.76,-2.46,-8.739432139244332
CC[C@@H]([NH3+])[C@@H](c1ccccc1Br)[NH+](CC(N)=O)CC(C)C,C43093519_decoy,CXCR4,Decoy,0,-8.14154,-6.6,-4.3,-3.7609306545242274
C[C@@H]([NH3+])[C@@H](c1ccccc1Br)[NH+](Cc1ccco1)C1CC1,C43093527_decoy,CXCR4,Decoy,0,-7.60152,-5.87,-1.95,-7.53622507926757
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[NH+](CC2CC2)CC1,C43261924_decoy,CXCR4,Decoy,0,-9.51615,-6.5,-1.04,-7.512520949276583
CCC[NH+](CC(=O)NC)[C@H](c1ccc(Br)s1)[C@H]([NH3+])CC,C43262396_decoy,CXCR4,Decoy,0,-8.8773,-5.68,-1.42,-8.280163791580812
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)[NH+](C)CC(=O)NC(C)C,C43262960_decoy,CXCR4,Decoy,0,-8.09885,-6.61,-2.58,-7.405394058637791
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](CC)CC(=O)NC,C43285717_decoy,CXCR4,Decoy,0,-9.88585,-5.85,-1.25,-10.17556412776126
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CC[NH+](C(C)(C)C)CC1,C43286674_decoy,CXCR4,Decoy,0,-9.08414,-5.93,-2.44,-7.33997138763001
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N1CC[NH+](C(C)(C)C)CC1,C43286677_decoy,CXCR4,Decoy,0,-9.62576,-6.41,-0.82,-8.07665533449551
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)N1CCC(C[NH+](C)C)CC1,C43287083_decoy,CXCR4,Decoy,0,-9.8306,-6.22,-3.54,-8.371615039116207
COc1ccc(C2[NH+](Cc3ccccc3O)CC[NH+]2Cc2ccccc2O)cc1OC,C19324032_decoy,CXCR4,Decoy,0,-8.51888,-8.34,-2.5,-3.851892895129337
[NH3+][C@H](COc1cncc(Nc2cccnc2)c1)CC1=c2ccccc2=[NH+]C1,C52627732_decoy,CXCR4,Decoy,0,-7.31078,-6.6,-3.73,-5.553501516990623
[NH3+][C@H](COc1cncc(-c2ccc3[nH]nc(Cl)c3c2)c1)CC1=c2ccccc2=[NH+]C1,C52634703_decoy,CXCR4,Decoy,0,-10.186,-10.33,-2.17,-8.824634342510514
CC(C)C[NH+]1CCN([C@@H](c2ccc(Br)s2)[C@@H](C)[NH3+])CC1,C55077350_decoy,CXCR4,Decoy,0,-9.68161,-5.88,-4.35,-8.068328729923573
C[C@H]([NH3+])[C@H](c1cc(Br)cs1)N1CCC(C[NH+](C)C)CC1,C43287075_decoy,CXCR4,Decoy,0,-9.03739,-5.72,-0.36,-8.377035085079891
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CCC[NH+]2CCC[C@@H]2C1,C62939950_decoy,CXCR4,Decoy,0,-10.4722,-6.55,-3.18,-8.306184925988834
O=C(Nc1cccc(C2[NH+]=c3ccccc3=[NH+]2)c1)c1cccc(NC(=O)c2ccco2)c1,C63078365_decoy,CXCR4,Decoy,0,-8.61291,-8.75,-3.74,-7.360273794894214
Cc1ccc(N2[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)NN[C@H]2c2cnccn2)cc1,C63165449_decoy,CXCR4,Decoy,0,-8.56506,-9.82,-4.31,-4.161059125699146
C[C@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)N[C@@H]1Nc2ccccc2S1,C63221280_decoy,CXCR4,Decoy,0,-8.20936,-6.25,-2.06,-5.722429452808293
C[C@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)N[C@H]1Nc2ccccc2S1,C63221283_decoy,CXCR4,Decoy,0,-8.40147,-8.98,-0.92,-8.680717298882598
c1coc(CN2[C@H](Cc3cccs3)NN[C@@H]2SCC2[NH+]=c3ccccc3=[NH+]2)c1,C63297494_decoy,CXCR4,Decoy,0,-8.97788,-7.03,-0.37,-7.63312771559605
CCN1NC(C)=C(NC(=O)CS[C@@H]2[NH+]=c3cc(C)cc(C)c3=[NH+]2)[C@@H]1C,C63340103_decoy,CXCR4,Decoy,0,-9.05293,-7.94,-1.53,-8.01730901225637
CCN1[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)NN[C@@H]1c1ccc(Cl)cc1,C63446218_decoy,CXCR4,Decoy,0,-8.46099,-9.9,-1.38,-8.547868461272769
COc1cccc([C@@H]2NN[C@@H](SCC3[NH+]=c4ccccc4=[NH+]3)N2Cc2ccco2)c1,C63446277_decoy,CXCR4,Decoy,0,-9.27412,-7.69,-1.54,-7.745637619563648
COc1ccccc1C([C@@H]1C(=O)[NH+]=c2ccccc2=C1O)[C@@H]1C(=O)[NH+]=c2ccccc2=C1O,C09698237_decoy,CXCR4,Decoy,0,-8.21804,-8.98,-1.37,-8.859384084703173
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2ccc(Cl)cc2Cl)O1,C63720223_decoy,CXCR4,Decoy,0,-9.51507,-7.02,-2.37,-7.276893846266718
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SCc2c(F)cccc2Cl)O1,C63720227_decoy,CXCR4,Decoy,0,-8.8843,-7.05,-4.26,-6.167638048086454
COc1ccc([C@@H](C[NH2+][C@@H](C)CC(N)=O)C2=c3ccccc3=[NH+]C2)cc1,C63919927_decoy,CXCR4,Decoy,0,-6.6829,-6.95,-1.78,-8.063017541080296
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1NN[C@H](SC/C=C/c2ccccc2)O1,C63985334_decoy,CXCR4,Decoy,0,-8.0511,-8.42,-0.85,-8.45354411269423
CCOc1ccc(C(=O)N[C@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc1,C64392334_decoy,CXCR4,Decoy,0,-7.92946,-8.91,-0.96,-8.45554778106419
Cc1cccc(NC(=O)CS[C@@H]2N=N[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64428618_decoy,CXCR4,Decoy,0,-8.26739,-9.77,-1.32,-4.384614332361896
Cc1cccc(NC(=O)CS[C@@H]2N=N[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1C,C64428623_decoy,CXCR4,Decoy,0,-8.33324,-8.24,-2.8,-6.815199042407839
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@H](SCc2ccc(Cl)c(Cl)c2)O1,C64428631_decoy,CXCR4,Decoy,0,-10.4069,-8.91,-2.58,-8.3779062055572
Cc1ccc2c(c1)=[NH+][C@H](CNC(=O)c1ccccc1[C@@H]1NC(c3ccc(F)cc3)=NO1)[NH+]=2,C64580501_decoy,CXCR4,Decoy,0,-8.13167,-9.72,-1.71,-7.367243883794255
Cc1ccc2c(c1)=[NH+][C@@H](CNC(=O)c1ccccc1[C@H]1NC(c3ccc(F)cc3)=NO1)[NH+]=2,C64580502_decoy,CXCR4,Decoy,0,-7.46956,-9.16,-1.84,-6.963831827820971
CC(=O)N[C@@H]1Nc2c(C)cc(NC(=O)CCC3[NH+]=c4ccccc4=[NH+]3)cc2S1,C64690829_decoy,CXCR4,Decoy,0,-9.666,-9.63,-1.09,-8.469405555363938
COc1ccc(CC(=O)N[C@@H](C(=O)NC2[NH+]=c3ccccc3=[NH+]2)C(C)C)c(Cl)c1,C65305792_decoy,CXCR4,Decoy,0,-9.46192,-8.36,-3.74,-4.372209981163061
COc1cccc(CC(=O)N[C@H](CC(C)C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)c1,C65305808_decoy,CXCR4,Decoy,0,-9.0656,-8.38,-1.33,-8.695484558797496
CC[C@@H](C)[C@H](NC(=O)Cc1ccc(OC)cc1Cl)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305919_decoy,CXCR4,Decoy,0,-8.87815,-8.86,-2.32,-4.315684917758543
CC[C@@H](C)[C@H](NC(=O)c1cc(C)cc(C)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305991_decoy,CXCR4,Decoy,0,-8.97891,-9.81,-0.92,-10.458103559193718
CCC[C@@H](NC(=O)Cc1ccc(OC)c(Cl)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65306028_decoy,CXCR4,Decoy,0,-9.49555,-8.15,-1.55,-4.591795212049801
CC(C)[NH+]1CCNC(=O)[C@H]1CC(=O)NCCC1=c2cc(C#N)ccc2=[NH+][C@H]1C,C65384759_decoy,CXCR4,Decoy,0,-8.70775,-9.91,-3.29,-11.894243250818786
[NH2+]=c1n(CC[NH+]2CCOCC2)c2ccccc2n1C[C@H](O)c1ccco1,C00845918_decoy,CXCR4,Decoy,0,-7.94148,-7.05,-0.99,-7.100880315867497
CC(C)C[C@H]([NH3+])C(=O)N1CCN(C(=O)CCn2ccc3cc[nH+]cc32)CC1,C19446764_decoy,CXCR4,Decoy,0,-8.99423,-8.6,-1.15,-10.48177355502828
[NH2+]=c1c2c(ncn1CCCn1cc[nH+]c1)Oc1cc(O)ccc1[C@@H]2c1ccccc1,C35833064_decoy,CXCR4,Decoy,0,-9.03744,-7.9,-1.53,-7.155016575200667
COc1ccc(N2CC(=O)C([C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)cc1,C38819053_decoy,CXCR4,Decoy,0,-7.29368,-9.09,-0.66,-7.823950729740945
C[NH2+]CC1=NNN(C2CC[NH+](Cc3ccc([C@@H]4C=CN=N4)s3)CC2)C1,C39358293_decoy,CXCR4,Decoy,0,-9.17223,-6.87,-3.91,-3.5317125646316008
CC[NH+](CC)CCNC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39626759_decoy,CXCR4,Decoy,0,-8.54209,-8.98,-2.0,-10.189356701830116
CC(=O)N1C[C@@H](C(=O)NCCCn2cc[nH+]c2)C2(CC[NH2+]CC2)C1,C39629881_decoy,CXCR4,Decoy,0,-8.4432,-7.68,-1.67,-7.968315740006498
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2)C(C)C,C39634703_decoy,CXCR4,Decoy,0,-9.29891,-9.13,-3.33,-4.461879913946062
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2)C(C)C,C39634912_decoy,CXCR4,Decoy,0,-9.49115,-7.95,-2.5,-8.335231734578878
CC1(C(=O)N2C[C@@H](C(=O)N[C@@H]3C[NH+]4CCC3CC4)C3(CC[NH2+]CC3)C2)CCCCC1,C39663094_decoy,CXCR4,Decoy,0,-9.3055,-8.38,-1.49,-3.371496360917192
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)N[C@H]3C[NH+]4CCC3CC4)C3(CC[NH2+]CC3)C2)c1F,C39663128_decoy,CXCR4,Decoy,0,-9.75801,-8.68,-1.99,-11.64722748335132
O=C(N[C@@H]1C[NH+]2CCC1CC2)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39663274_decoy,CXCR4,Decoy,0,-9.29059,-8.95,-3.28,-4.149721723421405
O=C(N[C@@H]1C[NH+]2CCC1CC2)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39663294_decoy,CXCR4,Decoy,0,-9.38456,-8.53,-1.6,-7.524428551389073
Cc1ccn2cc(CNC(=O)[C@H]3CN(C(=O)[C@@H]4CC=CCC4)CC34CC[NH2+]CC4)[nH+]c2c1,C39670236_decoy,CXCR4,Decoy,0,-9.63015,-9.27,-1.55,-8.86094937020328
Cc1ccc2[nH+]c(CNC(=O)[C@@H]3CN(C(=O)[C@H]4CC=CCC4)CC34CC[NH2+]CC4)cn2c1,C39670572_decoy,CXCR4,Decoy,0,-8.69629,-9.48,-3.12,-3.893824220066158
Cc1ccc(C(=O)N2C[C@H](C(=O)NCCC3=c4cc(C#N)ccc4=[NH+][C@@H]3C)C3(CC[NH2+]CC3)C2)cc1,C39674592_decoy,CXCR4,Decoy,0,-9.1034,-9.15,-1.3,-8.394289697731036
C[C@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39674826_decoy,CXCR4,Decoy,0,-10.2412,-11.19,-1.83,-10.151235696987705
O=C(N[C@H]1C[NH+]2CCC1CC2)[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2,C39681959_decoy,CXCR4,Decoy,0,-9.59948,-8.29,-0.89,-8.108698816503018
O=C(NC1CCN(c2cccc[nH+]2)CC1)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39687386_decoy,CXCR4,Decoy,0,-9.24135,-8.63,-2.11,-3.9333365737208577
Cn1cc[nH+]c1CNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C39688816_decoy,CXCR4,Decoy,0,-10.037,-8.08,-3.62,-4.278030092416584
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)NCc2[nH+]ccn2C)C2(CC[NH2+]CC2)C1,C39689031_decoy,CXCR4,Decoy,0,-9.08815,-7.64,-3.02,-3.983298567091409
COc1c(C(=O)N2C[C@@H](C(=O)NC[C@H]3CC[NH+](C)C3)C3(CC[NH2+]CC3)C2)csc1Cl,C39689764_decoy,CXCR4,Decoy,0,-10.9498,-6.83,-2.29,-4.194505725481862
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1Cc1ccc(Cl)cc1,C39783758_decoy,CXCR4,Decoy,0,-8.06669,-7.73,-2.24,-6.42971871328489
OCC/[NH+]=C(\c1ccc(Cl)cc1)N1CCN(/C(=[NH+]/CCO)c2ccc(Cl)cc2)CC1,C39939847_decoy,CXCR4,Decoy,0,-10.6877,-8.17,-1.82,-10.07940499144638
O=S1(=O)CC[C@@H]([NH2+]CCCCCC[NH2+][C@H]2CCS(=O)(=O)C2)C1,C40177464_decoy,CXCR4,Decoy,0,-9.02519,-6.29,-3.97,-3.508844736394966
CC[NH+]1CCC[C@](C)(C(=O)N2CCC(n3cc(C(C)(C)[NH3+])nn3)CC2)C1,C48080928_decoy,CXCR4,Decoy,0,-8.99776,-8.84,-1.98,-4.294766264024529
Cc1cccc(C2=c3cc(S(N)(=O)=O)ccc3=[NH+][C@@H]2C(=O)N[n+]2c(C)cc(C)cc2C)c1,C52426202_decoy,CXCR4,Decoy,0,-8.83144,-10.95,-2.88,-9.338061352791984
CCOc1ccc(NC(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)cc1F,C56702388_decoy,CXCR4,Decoy,0,-8.4469,-7.86,-1.47,-4.004910490448334
Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NC1CC[NH+](C)CC1,C43491177_decoy,CXCR4,Decoy,0,-8.62787,-5.73,-2.41,-5.368823565214899
C[C@@H]([NH3+])[C@@H](c1cccc(Br)c1)N1CCn2cc[nH+]c2C1,C62246240_decoy,CXCR4,Decoy,0,-7.79968,-6.62,-0.87,-6.259646153465886
[NH3+]C[C@@H](c1cc(Br)c(Br)o1)N1CCn2cc[nH+]c2C1,C62248772_decoy,CXCR4,Decoy,0,-9.29396,-7.17,-0.43,-9.36123223374882
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)N1CCC[NH+]2CCC[C@@H]2C1,C62939992_decoy,CXCR4,Decoy,0,-8.132,-6.85,-3.18,-3.176815353804653
O=C(NCCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1NC(c2cccs2)=NO1,C63119351_decoy,CXCR4,Decoy,0,-7.9419,-6.3,-1.16,-5.61926150055772
O=C1[NH+]=c2ccccc2=C(O)[C@@H]1C(c1cccnc1)[C@@H]1C(=O)[NH+]=c2ccccc2=C1O,C18223066_decoy,CXCR4,Decoy,0,-9.12929,-9.04,-1.83,-11.263262046746526
COc1ccc(N2CC(=O)C([C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)=C2N)cc1Cl,C63515063_decoy,CXCR4,Decoy,0,-8.61707,-7.42,-1.75,-6.478096450862395
O=C(NCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1NC(c2ccc(C(F)(F)F)cc2)=NO1,C63526365_decoy,CXCR4,Decoy,0,-7.46473,-9.58,-3.11,-4.13360921108852
O=C(NCC1[NH+]=c2ccccc2=[NH+]1)[C@H]1NC(c2ccc(C(F)(F)F)cc2)=NO1,C63526366_decoy,CXCR4,Decoy,0,-6.54047,-9.15,-2.06,-7.19670685445925
CC(=O)Nc1ccc(N2C(=O)C[C@H]([NH2+]CCC3=c4cc(C)ccc4=[NH+]C3)C2=O)cc1,C63633148_decoy,CXCR4,Decoy,0,-8.8063,-9.51,-0.43,-5.448993209866428
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NC1[NH+]=c2ccccc2=[NH+]1,C63733018_decoy,CXCR4,Decoy,0,-9.49459,-8.2,-2.38,-4.056049277429718
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C63805707_decoy,CXCR4,Decoy,0,-8.52143,-7.43,-1.06,-6.525026403459099
Cc1ccc2c(c1)=[NH+][C@@H](C1=C(N)N(Cc3ccc(F)cc3)CC1=O)[NH+]=2,C63904391_decoy,CXCR4,Decoy,0,-7.22145,-7.83,-0.81,-6.045063505097804
NC(=O)c1ccc([C@H]2CCCN2C(=O)COCC2[NH+]=c3ccccc3=[NH+]2)s1,C64015018_decoy,CXCR4,Decoy,0,-8.09423,-8.32,-1.31,-7.892958466730887
COc1ccc(C(=O)N[C@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc1,C64392376_decoy,CXCR4,Decoy,0,-6.83943,-8.36,-1.8,-3.64614474079564
COc1cccc(CC(=O)N[C@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)c1,C65305718_decoy,CXCR4,Decoy,0,-7.40741,-9.68,-1.63,-4.05873528180245
COCC(=O)N1C[C@H]2C[NH2+]C[C@@]2(C(=O)NC(C)(C)C[NH+]2CCCC2)C1,C65381045_decoy,CXCR4,Decoy,0,-8.1068,-7.57,-0.73,-8.637564690354067
C[NH+]1C[C@]2(C)CN(C(=O)C[NH+]3CCC(C(N)=O)CC3)C[C@](C)(C1)C2,C65382605_decoy,CXCR4,Decoy,0,-8.87662,-6.51,-0.4,-7.780281547736991
CCC[NH+](CCC)Cc1ccc(C(=O)N2CCO[C@@H](CC[NH3+])C2)cc1,C65418759_decoy,CXCR4,Decoy,0,-8.94682,-6.26,-1.13,-8.410931609192062
O=C(NC[C@H]1C=c2ccccc2=[NH+]1)c1cn(C[C@@H]2CCC[NH2+]C2)nn1,C65426276_decoy,CXCR4,Decoy,0,-8.43515,-6.12,-1.55,-5.642587588227562
O=C(N1CCc2[nH]c[nH+]c2C1)C1(Oc2ccc(Cl)cc2)CC[NH2+]CC1,C65532334_decoy,CXCR4,Decoy,0,-8.61408,-7.99,-1.18,-8.243817586851332
CCS(=O)(=O)N1CCC([NH2+]C[C@H]2CNc3cc(C)[nH+]n3C2)CC1,C65621273_decoy,CXCR4,Decoy,0,-8.94394,-7.4,-3.19,-3.820610257031259
C[C@@H]1C[C@@H](C)C[NH+]([C@@H](C[NH3+])c2ccc([C@@H]3C[C@@H]3C)o2)C1,C20081968_decoy,CXCR4,Decoy,0,-7.85722,-7.33,-1.54,-7.69218013995206
CC1CC[NH+]([C@@H](C[NH3+])c2ccc(OC(F)F)cc2)CC1,C22170282_decoy,CXCR4,Decoy,0,-6.72934,-6.78,-1.74,-6.705557994070559
CCCC[C@@H]([NH3+])c1c(C(C)(C)C)[nH+]c2ccc(C)cn12,C31912931_decoy,CXCR4,Decoy,0,-7.77709,-7.62,-0.22,-8.513882879177546
CCCC[C@H]([NH3+])c1c(C(C)(C)C)[nH+]c2ccc(C)cn12,C31912933_decoy,CXCR4,Decoy,0,-7.12673,-7.7,-0.37,-7.602562829858661
COc1ccccc1[C@@H](C[NH3+])[NH+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2,C32074078_decoy,CXCR4,Decoy,0,-8.21579,-6.34,-2.73,-7.842884162218436
CCC[C@H]1CC[C@H](C[NH3+])[C@H](N2CCC([NH+](C)C)CC2)C1,C36191260_decoy,CXCR4,Decoy,0,-8.21944,-6.38,-1.71,-8.733474728989009
CC(C)CC[C@](C)(C[NH3+])N1CCC([NH+](C)C)CC1,C36191633_decoy,CXCR4,Decoy,0,-7.41613,-6.3,-0.87,-9.203398659879024
C[C@@H]1C[NH+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](O)c1ccccc1,C36908615_decoy,CXCR4,Decoy,0,-6.44118,-7.3,-1.54,-7.255130105556012
CC(C)[C@@H](C)[NH+](C)[C@@H](C[NH3+])c1ccc2c(c1)CCO2,C37363870_decoy,CXCR4,Decoy,0,-7.78576,-6.43,-0.86,-7.8395342943895905
C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCCC[C@@H]2O)([NH+](C)C)C1,C40669396_decoy,CXCR4,Decoy,0,-8.09726,-6.77,-0.93,-7.571987547565304
CC(C)C[C@H]([NH3+])CN1CCC([NH+]2CCCCC2)CC1,C40694442_decoy,CXCR4,Decoy,0,-8.0595,-5.11,-2.89,-5.893853424976051
Cc1ccc(OCC[NH+]2[C@@H]3CC[C@H]2CC([NH3+])C3)cc1,C40750135_decoy,CXCR4,Decoy,0,-7.82548,-7.31,-1.89,-6.843377547553873
C[NH+](C)CCOc1ccc2cc(C#CC[NH3+])ccc2c1,C42477898_decoy,CXCR4,Decoy,0,-7.91588,-6.48,-1.26,-9.839197568924918
COc1cccc([C@H]([C@H](C)[NH3+])[NH+](C)C2CCCC2)c1,C43026244_decoy,CXCR4,Decoy,0,-7.34989,-7.57,-4.06,-9.53292332123045
CC[C@H]([NH3+])[C@@H](c1ccsc1)n1cc[nH+]c1C(C)C,C43124190_decoy,CXCR4,Decoy,0,-7.97376,-6.35,-1.07,-7.9973351405030675
CC[C@H]([NH3+])[C@H](c1ccc(Cl)s1)n1cc[nH+]c1C,C43254346_decoy,CXCR4,Decoy,0,-7.92007,-6.27,-1.63,-8.49110417357187
C[C@H]([NH3+])[C@@H](N1CCC(C[NH+](C)C)CC1)C(C)(C)C,C43293995_decoy,CXCR4,Decoy,0,-6.88254,-6.19,-2.03,-7.260323532956515
C[C@H]1CCC[C@@](C[NH3+])(N2CC[NH+](CC3CC3)CC2)C1,C48992078_decoy,CXCR4,Decoy,0,-8.59339,-7.44,-1.48,-11.370683717342136
CC[C@@H]1CC[C@@H]([NH3+])[C@H](N2CC[NH+](CC3CC3)CC2)C1,C48993035_decoy,CXCR4,Decoy,0,-8.53569,-7.07,-0.7,-9.483808051191255
Cc1cc(C)c(C[NH3+])c(N(C)[C@@H](C)c2cccs2)[nH+]1,C49725707_decoy,CXCR4,Decoy,0,-7.46145,-6.29,-1.09,-6.910482047292287
CC(C)(C[NH2+]C(C)(C)C)C[NH+]1CCC[C@H](CO)C1,C51206206_decoy,CXCR4,Decoy,0,-7.30781,-5.75,-2.82,-3.259115277532979
[NH3+]C[C@@H](C1CCCC1)N1CC[NH+](C2CCCC2)CC1,C52060710_decoy,CXCR4,Decoy,0,-8.14798,-7.4,-1.78,-3.0437251213509366
CC(C)(C)C1CC[NH+]([C@@H](C[NH3+])C2CCOCC2)CC1,C52178047_decoy,CXCR4,Decoy,0,-7.53022,-6.21,-0.96,-9.988173037119902
C[NH+](Cc1ccc(Cl)cc1)Cc1ccc(C[NH3+])o1,C52346338_decoy,CXCR4,Decoy,0,-6.6959,-6.94,-1.37,-6.9656367028574016
Cc1oc(C[NH+](C)Cc2ccc(Br)cc2)cc1C[NH3+],C52371772_decoy,CXCR4,Decoy,0,-7.94651,-6.91,-3.21,-7.692806805393671
CCC[NH2+][C@H](Cc1[nH]cc[nH+]1)c1cc(C)ccc1F,C52982512_decoy,CXCR4,Decoy,0,-6.61818,-7.11,-2.26,-8.013374366775118
C[NH2+][C@H]1CC[C@@H](C(C)(C)C)C[C@H]1C[NH+]1CCC[C@@H]1CO,C53876062_decoy,CXCR4,Decoy,0,-8.66295,-7.21,-2.8,-3.7186775106351337
CCC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C[NH+]1CCC[C@H](O)C1,C53877456_decoy,CXCR4,Decoy,0,-9.15011,-7.42,-0.66,-13.279688480435444
CCC[C@H]1CC[C@H]([NH3+])[C@H](CN2CC[NH+](C3CC3)CC2)C1,C53880544_decoy,CXCR4,Decoy,0,-9.23885,-6.41,-0.99,-8.322836390834725
CC[NH2+][C@@H]1CC[C@@H](C(C)C)C[C@@H]1C[NH+]1CCC(O)CC1,C54559439_decoy,CXCR4,Decoy,0,-8.37733,-6.76,-0.32,-8.82740234801677
CC[NH+]1CCN(C[C@@H]2C[C@@H](C(C)C)CC[C@@H]2[NH3+])CC1,C54559455_decoy,CXCR4,Decoy,0,-9.01278,-6.24,-0.3,-8.897168179668288
C[NH2+][C@@H]1CC[C@H](C(C)C)C[C@H]1C[NH+](C)C[C@@H](C)O,C54560650_decoy,CXCR4,Decoy,0,-7.81284,-6.12,-1.32,-8.798842410728856
CC(C)C[NH+]1CCN([C@@](C)(C[NH3+])CC(C)C)CC1,C55078523_decoy,CXCR4,Decoy,0,-8.08995,-5.82,-2.21,-6.796273003546124
CC[C@H]([NH3+])[C@@H](N1CCC([NH+](C)C)CC1)C(C)(C)C,C43292793_decoy,CXCR4,Decoy,0,-7.74334,-5.93,-1.17,-7.58109796013265
COc1ccc([C@H]([C@@H](C)[NH3+])[NH+]2CCC(C)(C)CC2)cc1,C61818302_decoy,CXCR4,Decoy,0,-7.80491,-6.86,-1.22,-8.027362889144214
CCOc1ccc([C@@H](C[NH3+])[NH+]2CCC(C)(C)CC2)cc1,C61819138_decoy,CXCR4,Decoy,0,-8.26749,-6.23,-3.36,-7.310221139683295
CC(C)(C)C[C@@H](C[NH3+])N1CC[NH+](C2CCCC2)CC1,C61840074_decoy,CXCR4,Decoy,0,-7.38756,-5.98,-4.97,-6.585480511727178
CC[C@@H]([NH3+])[C@@H](c1ccco1)[NH+]1CCC(C)(CC)CC1,C62951403_decoy,CXCR4,Decoy,0,-7.4213,-6.54,-2.67,-7.603557313743753
CC[C@H]([NH3+])[C@H](c1ccc(C)o1)[NH+]1CCC(C)(CC)CC1,C62951534_decoy,CXCR4,Decoy,0,-7.99344,-6.33,-1.65,-9.29365056501426
CCC[C@@H]1CC[C@H]([NH3+])[C@H](CN2CC[C@H]([NH+](C)C)C2)C1,C62970105_decoy,CXCR4,Decoy,0,-7.76168,-6.06,-1.6,-7.466997309856191
C[NH+](C)[C@H]1CCN(C[C@@H]2C[C@@H](C(C)(C)C)CC[C@H]2[NH3+])C1,C62970120_decoy,CXCR4,Decoy,0,-7.74999,-6.78,-2.27,-7.590806089779816
Cc1ccsc1[C@H]([C@@H](C)[NH3+])N1CC[C@H]([NH+]2CCCCC2)C1,C62977728_decoy,CXCR4,Decoy,0,-7.76576,-5.98,-0.72,-6.066008606554424
C[C@H]([NH3+])[C@H](N1CC[C@H]([NH+]2CCCCC2)C1)C(C)(C)C,C62977775_decoy,CXCR4,Decoy,0,-6.39719,-6.17,-0.64,-5.842354129029028
CC[NH+](CC)[C@@H]1CCN([C@@H]2CCCCC[C@@H]2C[NH3+])C1,C62978021_decoy,CXCR4,Decoy,0,-7.34956,-6.15,-0.75,-6.725832648836274
CC[NH+](CC)[C@H]1CCN([C@@H]2CCCCC[C@@H]2C[NH3+])C1,C62978022_decoy,CXCR4,Decoy,0,-7.89501,-5.83,-1.0,-9.269268136905872
CC[NH+](CC)[C@@H]1CCN([C@]2(C[NH3+])CCCC[C@@H]2C)C1,C62978331_decoy,CXCR4,Decoy,0,-8.0996,-6.27,-1.7,-8.321370536954621
CC[C@H]1CC[C@@H]([NH3+])[C@H](N2CC[C@H]([NH+](CC)CC)C2)C1,C62978875_decoy,CXCR4,Decoy,0,-7.65254,-6.38,-1.18,-7.196316282994316
CC[C@@H]([NH3+])[C@H](c1ccc(OC)cc1)[NH+]1CCCC1(C)C,C63065876_decoy,CXCR4,Decoy,0,-7.20986,-6.19,-1.7,-7.683377428154272
C[C@@H]1C[C@@H]1c1ccc([C@@H](C[NH3+])[NH+]2CCCC2(C)C)o1,C63066305_decoy,CXCR4,Decoy,0,-7.94192,-6.9,-0.64,-7.677384822156265
CC1CC[NH+](C[C@H](O)C[NH2+]C2CCCCCC2)CC1,C66475333_decoy,CXCR4,Decoy,0,-8.4125,-6.94,-0.85,-6.952857094655602
CC(C)CNC(=O)c1ccc(NC(=O)C(F)(F)F)cc1,C04843246_decoy,CXCR4,Decoy,0,-6.19357,-8.13,-2.28,-6.936773912883827
C=CCNC(=O)NC(=O)CSc1ccc(C)c(C)c1,C03518590_decoy,CXCR4,Decoy,0,-7.35606,-8.11,-2.57,-7.430425402263965
CCCNC(=O)NC(=O)CSc1ccc(Cl)cc1,C05105846_decoy,CXCR4,Decoy,0,-7.62109,-7.14,-1.18,-10.425567381893762
C/C=C/C=C/C(=O)Nc1ccc(NC(=O)C(C)C)cc1,C15561119_decoy,CXCR4,Decoy,0,-6.78703,-8.23,-1.31,-6.899297730866887
C[C@H](Nc1ccc(F)c(F)c1)C(=O)NCc1ccco1,C20359631_decoy,CXCR4,Decoy,0,-6.85602,-7.65,-1.34,-7.889947981106403
CCc1cccc(C)c1NCC(=O)Nc1cccc(C#N)c1,C25735474_decoy,CXCR4,Decoy,0,-7.5513,-8.72,-1.99,-7.98952211144031
CNS(=O)(=O)c1ccc(N[C@@H](C)c2ccccc2)cc1,C35348830_decoy,CXCR4,Decoy,0,-7.14294,-8.09,-1.47,-8.924191204178841
Cc1ccc(OCC(=O)Nc2ccccc2)c([C@@H](C)O)c1,C35630388_decoy,CXCR4,Decoy,0,-6.9441,-7.71,-1.13,-7.787407143971397
Cc1ccc(O[C@H](C)C(=O)NNC(C)C)cc1Cl,C35653718_decoy,CXCR4,Decoy,0,-7.17485,-6.6,-0.82,-6.319183156194237
CCC[C@H](C)N(C)S(=O)(=O)c1ccc(F)c(N)c1,C36789913_decoy,CXCR4,Decoy,0,-6.67174,-6.78,-1.8,-6.909773640438113
Cc1ccc(CNc2cccc(C(=O)NC(C)C)c2)o1,C36995845_decoy,CXCR4,Decoy,0,-6.84449,-7.95,-3.72,-3.725323619574379
CCCN(CC)S(=O)(=O)c1cc(N)cc(C)c1C,C37094340_decoy,CXCR4,Decoy,0,-6.39258,-6.48,-1.03,-7.55450998141919
CCCN(C(C)C)S(=O)(=O)c1cc(C)c(C)c(N)c1,C37095489_decoy,CXCR4,Decoy,0,-7.07639,-6.59,-1.38,-7.323837130028238
CCc1ccc(N)cc1S(=O)(=O)N(C)CC(C)C,C37098897_decoy,CXCR4,Decoy,0,-6.41079,-6.95,-1.28,-7.935281208511609
CC[C@@H](C)CN(C)S(=O)(=O)c1ccc(Cl)c(N)c1,C37172518_decoy,CXCR4,Decoy,0,-6.88163,-6.67,-0.72,-3.834932717663465
Cc1cc(N)ccc1SCc1nc(CC(C)C)no1,C37193513_decoy,CXCR4,Decoy,0,-7.41191,-7.51,-2.76,-3.565257710441106
CS(=O)(=O)Nc1ccc(NC[C@@H]2C[C@@H]3C=C[C@H]2C3)cc1,C37304216_decoy,CXCR4,Decoy,0,-7.64181,-7.77,-1.58,-4.498991525147028
CCCCS(=O)(=O)Nc1ccc(C#CCO)cc1C,C37552511_decoy,CXCR4,Decoy,0,-8.32414,-6.29,-2.07,-3.510733659328372
C[C@H](NC[C@H](O)c1ccc2c(c1)OCO2)c1cccs1,C37890319_decoy,CXCR4,Decoy,0,-8.24384,-7.47,-4.65,-8.752865640645705
C[C@H](Oc1cccc(F)c1)C(=O)Nc1cccc(CO)c1,C38003658_decoy,CXCR4,Decoy,0,-6.452,-7.47,-1.91,-6.975466943075116
CC(C)C[C@@H](C)NS(=O)(=O)c1ccc2c(c1)CCN2,C37265516_decoy,CXCR4,Decoy,0,-7.31815,-7.22,-2.05,-3.5255368884276788
C=C(C)CN(CC)S(=O)(=O)c1ccc(Cl)c(N)c1,C40316412_decoy,CXCR4,Decoy,0,-7.07152,-7.02,-3.15,-3.3635888714103186
COc1ccc(OC)c([C@H](N)c2nc(C(C)C)cs2)c1,C41182970_decoy,CXCR4,Decoy,0,-7.34378,-7.62,-1.36,-8.964488191797944
Cc1ccc(C(=O)c2ccc(OCC(N)=O)cc2)cc1C,C41440643_decoy,CXCR4,Decoy,0,-6.75995,-7.56,-0.68,-6.111908702371372
CC[C@@H](C)NC(=O)CCn1ccc2c1CC(C)(C)C[C@H]2O,C41710012_decoy,CXCR4,Decoy,0,-7.5096,-6.86,-1.29,-6.902996720370612
Cc1ccc([C@H](C)[NH2+][C@](C)(C(=O)[O-])c2ccccc2)o1,C41812958_decoy,CXCR4,Decoy,0,-6.05081,-7.03,-2.78,-6.884989250174977
C#CCNC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1,C46906616_decoy,CXCR4,Decoy,0,-5.73157,-7.53,-2.88,-3.476602856930316
CCN(C(=O)COc1ccccc1N)c1ccc(F)cc1,C48410977_decoy,CXCR4,Decoy,0,-7.06068,-7.43,-2.73,-8.986734164339447
COCCNC(=O)N[C@H](C)c1ccc(Cl)cc1Cl,C48727722_decoy,CXCR4,Decoy,0,-7.97776,-6.74,-1.16,-8.605683454050258
Cc1ccc([C@H](C)NC(=O)N[C@@H](C)Cc2ccsc2)o1,C48858677_decoy,CXCR4,Decoy,0,-7.83114,-6.61,-4.07,-7.229965269380636
CC[C@H](C)[C@@H](C)NC(=O)c1ccc(OC)c(C#CCO)c1,C49105477_decoy,CXCR4,Decoy,0,-8.06658,-5.6,-1.86,-6.828231367726849
CC[C@H](NC(=O)N[C@@H](C)c1sc(C)nc1C)C(C)C,C49247623_decoy,CXCR4,Decoy,0,-7.8937,-6.82,-2.28,-7.393949388438813
CC[C@H](NC(=O)C(=O)Nc1cc(C)cc(C)c1)C(C)C,C49274574_decoy,CXCR4,Decoy,0,-7.77552,-8.25,-1.42,-4.060768424933875
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(C)c(C)s1,C49430295_decoy,CXCR4,Decoy,0,-7.38913,-6.99,-1.6,-3.55404417929634
CCC[C@@H](NC(=O)NC(=O)CCl)c1cccs1,C49549046_decoy,CXCR4,Decoy,0,-7.4446,-5.84,-2.63,-8.155451954399691
COc1ccc(C#CCO)cc1NC(=O)CCC(C)C,C49589018_decoy,CXCR4,Decoy,0,-7.64087,-6.55,-3.01,-8.290841467043387
Cc1nn(CCCOc2ccc(N)cc2)c(C)c1Cl,C50585859_decoy,CXCR4,Decoy,0,-6.71904,-7.2,-0.78,-5.90885484910254
CCN(CC)C(=O)[C@H](C)Oc1cc(Cl)ccc1N,C51609263_decoy,CXCR4,Decoy,0,-6.93387,-6.32,-1.04,-7.902266812832844
CCNc1ccc(Cl)cc1C(=O)NCc1ccc(C)o1,C53043773_decoy,CXCR4,Decoy,0,-7.62563,-7.87,-1.84,-10.80272869640532
COc1ccc(NC(=S)Nc2cc(C)cc(C)c2)cn1,C16238098_decoy,CXCR4,Decoy,0,-7.48922,-7.9,-1.83,-10.33483388771413
COc1ccc(NC(=S)Nc2cccc(C)c2C)cn1,C07529795_decoy,CXCR4,Decoy,0,-6.9219,-8.25,-1.39,-8.268957805138468
Nc1ccccc1OCCc1nc(-c2ccco2)cs1,C58009022_decoy,CXCR4,Decoy,0,-7.41385,-5.36,-2.46,-5.156177758218382
Cc1ccc(S(=O)(=O)N(CC(C)C)C(C)C)c(N)c1,C42270188_decoy,CXCR4,Decoy,0,-6.52643,-6.75,-0.86,-8.008380337240457
Cc1cc(N)ccc1S(=O)(=O)N(CC(C)C)C(C)C,C40319106_decoy,CXCR4,Decoy,0,-6.44289,-6.66,-1.39,-7.0898085949771925
COc1ccc([C@@H](NC(=O)c2ccc[nH]2)C(C)C)cc1,C61211091_decoy,CXCR4,Decoy,0,-6.33451,-7.11,-1.69,-6.439013622495366
CC(C)NS(=O)(=O)Nc1ccc(C(F)(F)F)cc1,C62139613_decoy,CXCR4,Decoy,0,-6.41083,-7.28,-1.54,-6.81949138646219
CCNc1c(F)cc(C(=O)N[C@@H](C)c2ccco2)cc1F,C63005364_decoy,CXCR4,Decoy,0,-6.86223,-7.55,-3.24,-7.205214355488058
CNC(=O)[C@H](CC(C)C)NC(=O)c1ccc(F)c(C)c1,C63060605_decoy,CXCR4,Decoy,0,-5.60036,-6.69,-3.34,-2.887860275165374
CCCN(CCO)C(=O)Nc1ccc(C)cc1Cl,C65547593_decoy,CXCR4,Decoy,0,-6.96313,-7.14,-0.87,-11.012924170461472
CCC[C@@H](C)C(=O)Nc1cc(NC(C)=O)c(F)cc1F,C66285149_decoy,CXCR4,Decoy,0,-7.28965,-7.52,-1.04,-8.128834392425528
CC[NH+](CC)CCC[C@H](C)Nc1cc[nH+]c2cc(I)ccc12,C01700322_decoy,CXCR4,Decoy,0,-8.84289,-7.13,-1.33,-8.92018709652455
CC[NH+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](C23CC4CC(CC(C4)C2)C3)CC1,C12112286_decoy,CXCR4,Decoy,0,-9.64435,-8.24,-2.37,-7.959204640616547
CCOC(=O)c1s/c(=[NH+]\c2ccc(OC)cc2)n(N2CC[NH+](C)CC2)c1C,C27525528_decoy,CXCR4,Decoy,0,-8.56954,-6.7,-1.92,-6.853653045934034
COc1ccc([C@H]2CC(c3ccc(F)cc3)=NN2C(=O)C[NH+](C)C2CC[NH+](C)CC2)c(OC)c1,C35786574_decoy,CXCR4,Decoy,0,-8.30085,-7.52,-2.17,-7.476394200074288
O=C1[NH+]=c2ccc(S(=O)(=O)Oc3ccc(C4CCCCC4)cc3)cc2=[NH+]C1=O,C25147040_decoy,CXCR4,Decoy,0,-7.35388,-8.11,-0.68,-6.511715128287153
CCOc1cc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)cc(Br)c1O,C39351030_decoy,CXCR4,Decoy,0,-9.9231,-6.68,-1.44,-7.018589676593514
Cc1cc(/C=C(/C(=O)c2ccccc2)C2[NH+]=c3ccccc3=[NH+]2)c(C)n1-c1ccccc1,C39703092_decoy,CXCR4,Decoy,0,-7.81543,-9.7,-2.08,-8.209552617690285
COc1cc(/C=N/c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)ccc1OC(=O)c1ccc(Cl)cc1,C39707424_decoy,CXCR4,Decoy,0,-8.67935,-7.25,-1.31,-7.936346483817701
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/[C@@H]1CN(Cc3ccccc3C#N)c3ccccc31)[NH+]=2,C39934816_decoy,CXCR4,Decoy,0,-9.98282,-8.69,-0.97,-7.879417965053728
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,C39934956_decoy,CXCR4,Decoy,0,-8.0936,-9.42,-2.16,-8.068465813315816
COc1ccc2c(c1)=[NH+][C@H](/C(C#N)=C/c1cc(C)n([C@@H]3S[C@@H]4CCCCC4=C3C#N)c1C)[NH+]=2,C39934968_decoy,CXCR4,Decoy,0,-9.50748,-7.7,-5.11,-4.181682297899826
CCOC(=O)c1ccc(-n2c(C)cc(/C=C(/C#N)C3[NH+]=c4ccccc4=[NH+]3)c2C)cc1,C39943294_decoy,CXCR4,Decoy,0,-8.39223,-7.95,-1.95,-6.752879611842774
C[C@H]1C=C(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)[C@H](C)N1c1cccc([N+](=O)[O-])c1,C39943301_decoy,CXCR4,Decoy,0,-8.67664,-7.27,-1.33,-3.804588910387229
CCOc1cc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)cc(Br)c1OC(C)=O,C39964565_decoy,CXCR4,Decoy,0,-8.36961,-8.99,-3.18,-8.397145398448558
COc1cc(N2CCCC2)c(OC)cc1/C=C(/C#N)[C@@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39964875_decoy,CXCR4,Decoy,0,-9.72169,-7.72,-2.57,-4.018187554035014
CCOc1cc(/C=C(/C#N)[C@H]2[NH+]=c3ccc(OC)cc3=[NH+]2)cc(I)c1OC,C39969117_decoy,CXCR4,Decoy,0,-9.00159,-8.4,-1.61,-10.968716029117532
CCOC(=O)c1ccccc1N1[C@@H](C)C=C(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1C,C39973233_decoy,CXCR4,Decoy,0,-8.27957,-9.4,-2.38,-7.705051526719915
CC(C)C[C@H](C[NH+](C)C)[NH2+]Cc1cc(Br)c(Br)o1,C50360702_decoy,CXCR4,Decoy,0,-8.88796,-5.83,-1.28,-10.303381855563586
COc1ccc(C(=O)[C@@H]2C[C@H]2C[NH+]2CC=C(C3=c4c(Br)cccc4=[NH+]C3)CC2)cc1,C52565469_decoy,CXCR4,Decoy,0,-9.89497,-8.76,-1.68,-8.273487251408508
COc1ccc([C@H]2CCCCCN2S(=O)(=O)c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)cc1,C39773984_decoy,CXCR4,Decoy,0,-7.95144,-7.58,-3.39,-3.4332359691922925
O=C(C[NH+]1CCC(C2=c3ccccc3=[NH+]C2)CC1)Nc1cc(Cl)ccc1Cl,C63098907_decoy,CXCR4,Decoy,0,-9.4713,-9.95,-1.58,-9.17430906332114
C[C@H](C(=O)Nc1ccc(Cl)cc1F)[NH+]1CCC(C2=c3ccccc3=[NH+]C2)CC1,C63098944_decoy,CXCR4,Decoy,0,-8.18895,-7.15,-4.92,-3.347690594317391
Cc1ccc(O[C@H]2N=C3C=CC=CN3C(=O)[C@@H]2/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1,C39747215_decoy,CXCR4,Decoy,0,-8.04921,-9.73,-1.18,-8.01579112645347
N#C/C(=C\[C@H]1C(=O)N2C=CC=CC2=N[C@H]1Oc1ccc(Cl)cc1)C1[NH+]=c2ccccc2=[NH+]1,C39747221_decoy,CXCR4,Decoy,0,-8.82615,-7.89,-1.46,-7.348610410581243
Cc1cc(O[C@H]2N=C3C=CC=CN3C(=O)[C@@H]2/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)ccc1Cl,C39747247_decoy,CXCR4,Decoy,0,-9.70341,-8.32,-3.13,-8.633743649549986
Cc1cc(C)cc(O[C@H]2N=C3C=CC=CN3C(=O)[C@@H]2/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)c1,C39747255_decoy,CXCR4,Decoy,0,-8.52517,-8.67,-2.1,-8.2761723138431
COc1ccc(OC)c(-c2noc(CS[C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)n2)c1,C63217227_decoy,CXCR4,Decoy,0,-8.19707,-9.12,-4.39,-4.018571576371868
CCOCN(C(=O)CS[C@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1)c1c(C)cccc1CC,C63234462_decoy,CXCR4,Decoy,0,-10.0118,-8.24,-1.12,-11.245382906854072
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]=2,C63258784_decoy,CXCR4,Decoy,0,-10.3156,-8.26,-1.62,-8.74474591300729
O=C1CC2(CCCCC2)Oc2cc(OCC(=O)N3CCC(C4[NH+]=c5ccccc5=[NH+]4)CC3)ccc21,C63279861_decoy,CXCR4,Decoy,0,-8.9463,-10.94,-2.23,-8.046338103541004
COc1ccc(N2C(=O)C3=C4CCCC[C@H]4SC3=N[C@H]2SCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63297488_decoy,CXCR4,Decoy,0,-8.57249,-8.99,-1.11,-8.468726004651407
COCCN1C(=O)c2ccccc2[C@H](C(=O)N=C2[NH+]=c3ccccc3=[NH+]2)C12CCCCC2,C20744388_decoy,CXCR4,Decoy,0,-9.12941,-8.78,-5.0,-4.182031004701006
O=C(COc1ccc2c(-c3ccccc3)cc(=O)oc2c1)N=C1[NH+]=c2ccccc2=[NH+]1,C06664489_decoy,CXCR4,Decoy,0,-8.69998,-8.68,-1.74,-7.6480341403215615
Clc1ccccc1CN1C[C@H](C[NH2+]CCC2=c3ccccc3=[NH+]C2)c2ccccc21,C63393447_decoy,CXCR4,Decoy,0,-9.93937,-8.39,-1.5,-8.639727102545208
Cc1cc(C)cc(OCC(=O)Nc2cc(C3[NH+]=c4ccccc4=[NH+]3)ccc2C)c1,C63393615_decoy,CXCR4,Decoy,0,-8.5094,-6.85,-1.56,-6.925582392182817
CCCOc1cccc(C(=O)Nc2cc(C3[NH+]=c4ccccc4=[NH+]3)ccc2C)c1,C63406144_decoy,CXCR4,Decoy,0,-7.97805,-7.16,-3.6,-3.611341803564633
Cc1cc(OCC(=O)Nc2ccc(C3[NH+]=c4ccccc4=[NH+]3)cc2)cc(C)c1Cl,C63409591_decoy,CXCR4,Decoy,0,-8.99949,-9.02,-2.41,-8.225593922375047
C[C@H]1[NH+]=c2ccc(OC(F)(F)F)cc2=C1CC[NH2+]Cc1cc(F)c(F)c(F)c1,C63514343_decoy,CXCR4,Decoy,0,-7.06856,-9.64,-3.02,-6.8463484676428665
CCc1cccc(C)c1N(C(=O)CS[C@@H]1[NH+]=c2ccc(C)cc2=[NH+]1)[C@H](C)COC,C63576328_decoy,CXCR4,Decoy,0,-8.70886,-8.08,-1.64,-9.165758411643845
CCOCN(C(=O)CS[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1)c1c(C)cccc1CC,C63576336_decoy,CXCR4,Decoy,0,-9.41355,-8.34,-3.01,-9.17604533293259
CCOc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]=2,C63625906_decoy,CXCR4,Decoy,0,-9.18833,-7.92,-1.24,-7.891557392412093
Cc1ccc(CN2C(=O)c3sccc3N[C@@H]2SCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63709740_decoy,CXCR4,Decoy,0,-9.17999,-7.79,-2.95,-3.660819421946965
COc1ccc2c(c1)=[NH+][C@@H](SCC(=O)NC(c1ccccc1)c1ccccc1)[NH+]=2,C63731508_decoy,CXCR4,Decoy,0,-9.68876,-6.58,-1.62,-6.368739383867135
Cc1cc2c(cc1C)=[NH+][C@@H](CSc1ccc(NC(=O)c3cccs3)cc1)C(=O)[NH+]=2,C63751575_decoy,CXCR4,Decoy,0,-9.92819,-7.35,-1.05,-7.455014360219713
Cc1cc2c(cc1C)=[NH+][C@@H](CSc1ccc(NC(=O)Cc3ccc(F)cc3)cc1)C(=O)[NH+]=2,C63751656_decoy,CXCR4,Decoy,0,-9.69374,-9.67,-4.5,-8.848409981786894
COc1ccc([C@@H](C[NH2+][C@@H](C)C(=O)N2CCc3ccccc32)C2=c3ccccc3=[NH+]C2)cc1,C63830798_decoy,CXCR4,Decoy,0,-7.91636,-8.59,-0.79,-8.738345139215399
Cc1ccccc1N1N=C[C@@H]2[C@H]1CC(C)(C)C[C@H]2[NH2+]CC1=c2ccccc2=[NH+]C1,C64103343_decoy,CXCR4,Decoy,0,-8.42713,-10.06,-0.92,-7.528012835444599
N#C[C@H](C(=O)[C@@H]1Sc2cc([N+](=O)[O-])ccc2[C@H]1Cl)C1[NH+]=c2ccccc2=[NH+]1,C64198764_decoy,CXCR4,Decoy,0,-9.13821,-7.32,-1.4,-6.90501910252605
O=C(NCCC(c1ccccc1)c1ccccc1)[C@H]1CC12CC[NH+](C[C@H]1C=c3ccccc3=[NH+]1)CC2,C64609994_decoy,CXCR4,Decoy,0,-9.88968,-9.02,-2.09,-9.000247848390334
COc1c(F)c(F)c(C(=O)Nc2ccc(C3[NH+]=c4ccccc4=[NH+]3)cc2)c(F)c1F,C65548009_decoy,CXCR4,Decoy,0,-6.77167,-9.02,-1.73,-5.8290328599948165
CCC[NH+]1CCC([NH+]2CCC[C@H](C(=O)N3CCCCCC3)C2)CC1,C00212638_decoy,CXCR4,Decoy,0,-8.1403,-6.65,-3.16,-6.152235236007877
C1CCC([NH+]2CCC(C[NH+](C[C@H]3CCCO3)C3CCOCC3)CC2)C1,C12314148_decoy,CXCR4,Decoy,0,-8.82747,-7.04,-3.23,-3.5742157443643205
O=C(C1CCCC1)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[NH+](C2CCCC2)C1,C14949827_decoy,CXCR4,Decoy,0,-9.4128,-7.73,-1.86,-9.58984197130084
O=C1/C(=C/C2[NH+]=c3ccccc3=[NH+]2)SC(=S)N1c1ccc(Cl)c(Cl)c1,C38567859_decoy,CXCR4,Decoy,0,-8.93885,-8.09,-2.18,-6.1453967414646655
CC1C/C(=C\C2=c3ccccc3=[NH+]C2)C(=O)/C(=C/C2=c3ccccc3=[NH+]C2)C1,C38610745_decoy,CXCR4,Decoy,0,-9.35995,-10.35,-3.12,-8.548705581119558
N#C/C(=C\c1ccc2oc3ccccc3c2c1)C1[NH+]=c2ccccc2=[NH+]1,C38783281_decoy,CXCR4,Decoy,0,-8.58124,-9.1,-1.01,-6.999466976364396
COc1cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)ccc1OCc1ccccc1C,C38818801_decoy,CXCR4,Decoy,0,-8.70283,-6.7,-1.75,-6.264136922203245
CCSc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1,C39035004_decoy,CXCR4,Decoy,0,-8.03829,-7.89,-2.17,-7.005015260147367
Cc1ccccc1N1C(=O)/C(=C\C2[NH+]=c3ccccc3=[NH+]2)SC1=S,C39156562_decoy,CXCR4,Decoy,0,-8.7706,-8.35,-0.84,-7.215326219477517
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1cc(Cl)ccc1OCc1c(F)cccc1Cl)[NH+]=2,C39205969_decoy,CXCR4,Decoy,0,-10.0432,-8.38,-1.74,-9.12017801059632
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1ccc(OC(=O)c3cc(F)c(F)cc3Cl)cc1)[NH+]=2,C39210346_decoy,CXCR4,Decoy,0,-9.07253,-9.55,-2.1,-8.06938799505672
COc1cc(/C=C(\C#N)[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)ccc1OCc1ccccc1,C39252990_decoy,CXCR4,Decoy,0,-7.25396,-7.75,-1.28,-6.658392573308023
O=C1C[C@H](C2[NH+]=c3cc4ccccc4cc3=[NH+]2)CN1c1ccc(Cl)cc1,C39312162_decoy,CXCR4,Decoy,0,-9.53991,-9.1,-2.61,-7.355493209611087
N#C/C(=C/c1cccn1-c1ccc(Cl)cc1)C1[NH+]=c2ccccc2=[NH+]1,C39322128_decoy,CXCR4,Decoy,0,-8.10163,-8.6,-1.95,-7.477409757708157
C=CCn1cc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(OC)cc3=[NH+]2)c2ccccc21,C39353272_decoy,CXCR4,Decoy,0,-9.18143,-7.45,-1.58,-6.161136163551824
N#C/C(=C\c1ccc(I)cc1)C1[NH+]=c2ccccc2=[NH+]1,C39357234_decoy,CXCR4,Decoy,0,-8.54205,-6.47,-2.55,-6.269591454218613
COc1c(Br)cc(C2[NH+]=NN=[NH+]2)cc1Br,C39364928_decoy,CXCR4,Decoy,0,-8.18629,-7.41,-1.12,-3.266462927419355
CCCOc1c(I)cc(/C=C(\C#N)C2[NH+]=c3cc(C)c(C)cc3=[NH+]2)cc1OC,C39370823_decoy,CXCR4,Decoy,0,-9.96829,-7.31,-1.75,-7.076830130297467
Cc1ccc2c(c1)=[NH+][C@H](/C(C#N)=C/c1ccccc1OCc1ccc(Cl)cc1Cl)[NH+]=2,C39443787_decoy,CXCR4,Decoy,0,-9.18578,-8.38,-1.58,-7.993593420533381
CCCOc1ccc(Cl)cc1/C=C(/C#N)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39582615_decoy,CXCR4,Decoy,0,-8.52771,-7.62,-3.64,-8.267300401880357
CCOc1ccc(/C=N/c2ccccc2[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1,C39588286_decoy,CXCR4,Decoy,0,-8.26242,-8.08,-0.59,-8.001300103164997
N#C/C(=C\c1cc2c(cc1Br)OCO2)C1[NH+]=c2ccccc2=[NH+]1,C39699914_decoy,CXCR4,Decoy,0,-8.84092,-7.76,-1.78,-3.3220522429964188
COc1cccc(/C=C(\C#N)[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)c1OCc1ccc(Cl)cc1Cl,C39702827_decoy,CXCR4,Decoy,0,-9.51167,-6.72,-0.94,-6.663125214203639
N#C/C(=C\c1cn(Cc2ccc(Cl)cc2Cl)nc1-c1ccccc1)C1[NH+]=c2ccccc2=[NH+]1,C39703024_decoy,CXCR4,Decoy,0,-9.8803,-9.91,-0.87,-8.372340746355613
Cc1ccc2c(c1)=[NH+][C@H](/C(C#N)=C/c1cccc(Br)c1)[NH+]=2,C39703048_decoy,CXCR4,Decoy,0,-8.1558,-8.53,-1.2,-10.57887828091434
C=CCOc1ccc(Br)cc1/C=C(/C#N)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39732664_decoy,CXCR4,Decoy,0,-8.23126,-7.24,-2.79,-7.496529288198342
COc1cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)cc(Cl)c1OCc1ccccc1,C39934652_decoy,CXCR4,Decoy,0,-8.39588,-6.82,-1.5,-6.042858325845416
COc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1cc(Br)cs1)[NH+]=2,C39935001_decoy,CXCR4,Decoy,0,-10.0012,-7.29,-0.67,-6.772759107360791
Brc1ccc(/C=[NH+]/CCCC/[NH+]=C/c2ccc(Br)cc2)cc1,C16400322_decoy,CXCR4,Decoy,0,-8.97002,-5.31,-3.14,-5.632425487341889
Clc1ccc(/C=[NH+]/CCCC/[NH+]=C/c2ccc(Cl)c(Cl)c2)cc1Cl,C16384261_decoy,CXCR4,Decoy,0,-10.1981,-6.62,-1.11,-9.285544325578934
Cc1cccn2cc(C[NH+](Cc3ccc([C@@H]4C[C@@H]4C)o3)C3CC3)[nH+]c12,C59372516_decoy,CXCR4,Decoy,0,-8.15818,-8.65,-1.8,-3.8317372826951424
COc1cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)ccc1OCc1ccccc1,C39794833_decoy,CXCR4,Decoy,0,-7.96042,-8.11,-2.41,-9.175931145738025
C[C@@H]1CC[C@H](C(C)(C)C)[C@H](OC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)C1,C63234683_decoy,CXCR4,Decoy,0,-8.73997,-7.7,-1.38,-7.969685961203136
C/[NH+]=C1\SC[C@@H](C)N1/N=C/C1=c2cc(Br)ccc2=[NH+]C1,C39946569_decoy,CXCR4,Decoy,0,-9.17724,-6.72,-1.92,-6.398465501499054
COc1ccc(C(=O)[C@@H](C)SC2[NH+]=c3cc(C)c(C)cc3=[NH+]2)cc1,C63398383_decoy,CXCR4,Decoy,0,-7.47097,-8.1,-2.58,-3.558442103462361
COc1ccc2c(c1)=[NH+][C@@H]1C(N3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)=[NH+]C=NC=21,C63426747_decoy,CXCR4,Decoy,0,-9.06109,-8.66,-1.5,-7.089396393493964
COc1ccc2c(c1)=[NH+][C@@H]1C(N3C[C@]4(C)C[C@H]3CC(C)(C)C4)=[NH+]C=NC=21,C63426748_decoy,CXCR4,Decoy,0,-8.49506,-7.96,-0.53,-6.634996465977995
COc1cccc2c1=C1N=C[NH+]=C(N3C[C@]4(C)C[C@H]3CC(C)(C)C4)[C@H]1[NH+]=2,C63437214_decoy,CXCR4,Decoy,0,-8.62063,-8.3,-1.2,-10.248799666122014
O=S(=O)(c1ccc(F)cc1)N1CCC[C@H]1C1[NH+]=c2ccccc2=[NH+]1,C63491511_decoy,CXCR4,Decoy,0,-7.58705,-8.54,-5.28,-6.792637990105071
C[C@H]1c2cc(Br)ccc2O[C@@H]1C(=O)N1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1,C63493792_decoy,CXCR4,Decoy,0,-9.25183,-7.81,-2.54,-6.572963967582695
Ic1ccc(CSC2[NH+]=c3ccccc3=[NH+]2)cc1,C63503155_decoy,CXCR4,Decoy,0,-7.34823,-6.64,-1.05,-4.834468058469483
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)O[C@@H]1C[C@@H]3CC[C@@]1(C)C3(C)C)[NH+]=2,C63558068_decoy,CXCR4,Decoy,0,-9.0347,-7.03,-2.13,-7.017220053232218
Brc1ccc(CSC2[NH+]=c3ccccc3=[NH+]2)c(Br)c1,C63637956_decoy,CXCR4,Decoy,0,-8.86926,-6.08,-1.14,-7.151566526921574
Cc1ccc(C2=Nc3ccccc3S[C@H]2C2[NH+]=c3ccccc3=[NH+]2)cc1,C63674217_decoy,CXCR4,Decoy,0,-8.31976,-9.72,-1.63,-8.724988819368846
C[C@@H](S[C@@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1)C(=O)N1CCCCCC1,C63730994_decoy,CXCR4,Decoy,0,-8.22071,-7.55,-2.91,-3.672922846424656
COc1ccc2c(c1)=C(C)[C@@H]([C@@H]1C[C@H]3CN(C)C(=O)[C@]34CCC[NH+]14)[NH+]=2,C64006353_decoy,CXCR4,Decoy,0,-8.52055,-8.79,-1.19,-7.763134802391546
Cc1ccc2c(c1)[C@H](C)[C@H](C(=O)N1CCC([C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)CC1)O2,C64083881_decoy,CXCR4,Decoy,0,-6.87177,-6.88,-0.94,-4.537746452617573
Cc1ccc(C2=NN=C[C@@H]2CN(C)C[C@@H]2[NH+]=c3ccc(F)cc3=[NH+]2)cc1C,C64120658_decoy,CXCR4,Decoy,0,-8.39187,-8.28,-1.07,-7.962395086622277
O=C1[NH+]=c2ccc(C(=O)/C=C/c3cccc(Br)c3)cc2=[NH+]1,C64353795_decoy,CXCR4,Decoy,0,-8.48854,-8.8,-1.61,-7.241755321782434
CC(C)COc1ccc(C(=O)N2CCC(C3[NH+]=c4ccccc4=[NH+]3)CC2)cc1,C64480121_decoy,CXCR4,Decoy,0,-8.08657,-9.13,-1.87,-7.254962884571698
CC1=C2C[C@H]3[C@@H](C[C@@]2(C)CCC1)OC(=O)[C@@H]3C[NH+]1CCC([NH+]2CCCCC2)CC1,C04086592_decoy,CXCR4,Decoy,0,-10.0309,-9.36,-1.28,-8.575824914200508
CC1=CCC[C@]2(C)C[C@H]3OC(=O)[C@H](C[NH+]4CCC([NH+]5CCCCC5)CC4)[C@H]3C=C12,C04087517_decoy,CXCR4,Decoy,0,-9.025,-7.42,-0.89,-6.213287890967127
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]([NH+]1CCC([NH+]3CCCC3)CC1)CO2,C06747707_decoy,CXCR4,Decoy,0,-8.65021,-7.71,-1.52,-3.6874618283520286
COc1ccc(-c2nn(-c3ccccc3)cc2C[NH+]2CC[C@]3(CC[NH+](C)C3)C2)c(F)c1,C11873975_decoy,CXCR4,Decoy,0,-8.20734,-7.83,-0.65,-8.010159362936296
CCOC(=O)N1CCC([NH+]2CC[C@]3(CCC[NH+](CC(C)(C)C)C3)C2)CC1,C12208671_decoy,CXCR4,Decoy,0,-8.43265,-8.1,-0.54,-7.593686976412022
COc1ccc(F)c(C[NH+]2CCC[C@]3(CC[NH+](C/C=C/c4ccco4)C3)C2)c1,C12298839_decoy,CXCR4,Decoy,0,-8.32258,-8.69,-2.5,-8.174251796932548
CC(=O)N1CCC([NH+]2CC[C@]3(CCC[NH+](CC4CCCCC4)C3)C2)CC1,C12458005_decoy,CXCR4,Decoy,0,-9.42945,-8.93,-1.72,-3.988754407547698
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](C[NH+](C)C4CC[NH+](C)CC4)[C@H]3C=C12,C12659844_decoy,CXCR4,Decoy,0,-9.6678,-7.34,-3.66,-3.346050029970883
CCOC(=O)N1CCC([NH+]2CC[C@@]3(CCC[NH+](CC4CCCCC4)C3)C2)CC1,C15073701_decoy,CXCR4,Decoy,0,-8.81011,-8.62,-0.84,-7.522927969144917
O=C1/C(=C/C2[NH+]=c3ccccc3=[NH+]2)SC(=S)N1c1ccccc1Br,C38567863_decoy,CXCR4,Decoy,0,-9.29347,-7.4,-1.02,-6.407505983100938
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@@H]1Cl)c1ccc(Cl)s1,C39016643_decoy,CXCR4,Decoy,0,-8.63001,-6.99,-2.33,-7.410290911401529
Cc1ccc(N2C(=O)/C(=C\C3[NH+]=c4ccccc4=[NH+]3)SC2=S)cc1C,C39156564_decoy,CXCR4,Decoy,0,-8.72927,-9.62,-2.5,-7.217612598885461
O=C1/C(=C\C2[NH+]=c3ccccc3=[NH+]2)SC(=S)N1c1cccc(F)c1,C39156590_decoy,CXCR4,Decoy,0,-8.7185,-7.68,-1.05,-6.123389432450401
CC1=C(C#N)[C@H](n2c(C)cc(/C=C(/C#N)C3[NH+]=c4ccccc4=[NH+]3)c2C)O[C@H]1C,C39357320_decoy,CXCR4,Decoy,0,-8.07081,-8.49,-0.8,-6.739311177306748
CC1=C(C#N)[C@@H](n2c(C)cc(/C=C(\C#N)C3[NH+]=c4ccccc4=[NH+]3)c2C)O[C@@H]1C,C39370766_decoy,CXCR4,Decoy,0,-8.68128,-8.75,-4.57,-3.517715486968164
CCOC(=O)Cn1cc(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C39370804_decoy,CXCR4,Decoy,0,-8.64653,-8.55,-2.6,-9.453171000951809
C[C@H](OC(=O)C1=c2ccccc2=[NH+]C(=O)C1)C(=O)C1=c2ccccc2=[NH+][C@@H]1C,C39727085_decoy,CXCR4,Decoy,0,-8.35587,-7.44,-0.83,-5.562305067704931
C[C@H](c1ccccc1)N1C(=O)/C(=C\C2[NH+]=c3ccccc3=[NH+]2)SC1=S,C39909851_decoy,CXCR4,Decoy,0,-7.97547,-7.37,-2.04,-6.278599121408206
COc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1ccc(N3CCOCC3)cc1)[NH+]=2,C39934927_decoy,CXCR4,Decoy,0,-7.28571,-8.71,-3.05,-6.0181114337087465
Cc1ccc(C)c(C[NH+](Cc2nc(C(=O)N3CC[NH+](C)CC3)co2)C(C)C)c1,C40402405_decoy,CXCR4,Decoy,0,-7.70297,-7.04,-1.24,-6.86403444229336
CC[NH+]1CCN(CC(=O)N2CC[C@@]3(CCC[NH+](CC4CCCCC4)C3)C2)CC1,C23358062_decoy,CXCR4,Decoy,0,-8.68208,-8.94,-1.93,-8.018695812649524
CCOc1cc(/C=C/C(=O)c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)cc(Cl)c1OC,C39760316_decoy,CXCR4,Decoy,0,-10.2253,-8.47,-4.33,-4.620894274722507
O=C1[NH+]=c2ccc(S(=O)(=O)N3CCc4sccc4[C@@H]3c3ccccc3)cc2=[NH+]1,C12770576_decoy,CXCR4,Decoy,0,-7.70315,-7.74,-1.78,-9.12327826730316
CCOc1ccc(N2C(=O)C[C@H](SCC3[NH+]=c4ccccc4=[NH+]3)C2=O)cc1,C63099025_decoy,CXCR4,Decoy,0,-8.32381,-8.85,-2.9,-3.904865087260928
COc1ccc(N2C(=O)C[C@H](SCCC3[NH+]=c4ccccc4=[NH+]3)C2=O)cc1,C63099029_decoy,CXCR4,Decoy,0,-7.9025,-7.62,-1.74,-6.8588887091830175
COc1ccc(C(=O)CS[C@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)cc1OC,C63166690_decoy,CXCR4,Decoy,0,-9.82277,-7.94,-4.52,-7.88227084799471
Cc1[nH+]c(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2C)n(C2CCCC2)c1C,C39939348_decoy,CXCR4,Decoy,0,-9.26523,-8.76,-1.79,-8.459835815249443
COc1ccc(N2CCN(C(=O)c3ccc4c(c3)=[NH+][C@@H](C(F)(F)F)[NH+]=4)CC2)cc1,C63280872_decoy,CXCR4,Decoy,0,-6.45397,-6.9,-1.19,-2.7727572344898195
O=C(Cn1ccc2c(Br)cccc21)N=C1[NH+]=c2ccccc2=[NH+]1,C39980400_decoy,CXCR4,Decoy,0,-8.18607,-7.83,-2.34,-3.2492468409780617
O=C(N=C1[NH+]=c2ccccc2=[NH+]1)[C@@H]1CC(=O)N(c2ccccc2Br)C1,C32095105_decoy,CXCR4,Decoy,0,-8.647,-9.5,-4.46,-7.240673618960313
O=C(N=C1[NH+]=c2ccccc2=[NH+]1)c1ccc2nc(C(F)(F)F)sc2c1,C20719763_decoy,CXCR4,Decoy,0,-8.20432,-6.66,-3.92,-5.626973837116907
CCOc1ccc2c(c1)=C1N=C[NH+]=C(N3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)[C@@H]1[NH+]=2,C63432231_decoy,CXCR4,Decoy,0,-9.1032,-9.35,,99.0
CCOc1ccc(-c2nc(CS[C@@H]3[NH+]=c4cccnc4=[NH+]3)c(C)o2)cc1,C63558205_decoy,CXCR4,Decoy,0,-8.4939,-7.58,-2.05,-7.040812645989398
Cc1ccc2c(c1)=[NH+][C@@H](SC[C@@H]1N=C3C=CC=CN3[C@H]1Br)[NH+]=2,C63668986_decoy,CXCR4,Decoy,0,-8.60231,-7.97,-1.28,-8.034861183360407
O=C(C1CCN(C2[NH+]=c3ccccc3=[NH+]2)CC1)N1CCN(c2cccc(Cl)c2)CC1,C63694921_decoy,CXCR4,Decoy,0,-9.7422,-9.36,-2.93,-6.912279803468173
O=C(c1cc2ccccc2oc1=O)N1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1,C63699644_decoy,CXCR4,Decoy,0,-8.1764,-10.34,-2.7,-7.8296089652992995
CS(=O)(=O)N1N=C(c2ccc(Br)cc2)C[C@@H]1C1[NH+]=c2ccccc2=[NH+]1,C63712167_decoy,CXCR4,Decoy,0,-8.10176,-8.31,-2.99,-3.325056838340885
CCOc1ccc2c(c1)=[NH+][C@H](S[C@H](C)C(=O)N1CCN(CC)CC1)[NH+]=2,C63746459_decoy,CXCR4,Decoy,0,-9.50242,-7.45,-1.31,-4.191412878173639
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1CN1CCN(c2cccc(Cl)c2)CC1,C63751506_decoy,CXCR4,Decoy,0,-9.15716,-7.23,-1.05,-7.931484609306693
O=C1[NH+]=c2ccccc2=[NH+][C@H]1CN1CCN(c2ccccc2Cl)CC1,C63751555_decoy,CXCR4,Decoy,0,-8.39252,-7.92,-2.01,-6.735759615663455
O=C1C[C@@H](C2[NH+]=c3ccccc3=[NH+]2)CN1c1ccccc1Br,C63766801_decoy,CXCR4,Decoy,0,-7.86199,-8.63,-0.71,-7.715388391696722
O=C(c1cncc(Br)c1)N1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1,C63767657_decoy,CXCR4,Decoy,0,-8.82545,-7.94,-1.75,-3.518357622279481
O=C1[C@H]2SC(c3ccc(F)cc3)=CC2=NCN1CC1[NH+]=c2ccccc2=[NH+]1,C63883608_decoy,CXCR4,Decoy,0,-8.30402,-8.34,-0.41,-6.52763441596764
C[C@@H]1c2cccc(F)c2O[C@@H]1C(=O)N1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1,C64040333_decoy,CXCR4,Decoy,0,-7.61666,-9.35,-3.44,-3.5667858407139708
Cc1ccc(N2C(=O)C[C@@H]([NH+]3CCC(C4=c5ccccc5=[NH+]C4)CC3)C2=O)cc1,C64059766_decoy,CXCR4,Decoy,0,-8.24012,-8.46,-2.38,-8.749873120184503
Cc1ccc(-c2nc(CN3CCCC[C@H]3C3[NH+]=c4ccccc4=[NH+]3)c(C)o2)o1,C64120634_decoy,CXCR4,Decoy,0,-8.16267,-8.27,-2.94,-8.893935003706655
O=C1[NH+]=c2ccc(S(=O)(=O)N(Cc3cccs3)Cc3cccs3)cc2=[NH+]1,C07688992_decoy,CXCR4,Decoy,0,-7.93847,-7.38,-2.56,-8.522190222480713
COc1ccc(-c2nnc([C@H](C)[NH+]3CC=C(C4=c5ccccc5=[NH+]C4)CC3)o2)cc1,C64212792_decoy,CXCR4,Decoy,0,-8.72384,-8.25,-0.97,-7.325961756381959
O=C(Cc1csc(-n2cccc2)n1)N1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1,C64411338_decoy,CXCR4,Decoy,0,-9.27357,-8.56,-2.65,-8.458589162290137
CN1C[C@@H](CN2CCN(C(=O)CCC3[NH+]=c4ccccc4=[NH+]3)CC2)c2ccccc21,C65330103_decoy,CXCR4,Decoy,0,-8.15874,-9.71,-1.34,-8.703198710588802
S[C@@H]1[NH+]=C(c2ccco2)N2[C@H](S)[NH+]=C(c3ccccc3)N12,C04362847_decoy,CXCR4,Decoy,0,-7.77383,-5.84,-2.01,-2.572809055105168
Cc1ccc(-c2cc(N3CC[NH+](C)CC3)c3cc(C)ccc3[o+]2)cc1,C01961612_decoy,CXCR4,Decoy,0,-7.84647,-10.22,-2.37,-7.317665630905484
C[C@H]1[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@@H]([NH+](C)C)CC[C@]5(C)[C@H]4CC[C@@]23C[NH+]1C,C05529758_decoy,CXCR4,Decoy,0,-9.19511,-6.86,-2.69,-2.971817064214776
COc1c2c(cc3c1[C@H](C#CC[NH+](C)C)[NH+](C)CC3)OCO2,C00487547_decoy,CXCR4,Decoy,0,-7.82738,-6.88,-1.56,-9.326235635015523
FC(F)(F)c1c[nH+]c(N2CCN(c3[nH+]c(C(F)(F)F)ccc3Cl)CC2)c(Cl)c1,C03771028_decoy,CXCR4,Decoy,0,-8.77723,-10.65,-3.37,-7.73831629144662
C[NH+](CC#N)[C@H]1CC[C@@H]2[C@@H]3CC[C@@H]4C[C@@H](OC(=O)C[N+](C)(C)C)CC[C@]4(C)[C@H]3CC[C@@]21C,C09359314_decoy,CXCR4,Decoy,0,-8.25864,-8.34,-2.03,-6.633241594924627
C[C@H]1[C@@H]2CC[C@@H]3[C@@H]4CC=C5C[C@@H]([NH+](C)C)CC[C@@]5(C)[C@@H]4CC[C@@]32C[NH+]1C,C13783786_decoy,CXCR4,Decoy,0,-9.00362,-5.3,-2.26,-4.415535866196231
CN1/C(=C\C=C\c2c3sc(-c4ccccc4)c(O)[n+]3c3ccccc3[n+]2C)C(C)(C)c2ccccc21,C16693734_decoy,CXCR4,Decoy,0,-9.90188,-10.31,-3.47,-7.481060655584221
COc1ccc(/C=[NH+]/CC[C@@]2(c3ccccc3)C[C@@H](C)[NH+](C)C[C@@H]2C)cc1,C13381830_decoy,CXCR4,Decoy,0,-8.45607,-7.13,-4.55,-3.69974716830337
CCOc1ccc2oc(-c3ccc(C)cc3)c/c(=[NH+]\CC[NH+](CC)CC)c2c1,C28302767_decoy,CXCR4,Decoy,0,-7.93511,-8.05,-0.86,-8.516404195364682
O=C(c1ccco1)[C@@H]([C@H](c1ccc(Cl)cc1)[NH+]1CCCCC1)[NH+]1CCCCC1,C32559907_decoy,CXCR4,Decoy,0,-8.88416,-7.99,-1.41,-8.627714657147678
Brc1cccc(/C=[NH+]/CC/[NH+]=C/c2cccc(Br)c2)c1,C01954919_decoy,CXCR4,Decoy,0,-9.66176,-7.78,-1.5,-8.854889215730156
N#C/C(=C\c1ccccc1Br)C1[NH+]=c2ccccc2=[NH+]1,C38811709_decoy,CXCR4,Decoy,0,-7.80991,-8.48,-1.29,-8.319435154011298
Fc1ccc(/C=[NH+]/C2=C[C@@H](c3ccc(Br)cc3)[NH+]=N2)cc1Oc1ccccc1,C39159686_decoy,CXCR4,Decoy,0,-9.80401,-9.71,-3.9,-4.640320804555087
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1ccccc1Cl)[NH+]=2,C39205092_decoy,CXCR4,Decoy,0,-7.97217,-7.77,-0.88,-9.001812137285732
COc1cc(C)c(CS[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1C(C)C,C39224443_decoy,CXCR4,Decoy,0,-7.74684,-9.34,-2.26,-7.509022255455371
N#C[C@@H]1C2=C(CCC2)S[C@@H]1/N=C/C1[NH+]=c2ccccc2=[NH+]1,C39345146_decoy,CXCR4,Decoy,0,-8.62888,-7.59,-1.54,-3.096459412652128
N#C/C(=C\c1cc2c(cc1Cl)OCO2)C1[NH+]=c2ccccc2=[NH+]1,C39697476_decoy,CXCR4,Decoy,0,-8.24999,-7.4,-2.8,-5.9840597054097895
CN(C)c1ccc(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1Br,C39736994_decoy,CXCR4,Decoy,0,-7.67354,-7.53,-1.17,-7.345897768187524
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1/C=C/c1ccc2c(c1)OCO2,C39958287_decoy,CXCR4,Decoy,0,-6.42074,-7.05,-1.7,-2.683337960266063
N#C/C(=C\[C@H]1CN(Cc2c(F)cccc2Cl)c2ccccc21)C1[NH+]=c2ccccc2=[NH+]1,C39962675_decoy,CXCR4,Decoy,0,-10.2134,-9.74,-2.16,-11.124969769263783
CC[n+]1c(/C=C\C=C2\C=CC=C[NH+]2CC)sc2ccccc21,C44709671_decoy,CXCR4,Decoy,0,-8.58408,-7.9,-1.11,-9.002661127936918
C[C@H](c1ccccc1Cl)[NH+](C)Cc1cc(=O)n2ccsc2[nH+]1,C53235316_decoy,CXCR4,Decoy,0,-8.49491,-7.48,-1.37,-7.564774555716069
COc1cccc2cc(C3[NH+]=c4cc(C)c(C)cc4=[NH+]3)c(=O)oc12,C63110778_decoy,CXCR4,Decoy,0,-7.41977,-8.4,-1.02,-8.156560723517513
O=C1C[C@H](C2[NH+]=c3ccccc3=[NH+]2)CN1c1cccc2ccccc12,C63234426_decoy,CXCR4,Decoy,0,-7.92375,-10.91,-4.26,-7.643560289383508
S=C1[NH+]=N[C@@H](c2cc[nH+]cc2)N1/N=C/c1ccc(Cl)cc1,C38904009_decoy,CXCR4,Decoy,0,-8.72373,-5.33,-0.23,-6.421124946953899
Clc1ccc([C@@H]2[NH+]=c3cccc(Cl)c3=[NH+]2)c(Cl)c1,C63303268_decoy,CXCR4,Decoy,0,-8.37053,-7.62,-0.69,-8.515092022224726
Cc1ccc2c(c1)=[NH+][C@@H](SCC1=N[C@H]3N=CC=CN3C1)[NH+]=2,C63392665_decoy,CXCR4,Decoy,0,-6.50594,-8.23,0.1,-6.48567847421164
c1ccc(-c2nnc(SC3[NH+]=c4ccccc4=[NH+]3)c3ccccc23)cc1,C63393776_decoy,CXCR4,Decoy,0,-7.73631,-9.21,-2.21,-7.107299744536404
CC1(C)C[C@H]2C[C@](C)(CN2C2=[NH+]C=NC3=c4cc(F)ccc4=[NH+][C@H]23)C1,C63399477_decoy,CXCR4,Decoy,0,-8.52627,-9.11,-0.31,-6.54893010214907
COc1ccc(C(C)=O)cc1CS[C@@H]1[NH+]=c2ccc(C(F)(F)F)cc2=[NH+]1,C63591075_decoy,CXCR4,Decoy,0,-7.30024,-9.15,-1.16,-7.273462621862714
CC1=CC(C)(C)N(C(=O)CSC2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C63677129_decoy,CXCR4,Decoy,0,-6.94862,-10.04,-2.22,-8.308323008990131
Cc1ccc2c(c1)=[NH+][C@@H](N1CCC(C(=O)N3CCCC3)CC1)[NH+]=2,C63694243_decoy,CXCR4,Decoy,0,-8.12012,-9.4,-2.39,-8.51954951295412
C[C@H](S[C@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1)C(=O)N1CCCCCC1,C63730995_decoy,CXCR4,Decoy,0,-8.36866,-7.73,-1.89,-8.477881147855342
CCCC[NH+](Cc1ccco1)C[C@@H]1C=c2ccc(F)cc2=[NH+]C1=O,C63832891_decoy,CXCR4,Decoy,0,-7.52605,-7.66,-1.57,-9.2421188462571
O=C1C[C@@H](C2[NH+]=c3ccccc3=[NH+]2)CN1c1ccc(Cl)cc1,C63838980_decoy,CXCR4,Decoy,0,-7.83125,-8.99,-0.13,-7.139564517402641
O=C1C[C@H](C2[NH+]=c3ccccc3=[NH+]2)CN1c1ccc(F)cc1,C63838994_decoy,CXCR4,Decoy,0,-7.0455,-7.96,-1.25,-5.847670292690612
COc1ccc(Cl)c([C@H]2[NH+]=c3ccc(C#N)cc3=[NH+]2)c1F,C63848090_decoy,CXCR4,Decoy,0,-7.60923,-8.4,-1.63,-8.210940230542638
N#Cc1ccc2c(c1)=[NH+][C@H](c1cccn1-c1ccc(Cl)cn1)[NH+]=2,C63848603_decoy,CXCR4,Decoy,0,-7.67728,-7.52,-2.54,-6.889786627714681
N#Cc1ccc2c(c1)=[NH+][C@@H](c1cccn1-c1ccc(Cl)cn1)[NH+]=2,C63848604_decoy,CXCR4,Decoy,0,-6.95943,-7.53,-1.28,-6.479979633961568
C[NH+]1CCN(/N=C/C2=c3cc(Br)ccc3=[NH+]C2)CC1,C40006207_decoy,CXCR4,Decoy,0,-8.31599,-7.51,-1.43,-3.0639569852769544
Cc1sc([C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1-c1ccccc1,C63885286_decoy,CXCR4,Decoy,0,-7.88471,-8.68,-0.57,-8.28515972787298
CCCCN(CC[NH+]1C[C@H]2CC(Cl)=CC[C@H]2C1)C[NH+]1C[C@H]2CC(Cl)=CC[C@H]2C1,C19327724_decoy,CXCR4,Decoy,0,-10.7188,-8.07,-0.97,-8.149847433255175
COc1ccc2c(c1)=C1N=C[NH+]=C(N3CCCC[C@@H]3C)[C@@H]1[NH+]=2,C63896879_decoy,CXCR4,Decoy,0,-7.25014,-7.73,-1.15,-6.171836646843363
N#C/C(=C\c1ccc(Oc2ccccc2)cc1Cl)C1[NH+]=c2ccccc2=[NH+]1,C64038282_decoy,CXCR4,Decoy,0,-7.98185,-8.42,-2.86,-6.680034044997436
CC1=c2cccc(Cl)c2=[NH+][C@H]1[C@@H]1C[C@H]2CN(C)C(=O)[C@]23CCC[NH+]13,C64045358_decoy,CXCR4,Decoy,0,-8.4179,-8.95,-0.62,-6.7583369634744725
CN1CC[NH+]=C1S[C@@H]1C(=O)[NH+]=c2ccccc2=C1c1ccccc1,C64058306_decoy,CXCR4,Decoy,0,-7.44816,-7.61,-3.37,-3.074831586050029
Cc1cc(-c2nc(-c3ccc4c(c3)=[NH+]C(=O)[NH+]=4)cs2)ccc1F,C64188447_decoy,CXCR4,Decoy,0,-8.44864,-8.25,-1.44,-6.979611194682083
CC1CCC([NH+](Cn2[nH+]c(N(C)C)sc2=S)C2CC2)CC1,C66447938_decoy,CXCR4,Decoy,0,-8.36656,-5.95,-2.84,-7.958068441892311
CC(C)[C@@H](C(=O)N1CCC[C@@H]([NH+](C)C)C1)[NH+]1CCCCC1,C67044893_decoy,CXCR4,Decoy,0,-7.59351,-6.89,-2.29,-7.5861351323855555
CC[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=S)NCC[NH+]1CCOCC1,C08300496_decoy,CXCR4,Decoy,0,-9.70288,-7.41,-2.93,-8.277248658575045
COc1c(Cl)ccc(Cl)c1[C@@H]([NH3+])c1nccn1C[NH+](C)C,C11735533_decoy,CXCR4,Decoy,0,-8.31151,-6.46,-1.6,-9.382025727628095
CCOc1cc(CC[NH3+])cc(Cl)c1OCC[NH+]1CCCCC1,C11860923_decoy,CXCR4,Decoy,0,-8.75386,-6.87,-1.61,-7.844710594960322
O=C(C[NH2+][C@H]1C[NH+]2CCC1CC2)Nc1cccc(Br)c1,C20070888_decoy,CXCR4,Decoy,0,-9.00358,-7.31,-0.72,-7.780848258432909
COc1cc(C[NH+]2CC[C@@H](N3CC[NH+](C)CC3)[C@H](O)C2)cc(Cl)c1O,C20233185_decoy,CXCR4,Decoy,0,-9.32648,-8.75,-2.54,-8.006401519117079
CC[NH+]1CCN([C@@H](C[NH3+])c2ccc(OC(C)C)c(OC)c2)CC1,C32086181_decoy,CXCR4,Decoy,0,-8.74944,-6.34,-2.46,-8.912087015267103
CCCCOc1cc([C@@H](C[NH3+])N2CC[NH+](C)CC2)ccc1OC,C32086238_decoy,CXCR4,Decoy,0,-8.32687,-6.31,-1.31,-8.902611833263322
CCCCOc1cc([C@H](C[NH3+])N2CC[NH+](C)CC2)ccc1OC,C32086240_decoy,CXCR4,Decoy,0,-8.19922,-6.85,-1.78,-9.941083295772389
CCOc1ccc2ccccc2c1[C@@H](C[NH3+])N1CC[NH+](CC)CC1,C32088333_decoy,CXCR4,Decoy,0,-9.23662,-8.39,-0.85,-9.658839643556409
COc1ccc([C@H](C[NH3+])N2CC[NH+](C)CC2)cc1Br,C32088518_decoy,CXCR4,Decoy,0,-9.02498,-6.91,-0.56,-8.951515849882494
C[C@H](C1CC1)[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C36783484_decoy,CXCR4,Decoy,0,-8.89444,-7.56,-1.91,-9.358103778093058
CC(C)C[NH+](C)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C37108232_decoy,CXCR4,Decoy,0,-9.7418,-6.97,-2.18,-9.576657113862357
CC[C@H](C)[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCCO2,C37109791_decoy,CXCR4,Decoy,0,-9.76315,-8.0,-2.07,-11.036454399956058
COc1cc(Br)c([C@@H](C[NH3+])[NH+]2CCCCC2)cc1OC,C37754893_decoy,CXCR4,Decoy,0,-8.27899,-6.49,-4.59,-8.932957638541408
C[NH+]1CCN(CC[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1,C37759738_decoy,CXCR4,Decoy,0,-8.95306,-6.92,-1.87,-7.801958883936517
COc1ccc(C[NH2+]CC[C@]2(O)C[C@@H](C)[NH+](C)C[C@H]2C)cc1OC,C04539323_decoy,CXCR4,Decoy,0,-8.18364,-7.99,-4.56,-8.20746714801058
C[NH+]1CC[C@@H](C[NH2+]C[C@H](O)COc2ccc(Cl)cc2Cl)C1,C37894139_decoy,CXCR4,Decoy,0,-9.60046,-6.77,-1.53,-8.979855522355136
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC[C@@H]2CC[NH+](C)C2)C2(CC[NH2+]CC2)C1,C39689566_decoy,CXCR4,Decoy,0,-8.53275,-7.15,-1.23,-8.318225594725119
CCC(CC)C(=O)N1C[C@@H](C(=O)NC[C@H]2CC[NH+](C)C2)C2(CC[NH2+]CC2)C1,C39689661_decoy,CXCR4,Decoy,0,-8.86022,-6.76,-3.28,-3.928828390415684
C[C@@H]1NN=C(S[C@H]2C(=O)[NH+]=c3ccccc3=C2[NH2+]C2CC2)N1C,C39734268_decoy,CXCR4,Decoy,0,-7.77235,-8.37,-2.93,-3.458118497987412
C[NH+]1CCN(c2cc(CNC(=O)Nc3ccc(Cl)c(F)c3)cc[nH+]2)CC1,C48468105_decoy,CXCR4,Decoy,0,-8.32027,-7.91,-2.77,-7.103261380927272
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)N[C@@H](C)Cn2cc[nH+]c2)C1,C49208303_decoy,CXCR4,Decoy,0,-8.48895,-7.95,-1.67,-8.516648912656409
C[C@H]([NH3+])Cc1cccc(Br)c1OCCCn1cc[nH+]c1,C49329033_decoy,CXCR4,Decoy,0,-8.08959,-6.61,-1.42,-8.593710834487633
C[C@@H]([NH3+])[C@@H](c1cnn(C)c1)[NH+](C)Cc1cccc(Br)c1,C43128647_decoy,CXCR4,Decoy,0,-8.21196,-7.45,-2.14,-8.42911609958833
COc1cc(C[NH+]2CC[C@H]([NH3+])C2)c(OC)cc1Br,C50243218_decoy,CXCR4,Decoy,0,-8.35077,-6.85,-1.45,-8.837848425748701
C[NH2+]Cc1[nH+]ccn1CC(=O)Nc1ccc(Br)cc1,C51004519_decoy,CXCR4,Decoy,0,-7.87993,-7.1,-0.43,-8.267025268431386
CC(=O)NCC1CC[NH+](CC(=O)NC[C@@H]2CC[NH+](CC(F)(F)F)C2)CC1,C51856583_decoy,CXCR4,Decoy,0,-7.98961,-8.19,-1.15,-7.6058916526515965
CC(C)CNC(=O)NC(=O)[C@@H](C)[NH+]1CCC([NH+]2CCCC2)CC1,C51951861_decoy,CXCR4,Decoy,0,-8.80503,-6.92,-5.09,-7.1954501160558895
C[NH+](CCn1cc(C[NH3+])nn1)Cc1ccc(Br)cc1,C52371790_decoy,CXCR4,Decoy,0,-7.0787,-6.59,-1.76,-7.760754359859167
COc1cc(-c2cccc(N)[nH+]2)c(OC)cc1OCC[NH+](C)C,C28377081_decoy,CXCR4,Decoy,0,-8.06804,-6.61,-3.53,-7.654417959153017
C[C@H]1CCC[NH+](C(C)(C)CNC(=O)NC2CC[NH+](C3CC3)CC2)C1,C54805027_decoy,CXCR4,Decoy,0,-8.56714,-6.4,-1.41,-7.954002658338012
CC(C)c1[nH+]ccn1CCC[NH2+]Cc1c[nH]nc1-c1ccc(F)cc1,C55212148_decoy,CXCR4,Decoy,0,-8.41488,-7.71,-1.72,-9.781485793317716
C[C@@H](C[NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl)[NH+](C)C,C44317123_decoy,CXCR4,Decoy,0,-8.84754,-7.08,-1.46,-9.066918906263002
C[C@H](C[NH2+]C[C@@H](O)COc1ccc(Cl)cc1Cl)[NH+](C)C,C44317124_decoy,CXCR4,Decoy,0,-8.93397,-5.94,-1.25,-8.449303532236458
C[C@H]([NH3+])[C@H](c1ccc(Cl)s1)N1CCN(CC[NH+](C)C)CC1,C61642409_decoy,CXCR4,Decoy,0,-9.11076,-6.21,-1.42,-10.33233881781503
COc1ccc([C@H](C[NH3+])N2CC[C@H]([NH+](C)C)C2)cc1Br,C62964558_decoy,CXCR4,Decoy,0,-8.10173,-7.36,-2.38,-8.585668596808238
CC(=O)Nc1cccc(NC(=O)c2ccc3c(c2)=[NH+][C@@H](C(F)(F)F)[NH+]=3)c1,C63271791_decoy,CXCR4,Decoy,0,-6.82547,-8.96,-2.28,-7.236536281260722
C[C@@H]1NN(CC(=O)NCCC2[NH+]=c3ccccc3=[NH+]2)[C@@H](C)[C@@H]1Br,C63521119_decoy,CXCR4,Decoy,0,-9.0523,-6.61,-2.0,-7.405203875229853
C[C@@H]1NN(CC(=O)NCC2[NH+]=c3ccccc3=[NH+]2)[C@@H](C)[C@H]1Br,C63529250_decoy,CXCR4,Decoy,0,-8.35992,-8.57,-3.11,-8.359796643435367
C[C@@H]1NN(CC(=O)NCC2[NH+]=c3ccccc3=[NH+]2)[C@@H](C)[C@H]1Cl,C63529254_decoy,CXCR4,Decoy,0,-8.38098,-6.91,-0.9,-6.876921672942879
CCc1c(C)nn(CC[NH2+]C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)c1C,C63847599_decoy,CXCR4,Decoy,0,-9.03293,-7.5,-0.8,-8.112270880646857
C=CCN1C=C(C[NH2+]CCC2=c3cc(C#N)ccc3=[NH+][C@@H]2C)[C@H](C)N1,C63872380_decoy,CXCR4,Decoy,0,-8.62488,-8.78,-3.44,-4.273367424213185
O=C(CCC1=c2ccccc2=[NH+]C1)NNC(=O)CCC1=c2ccccc2=[NH+]C1,C64120520_decoy,CXCR4,Decoy,0,-7.7737,-9.23,-1.88,-8.621478515260089
O=C(/C=C1/CS[C@@H](n2cccc2)N1)NCC1[NH+]=c2ccccc2=[NH+]1,C64411336_decoy,CXCR4,Decoy,0,-8.78522,-8.28,-2.22,-3.723292456703533
Cc1cc(C)cc(C(=O)N[C@H](C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)c1,C65305778_decoy,CXCR4,Decoy,0,-7.05105,-9.56,-4.05,-4.009527743020176
CC(C)Cn1c[nH+]cc1CN1CN[C@H](c2ccccc2)[C@@H]1c1[nH]cc[nH+]1,C65459580_decoy,CXCR4,Decoy,0,-7.58691,-6.12,-3.28,-7.538758935516751
Cc1cc2n([nH+]1)C[C@@H](CN[C@@H](c1ccccc1)c1[nH+]ccn1C)CN2,C65623723_decoy,CXCR4,Decoy,0,-9.15893,-7.36,-0.73,-10.522351510284334
CCCC[NH+]1CCCC[C@@H]1CNC(=O)N[C@@H](C)Cn1cc[nH+]c1,C66597502_decoy,CXCR4,Decoy,0,-8.86816,-6.56,-2.01,-7.902670027901134
CCCC[NH+]1CCCC[C@H]1CNC(=O)N[C@@H](C)Cn1cc[nH+]c1,C66597503_decoy,CXCR4,Decoy,0,-7.70764,-5.78,-3.0,-3.42283410354493
CC[NH+]1CCN([C@H](C)C[NH2+]Cc2c[nH]nc2-c2cc3ccccc3o2)CC1,C67188307_decoy,CXCR4,Decoy,0,-7.80343,-7.87,-0.62,-7.227895262982893
CC[NH+]1CCC([C@@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)CC1,C37221319_decoy,CXCR4,Decoy,0,-8.19048,-6.3,-2.24,-7.255236278353055
C[NH+]1CCN([C@H]2N=C3C=CC=CN3C(=O)[C@@H]2/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)CC1,C39037684_decoy,CXCR4,Decoy,0,-8.36783,-7.8,-1.34,-7.993220625270351
COc1ccc([C@H]2[NH+]=NC=C2C[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c(F)c1,C39371519_decoy,CXCR4,Decoy,0,-8.75781,-7.75,-3.6,-8.033427746924053
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1ccc(N3CC[NH+](C)CC3)c([N+](=O)[O-])c1)[NH+]=2,C39578852_decoy,CXCR4,Decoy,0,-8.00612,-6.71,-1.7,-5.747640664038828
CC[C@H]1CC[C@@H]([NH2+]C)[C@H]([NH+]2CCC(C[NH+](C)C)CC2)C1,C43970598_decoy,CXCR4,Decoy,0,-7.9271,-7.17,-0.7,-7.462488021878265
CC[NH+](CC)CCC[NH2+][C@H]1N=CC=c2c1cc1c(c2C)[NH+]=c2ccncc2=1,C44709896_decoy,CXCR4,Decoy,0,-9.29743,-8.38,-2.13,-13.414494056279844
C[NH2+][C@@](C)(CC[NH+]1CCC(C[NH+](C)C)CC1)C(N)=O,C45277115_decoy,CXCR4,Decoy,0,-8.40424,-6.45,-1.71,-7.001779972616458
CCCN(CC[NH+](C)C)C1(C[NH3+])CC[NH+](CC)CC1,C45665981_decoy,CXCR4,Decoy,0,-8.11815,-5.82,-0.6,-9.224629181449972
C[NH+]1CCC[NH+](CCCC[C@](C)([NH2+]C2CC2)C(N)=O)CC1,C45380375_decoy,CXCR4,Decoy,0,-8.01744,-6.37,-2.06,-7.38963872307529
CC(C)[NH2+]C[C@]1(C[NH+](C)C2CC[NH+](C)CC2)CCOC1,C51213386_decoy,CXCR4,Decoy,0,-7.77836,-6.02,-0.49,-9.796640287897928
CC(C)C[NH2+]C[C@@]1(C[NH+](C)C2CC[NH+](C)CC2)CCOC1,C51213400_decoy,CXCR4,Decoy,0,-7.69387,-6.17,-0.77,-8.676988844031998
CC[C@@](C)(C[NH2+]C(C)C)C[NH+]1CCC(C[NH+](C)C)CC1,C51252201_decoy,CXCR4,Decoy,0,-8.24805,-6.81,-2.34,-8.753096016729202
CC(C)C[NH2+]C[C@@H]1CC[C@H](C[NH+](C)C2CC[NH+](C)CC2)O1,C52419926_decoy,CXCR4,Decoy,0,-7.89778,-6.12,-3.13,-3.434926471614962
CC(C)[NH2+]C[C@@H]1CC[C@H](C[NH+]2CCC([NH+](C)C)CC2)O1,C52477792_decoy,CXCR4,Decoy,0,-8.34797,-5.62,-3.21,-6.023140031855133
CC(C)C[NH2+]C[C@H]1CC[C@@H](C[NH+]2CCC([NH+](C)C)CC2)O1,C52477819_decoy,CXCR4,Decoy,0,-8.36122,-6.35,-1.97,-7.034252654479907
CC1CCC([NH2+]CC[NH+]2CCC(C[NH+](C)C)CC2)CC1,C53428181_decoy,CXCR4,Decoy,0,-8.06553,-6.06,-1.41,-6.592188155028055
Cc1ccc(C[NH+](CCCn2cc[nH+]c2)Cc2[nH]c[nH+]c2C)s1,C36740418_decoy,CXCR4,Decoy,0,-8.61025,-6.38,-3.51,-8.345910884575167
C[NH2+][C@@H]1CCCCC[C@H]1C[NH+]1CCC(C[NH+](C)C)CC1,C53873126_decoy,CXCR4,Decoy,0,-8.18544,-6.45,-0.86,-10.05464909856582
CCC[NH2+][C@H](CC[NH+]1CCC(C[NH+](C)C)CC1)C(C)(C)C,C54028683_decoy,CXCR4,Decoy,0,-7.74702,-5.67,-3.59,-7.379413948488256
CC(C)[C@@H]1CC[C@@H]([NH3+])[C@H]([NH+]2CCC(C[NH+](C)C)CC2)C1,C54555526_decoy,CXCR4,Decoy,0,-8.9969,-7.53,-1.34,-7.884979761224853
CC(C)C1CCC(C[NH3+])([NH+]2CCC(C[NH+](C)C)CC2)CC1,C54557127_decoy,CXCR4,Decoy,0,-9.10399,-6.58,-0.56,-10.29741114148801
CC[C@H](C)C[C@](CC)(C[NH3+])[NH+]1CCC(C[NH+](C)C)CC1,C42392172_decoy,CXCR4,Decoy,0,-7.70697,-6.02,-1.18,-7.459805633231999
CCC(CC)(C[NH3+])C[NH+]1CCN(CC[NH+](C)C)CC1,C61653748_decoy,CXCR4,Decoy,0,-8.53363,-6.36,-2.54,-8.180898276843392
CC[NH2+][C@@H]1CCC[C@H]1C[NH+]1CCN(CC[NH+](C)C)CC1,C61653768_decoy,CXCR4,Decoy,0,-7.54344,-7.11,-0.59,-9.074506749448464
C[NH2+]C[C@@H]1CC[C@H](C[NH+]2CCN(CC[NH+](C)C)CC2)O1,C61654859_decoy,CXCR4,Decoy,0,-7.65905,-5.65,-0.65,-7.164468289298937
C[NH2+]C[C@H]1CC[C@@H](C[NH+]2CCC(C[NH+]3CCCC3)CC2)O1,C62036404_decoy,CXCR4,Decoy,0,-8.25119,-6.85,-0.85,-7.290746672355772
CCC[NH2+]C[C@@H](CC)[NH+]1CCC(C[NH+]2CCCC2)CC1,C62036473_decoy,CXCR4,Decoy,0,-8.44201,-6.64,-1.32,-3.641068245318509
CC(C)[NH2+]C[C@@H](C)C[NH+]1CCC(C[NH+]2CCCC2)CC1,C62036487_decoy,CXCR4,Decoy,0,-7.27671,-5.79,-1.67,-2.924778797317838
[NH3+]C[C@H]([C@H]1CCOC1)[NH+]1CCC(C[NH+]2CCCC2)CC1,C62050307_decoy,CXCR4,Decoy,0,-8.39964,-6.86,-3.82,-9.055545431756515
C[C@@H]1CC[C@H]([NH3+])[C@H]([NH+]2CCC(C[NH+]3CCCC3)CC2)C1,C62051627_decoy,CXCR4,Decoy,0,-8.43294,-7.3,-1.47,-6.96862758688827
CC[NH2+]Cc1c(C)cc(C)[nH+]c1N1CCn2cc[nH+]c2C1,C62324255_decoy,CXCR4,Decoy,0,-7.49462,-7.8,-1.08,-8.794138979008851
C[NH+]1CCC(C[NH+](C)CCCC[C@](C)([NH3+])C(N)=O)CC1,C63121717_decoy,CXCR4,Decoy,0,-7.946,-7.07,-3.86,-6.520041454483514
O=C(NCCCn1cc[nH+]c1)c1ccc2c(c1)=[NH+][C@@H](C(F)(F)F)[NH+]=2,C63281498_decoy,CXCR4,Decoy,0,-5.984,-8.13,-2.42,-6.322206675565188
CCC(=O)N[C@H]1[C@H](C2[NH+]=c3ccccc3=[NH+]2)[C@H](C)C(C)=[N+]1CC(C)C,C63491103_decoy,CXCR4,Decoy,0,-8.01162,-7.99,-2.53,-3.6583688428415937
CCC(=O)N[C@@H]1[C@H](C2[NH+]=c3ccccc3=[NH+]2)[C@H](C)C(C)=[N+]1CCCOC(C)C,C63491184_decoy,CXCR4,Decoy,0,-8.62032,-7.73,-1.49,-7.997108020132348
C[C@@H]1O[C@@H](c2ccccc2F)N[C@H]1CS[C@@H]1[NH+]=c2cc[nH+]cc2=[NH+]1,C63513583_decoy,CXCR4,Decoy,0,-9.01949,-8.14,-1.13,-7.039918833224222
Cc1cc(C)c(CS[C@H]2[NH+]=c3cc[nH+]cc3=[NH+]2)c(C)c1,C63513647_decoy,CXCR4,Decoy,0,-7.75481,-5.37,-0.92,-5.327696314497093
Cc1onc(-c2ccccc2)c1[C@@H]1[NH+]=C(CSC2[NH+]=c3ccccc3=[NH+]2)NO1,C63608948_decoy,CXCR4,Decoy,0,-8.69178,-9.68,-1.72,-9.69867248096779
C[NH+]1CCN(C[C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)CC1,C63763405_decoy,CXCR4,Decoy,0,-8.00174,-7.57,-3.65,-7.767317392219359
CCN1C(=O)N(C)C(=O)C12CC[NH+](CC1[NH+]=c3ccccc3=[NH+]1)CC2,C63985523_decoy,CXCR4,Decoy,0,-7.38069,-7.81,-0.72,-8.873710588108878
Cc1cc2c(cc1C)=[NH+]C(C[NH+](C)C[C@@H]1N[C@@H](c3cc(F)ccc3F)O[C@H]1C)[NH+]=2,C64103318_decoy,CXCR4,Decoy,0,-8.2896,-10.04,-2.59,-7.517931873959268
C[NH+](CC1=CN=[NH+][C@@H]1c1ccc2c(c1)OCO2)C[C@@H]1C=c2cc(F)ccc2=[NH+]1,C64103577_decoy,CXCR4,Decoy,0,-8.58083,-8.5,-2.64,-7.00463992288113
COc1cccc(C[NH+]2C[C@H](SC3[NH+]=c4ccccc4=[NH+]3)C[C@H]2C(=O)NC(C)C)c1,C64158160_decoy,CXCR4,Decoy,0,-9.16558,-8.54,-2.52,-8.17630882382948
CC1=[NH+][C@H](C[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)ON1,C64188117_decoy,CXCR4,Decoy,0,-8.56907,-6.21,-1.2,-5.700740880463222
Cc1cccc2c1=[NH+][C@@H](C[NH+](C)C[C@]1(O)CCCN(C)C1=O)[NH+]=2,C64636511_decoy,CXCR4,Decoy,0,-8.3059,-7.42,-2.24,-3.302500982282439
C[C@H]1O[C@@H](c2ccccc2Cl)N[C@@H]1C[NH+](C)C[C@@H]1[NH+]=c2ccc(F)cc2=[NH+]1,C64639968_decoy,CXCR4,Decoy,0,-9.23654,-9.06,-1.96,-4.184811627666831
[NH3+][C@H](c1ccccc1)c1ccc2c(c1)=[NH+][C@@H](C(F)(F)F)[NH+]=2,C64672587_decoy,CXCR4,Decoy,0,-6.79129,-7.14,-0.88,-3.0806775765288283
O=C(C[NH2+]CCSc1c[nH]nn1)NC1[NH+]=c2ccccc2=[NH+]1,C65394509_decoy,CXCR4,Decoy,0,-7.78079,-7.12,-0.97,-3.4775237683025493
Cc1cccc2c1=[NH+][C@H](CCN(C)C1=[NH+]C=NC3=NC=C[C@H]31)[NH+]=2,C65409735_decoy,CXCR4,Decoy,0,-7.4962,-9.3,-0.9,-7.792110627749184
Cc1ccc2c(c1C)=[NH+][C@@H](C[NH2+]Cc1ccccc1-n1cccn1)[NH+]=2,C65469585_decoy,CXCR4,Decoy,0,-8.30309,-6.74,-2.97,-3.4480454944009824
CC[NH+](CC)CCC[C@H](C)Nc1cc[nH+]c2cc(Br)ccc12,C01700320_decoy,CXCR4,Decoy,0,-8.79149,-6.44,-1.16,-10.449245706750522
COc1ccc(CC[NH+]2CCC(C[NH+](C)Cc3cc(C)c(C)o3)CC2)cc1,C12076427_decoy,CXCR4,Decoy,0,-8.50353,-7.92,-2.14,-7.613915425128856
CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(F)c(Br)c1,C19915208_decoy,CXCR4,Decoy,0,-8.3234,-6.59,-1.73,-6.982405672455883
CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(Br)s1,C20024350_decoy,CXCR4,Decoy,0,-8.97359,-6.76,-3.58,-8.2285017717606
C[C@@H]1C[NH+](C)[C@@H](C)C[C@@H]1NCC[C@@]1(c2ccccc2)C[C@@H](C)[NH+](C)C[C@@H]1C,C17250764_decoy,CXCR4,Decoy,0,-9.68058,-7.82,-3.61,-10.680142282052527
CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1c(Cl)ccc(Cl)c1Cl,C35054816_decoy,CXCR4,Decoy,0,-9.43624,-6.68,-1.86,-10.171516438834876
CC(C)C[C@H](C[NH+](C)C)[NH2+]C1CC(c2ccc(Br)cc2)C1,C37167250_decoy,CXCR4,Decoy,0,-9.17151,-6.92,-1.84,-8.162950301361597
COc1ccc([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)cc1Br,C37197141_decoy,CXCR4,Decoy,0,-8.10033,-6.95,-2.31,-9.32253172333046
C[C@@H]([NH2+]CC1([NH+](C)C)CCCCC1)c1ccc(I)cc1,C37216984_decoy,CXCR4,Decoy,0,-8.41692,-6.33,-1.7,-7.550802566100276
Brc1ccc(C2CC([NH2+]C[C@@H]3CC[NH+](C4CC4)C3)C2)cc1,C37648919_decoy,CXCR4,Decoy,0,-9.21534,-7.06,-4.21,-7.533855820604733
C[C@@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1ccc(Br)s1,C38003258_decoy,CXCR4,Decoy,0,-9.22277,-6.39,-3.67,-8.17563064444845
C[C@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1ccc(Br)s1,C38003259_decoy,CXCR4,Decoy,0,-7.8308,-6.01,-2.15,-3.456576830914065
CC(C)C[C@@H](C[NH+](C)C)[NH2+][C@H](C)c1ccc(F)c(Br)c1,C37321667_decoy,CXCR4,Decoy,0,-8.70722,-7.7,-1.75,-9.765806768125264
CC(C)OC(=O)COc1ccc(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1,C39352787_decoy,CXCR4,Decoy,0,-8.50899,-6.26,-2.47,-6.888576558004183
CCN(CC)c1ccc(/C=C(/C#N)[C@@H]2[NH+]=c3ccc(OC)cc3=[NH+]2)c(OC)c1,C39369748_decoy,CXCR4,Decoy,0,-8.72225,-8.29,-2.44,-4.450428295404051
COc1ccc([C@@H]2[NH+]=NC=C2C[NH2+]CC[C@@H]2C[C@@H]3C=C[C@H]2C3)c(F)c1,C39388198_decoy,CXCR4,Decoy,0,-8.71148,-7.59,-3.68,-7.919828665254202
Fc1ccc([C@H]2[NH+]=NC=C2C[NH2+]CCc2ccc(C(F)(F)F)cc2)c(F)c1,C39447852_decoy,CXCR4,Decoy,0,-7.93928,-7.53,-2.65,-6.368219476387339
CCCOc1c(Br)cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1OCC,C39934648_decoy,CXCR4,Decoy,0,-9.89387,-6.85,-1.73,-7.997102495125469
C[NH+](C)CCC[NH2+]Cc1ccc(OCc2ccc(F)cc2Cl)cc1,C40719529_decoy,CXCR4,Decoy,0,-8.35112,-6.57,-2.34,-8.173669946554398
C[NH+](C)CCC[NH2+]Cc1cc(Cl)ccc1OCc1ccc(F)cc1Cl,C40720657_decoy,CXCR4,Decoy,0,-8.78401,-7.78,-2.69,-8.906289907112727
CC[NH+]1CCC([C@H](C)[NH2+][C@H](C)c2ccc(Br)cc2)CC1,C49514961_decoy,CXCR4,Decoy,0,-8.27819,-5.71,-2.09,-7.03952350750922
Brc1ccc(OCC[NH2+][C@@H]2CC[NH+]3CCCC[C@H]23)cc1,C49596188_decoy,CXCR4,Decoy,0,-8.97801,-6.91,-1.47,-8.233474113871646
C[NH+](C)CC[NH2+]CC[C@H](Cc1ccccc1Cl)c1ccc(Cl)cc1,C20588734_decoy,CXCR4,Decoy,0,-9.83296,-7.41,-2.43,-9.017514870136074
CC(C)C[NH2+]CC(C)(C)C[NH+](C)Cc1csc(Br)c1,C51256940_decoy,CXCR4,Decoy,0,-8.44955,-6.1,-0.77,-7.349711675706465
CCC[NH2+]Cc1coc(C[NH+](C)Cc2ccc(Br)cc2)c1,C52371799_decoy,CXCR4,Decoy,0,-7.91945,-6.43,-1.6,-7.088734642177556
C[C@H](CCC[NH2+]C(C)(C)C)[NH+](C)Cc1ccc(Br)cc1,C52371813_decoy,CXCR4,Decoy,0,-8.30212,-6.74,-0.95,-7.593492950915152
C[NH+](CCCCC[NH2+]C(C)(C)C)Cc1cc(Br)cs1,C52517154_decoy,CXCR4,Decoy,0,-8.74358,-5.46,-2.05,-10.373487475570338
CC(C)[NH2+]Cc1ccc(C[NH+](C)Cc2ccccc2Br)o1,C52541225_decoy,CXCR4,Decoy,0,-8.08631,-7.13,-2.53,-3.4674814802283493
CC(C)C[NH2+]CCC[C@@H](C)[NH+](C)Cc1cccc(Br)c1,C52545190_decoy,CXCR4,Decoy,0,-8.45057,-6.9,-2.85,-8.186314056344006
CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(Br)s1)N1CC[NH+](C)CC1,C40770332_decoy,CXCR4,Decoy,0,-8.61126,-6.79,-3.39,-3.6518736751964327
CC[NH+]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2cc(Cl)cc(Cl)c2)o1,C35805114_decoy,CXCR4,Decoy,0,-9.89782,-7.49,-1.25,-7.77226001368972
CCC[NH2+]Cc1ccoc1C[NH+](C)Cc1ccccc1Br,C52541217_decoy,CXCR4,Decoy,0,-8.23497,-7.02,-4.62,-9.637394198343928
CC[C@H](C)[NH+]1CCN(c2ccc([C@H](C)[NH2+]C)cc2Br)CC1,C61698228_decoy,CXCR4,Decoy,0,-8.88723,-6.95,-1.15,-7.249906765408191
CC[NH+](CC)CCOc1ccc(C[NH2+]C(C)(C)C)cc1Br,C62727926_decoy,CXCR4,Decoy,0,-8.02057,-6.23,-3.58,-8.57721795655909
CC(C)C[NH2+]Cc1cccc(Br)c1OCC[NH+]1CCCC1,C62733667_decoy,CXCR4,Decoy,0,-8.50289,-7.27,-1.01,-11.933885064171672
O=C(N[C@H](Cc1ccccc1)C1[NH+]=c2ccccc2=[NH+]1)c1cc(F)c(F)cc1Cl,C63268812_decoy,CXCR4,Decoy,0,-8.99835,-8.7,-1.71,-9.125983998654592
C[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C1[NH+]=c2ccccc2=[NH+]1,C63338968_decoy,CXCR4,Decoy,0,-8.3348,-10.05,-2.56,-9.350454593315128
CCC(CC)C[NH2+]CCC1=c2cc(OC(F)(F)F)ccc2=[NH+][C@@H]1C,C63514317_decoy,CXCR4,Decoy,0,-7.63238,-7.69,-1.11,-7.033743053642169
Cc1cc(C)c(NC(=O)CSCC2[NH+]=c3ccccc3=[NH+]2)c(C)c1,C63533476_decoy,CXCR4,Decoy,0,-8.46707,-8.96,-2.58,-8.843313836341054
O=C(c1ccccc1)[C@H](SC1[NH+]=c2ccccc2=[NH+]1)c1ccccc1,C63677321_decoy,CXCR4,Decoy,0,-7.70162,-7.81,-2.09,-9.824660165341047
CC1=c2cc(C)ccc2=[NH+][C@H]1CN1CC[NH+](C2CCCC2)[C@H](CCO)C1,C64058616_decoy,CXCR4,Decoy,0,-9.21013,-7.94,-4.1,-3.68585968609089
C[C@@H]([NH2+]C[C@@H]1C=c2ccccc2=[NH+]1)[C@@H]1C=NN(c2cccc(F)c2)[C@H]1C,C64111279_decoy,CXCR4,Decoy,0,-8.29795,-8.7,-0.87,-7.939393801657049
CCCOc1ccc(/C=C/C(=O)c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)cc1OC,C64181990_decoy,CXCR4,Decoy,0,-7.9661,-7.54,-2.53,-9.78096149180194
Fc1ccc(C[NH2+]CCC2=c3ccccc3=[NH+]C2)cc1Br,C64693614_decoy,CXCR4,Decoy,0,-7.40693,-8.5,-0.76,-6.998065381257627
CC[C@@H]1[NH+]=c2ccc(CCC(=O)Nc3ccc(F)c(Cl)c3)cc2=[NH+]1,C64747076_decoy,CXCR4,Decoy,0,-8.85753,-9.03,-0.59,-8.108255901094003
CCC[C@@H]1[NH+]=c2ccc(CCC(=O)Nc3ccc(F)c(Cl)c3)cc2=[NH+]1,C65112875_decoy,CXCR4,Decoy,0,-8.4845,-8.84,-1.48,-9.23639312622423
CCC[C@@H]1[NH+]=c2ccc(CCC(=O)Nc3ccc(C)c(F)c3)cc2=[NH+]1,C65112967_decoy,CXCR4,Decoy,0,-6.41958,-7.81,-1.81,-7.257888589514805
CCC[C@H]1[NH+]=c2ccc(CCC(=O)Nc3ccc(F)c(F)c3)cc2=[NH+]1,C65112976_decoy,CXCR4,Decoy,0,-8.31511,-7.18,-2.17,-3.850936220701864
CCC[C@H]1[NH+]=c2ccc(CCC(=O)Nc3ccc(Cl)cc3F)cc2=[NH+]1,C65112978_decoy,CXCR4,Decoy,0,-8.49784,-6.44,-1.42,-6.247540209204013
Cc1ccccc1[C@@H]1N=C[C@H](CNC[C@@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)S1,C65376048_decoy,CXCR4,Decoy,0,-8.23913,-8.6,-1.8,-6.823157546185422
CC(C)[NH+](CC#Cc1ccc(C#CC[NH+](C(C)C)C(C)C)cc1)C(C)C,C02478830_decoy,CXCR4,Decoy,0,-8.13635,-6.27,-3.72,-7.97059728216274
CC[NH+](CC)Cc1c(C)cc(C)c(C[NH+](CC)CC)c1C,C02022443_decoy,CXCR4,Decoy,0,-7.2862,-6.23,-1.83,-8.739457339569118
C[C@H]1C[NH+](C/C=C/C[NH+]2C[C@H](C)C(=O)C[C@@H]2C)[C@@H](C)CC1=O,C09327755_decoy,CXCR4,Decoy,0,-8.13543,-7.41,-1.66,-8.65210649196069
COCC[NH+]1CCC[C@]2(CC[NH+](C3CCCCCCC3)C2)C1,C12074249_decoy,CXCR4,Decoy,0,-8.31712,-7.31,-0.14,-8.151075220069698
O=C(C1CCCC1)N(CC[NH+]1CCCCC1)C[C@H]1CCC[NH+](C2CCCC2)C1,C14949830_decoy,CXCR4,Decoy,0,-9.54458,-7.68,-0.92,-8.480114764655854
COCC[NH+]1CCC(C[NH+](CC2CCCCC2)C[C@@H]2CCCO2)CC1,C12758949_decoy,CXCR4,Decoy,0,-9.32225,-6.18,-4.16,-8.985230619653878
C(=C\c1ccccc1)\C=[NH+]\CC/C=C\C=[NH+]\CCc1ccccc1,C17324154_decoy,CXCR4,Decoy,0,-8.54881,-8.27,-2.38,-8.790800030615017
COCC[NH+]1CCC(CN2CCC([NH+]3CCCC3)CC2)CC1,C32587110_decoy,CXCR4,Decoy,0,-8.27258,-5.81,-1.68,-6.743640048629283
C=CC/[NH+]=C(\SC)N1CCN(/C(=[NH+]/CC=C)SC)CC1,C06182731_decoy,CXCR4,Decoy,0,-7.92664,-5.71,-1.86,-7.734722588521585
N#C/C(=C/c1ccc(N2CCOCC2)c(F)c1)C1[NH+]=c2ccccc2=[NH+]1,C39354015_decoy,CXCR4,Decoy,0,-8.02456,-7.12,-1.38,-6.272349228282315
Cc1ccccc1CSC1[NH+]=c2cc3ccccc3cc2=[NH+]1,C39370777_decoy,CXCR4,Decoy,0,-7.51207,-7.12,-1.23,-4.874649906571167
C#CCOc1ccccc1/C=C(\C#N)C1[NH+]=c2ccccc2=[NH+]1,C39425637_decoy,CXCR4,Decoy,0,-7.80377,-6.28,-1.57,-5.982250797096319
CCCOc1ccccc1/C=C(\C#N)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39443752_decoy,CXCR4,Decoy,0,-7.77091,-7.17,-1.44,-9.08222990045194
O=[N+]([O-])c1ccc2c(c1)=[NH+][C@@H](/C(Cl)=C/c1cccs1)[NH+]=2,C39461920_decoy,CXCR4,Decoy,0,-7.08493,-5.55,-1.66,-4.9677333004936495
O=[N+]([O-])c1ccc2c(c1)=[NH+][C@H](/C(Cl)=C/c1ccsc1)[NH+]=2,C39461922_decoy,CXCR4,Decoy,0,-7.06572,-7.16,-2.74,-2.983652870986476
COc1ccccc1/C=[NH+]/CC/[NH+]=C/c1ccccc1OC,C18168950_decoy,CXCR4,Decoy,0,-7.71302,-7.49,-3.9,-7.9924032143033
CC(=O)c1ccc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)cc1,C39697478_decoy,CXCR4,Decoy,0,-7.37787,-6.85,-1.09,-6.1633453661976265
C=CCOc1ccccc1/C=C(\C#N)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39706872_decoy,CXCR4,Decoy,0,-7.85153,-7.16,-2.86,-8.660835161492942
C=CCOc1ccccc1/C=C(\C#N)[C@@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C39706873_decoy,CXCR4,Decoy,0,-7.91562,-7.65,-0.8,-9.812772675749851
N#C/C(=C\[C@@H]1CN(Cc2ccc(F)cc2Cl)c2ccccc21)C1[NH+]=c2ccccc2=[NH+]1,C39934669_decoy,CXCR4,Decoy,0,-10.746,-9.29,-3.86,-9.901204510639603
N#C/C(=C/[C@H]1CN(Cc2ccc(F)cc2Cl)c2ccccc21)C1[NH+]=c2ccccc2=[NH+]1,C39964526_decoy,CXCR4,Decoy,0,-9.33272,-10.86,-3.45,-9.865026038778405
C[NH+](C)C1C(c2ccccc2)C([NH+](C)C)C1c1ccccc1,C45027945_decoy,CXCR4,Decoy,0,-6.33322,-8.03,-1.48,-8.584922755660175
C1CCC[NH+](CC2CC[NH+](C[C@H]3CCCCO3)CC2)CC1,C48563697_decoy,CXCR4,Decoy,0,-8.54994,-7.75,-0.76,-8.538260158349244
Cc1cc(C)c(CCl)c(N2CC[NH+](C(C)(C)C)CC2)[nH+]1,C48946103_decoy,CXCR4,Decoy,0,-7.94612,-7.01,-1.07,-8.157026253430491
CC[NH+](CC)CC[NH+](CC)Cc1c(C)oc2ccc(OC)cc12,C51331093_decoy,CXCR4,Decoy,0,-8.00624,-7.05,-3.26,-8.744254052698908
CC(C)N(C(=O)C[NH+]1CCC([NH+]2CCCC2)CC1)C(C)C,C51925399_decoy,CXCR4,Decoy,0,-7.52841,-6.0,-0.48,-6.166603968159404
Fc1ccc(/C=N/N2C(=S)[NH+]=N[C@H]2c2cc[nH+]cc2)cc1,C38905782_decoy,CXCR4,Decoy,0,-6.66591,-5.23,-1.75,-5.642934684062758
CC[NH+]1CCN(C(=O)CCC2CC[NH+](C[C@H](C)CCC=C(C)C)CC2)CC1,C14979905_decoy,CXCR4,Decoy,0,-9.93132,-7.51,-1.99,-8.163512196760086
Fc1ccc([NH+]=c2ccn(CCCCCCCCn3ccc(=[NH+]c4ccc(F)cc4)cc3)cc2)cc1,C29236164_decoy,CXCR4,Decoy,0,-8.58037,-9.06,-3.11,-8.943182708352712
C=C(C)CN(CC)C(=O)[C@H](C)[NH+]1CCC(CC[NH+](C)C)CC1,C56523191_decoy,CXCR4,Decoy,0,-7.7312,-6.0,-3.49,-7.085939799297389
Cc1ccc(/C=C/C(=O)c2ccc3c(c2)=[NH+]C(=O)[NH+]=3)c(C)c1,C39771875_decoy,CXCR4,Decoy,0,-7.82824,-9.5,-1.32,-8.474719389473062
Cc1ccc(S(=O)(=O)CCC2[NH+]=c3ccccc3=[NH+]2)cc1,C63165488_decoy,CXCR4,Decoy,0,-7.46694,-8.39,-3.46,-3.358215958255484
Cc1ccc2c(c1)=[NH+][C@@H]([C@H](C)c1ccc(CC(C)C)cc1)[NH+]=2,C63221911_decoy,CXCR4,Decoy,0,-8.30701,-8.18,-1.25,-7.8897441704943185
Cc1ccc2c(c1)=[NH+][C@H](SCc1ccc(Cl)c(Cl)c1)[NH+]=2,C63258792_decoy,CXCR4,Decoy,0,-8.73717,-7.6,-1.28,-7.523957980156195
c1ccc(-c2noc(CCC3[NH+]=c4ccccc4=[NH+]3)n2)cc1,C63279654_decoy,CXCR4,Decoy,0,-7.38147,-8.33,-3.91,-3.552605150796329
S=C1[NH+]=N[C@@H](c2cc[nH+]cc2)N1/N=C/c1ccc(Cl)cc1Cl,C38903824_decoy,CXCR4,Decoy,0,-8.81851,-7.59,-0.85,-9.263124809578844
Cc1cccc(/C=N/N2C(=S)[NH+]=N[C@H]2c2cc[nH+]cc2)c1,C38931712_decoy,CXCR4,Decoy,0,-6.95516,-5.84,-2.48,-2.66459544356797
CC1=CC=CN2CC(CSC3[NH+]=c4ccccc4=[NH+]3)=N[C@H]12,C63576369_decoy,CXCR4,Decoy,0,-6.65694,-8.12,-3.46,-3.113633691135661
O=C(c1ccccc1Cl)N1N=C(c2ccccc2)C[C@@H]1C1[NH+]=c2ccccc2=[NH+]1,C63611361_decoy,CXCR4,Decoy,0,-6.87462,-9.12,-2.47,-7.811622789739977
CCOc1ccc2c(c1)=[NH+][C@@H](SCC(=O)C1=CC[C@@H](F)C=C1)[NH+]=2,C63637411_decoy,CXCR4,Decoy,0,-7.83959,-6.35,-1.06,-6.605810185898915
COc1cccc(CS[C@@H]2[NH+]=c3ccc(OC)cc3=[NH+]2)c1,C63745792_decoy,CXCR4,Decoy,0,-6.65804,-7.63,-1.34,-3.2144423602542886
CN(C)C(=O)[C@@H](S[C@@H]1[NH+]=c2ccc(Cl)cc2=[NH+]1)c1ccccc1,C63749935_decoy,CXCR4,Decoy,0,-7.52482,-7.63,-1.78,-6.928897705893941
CCc1ccccc1N1C[C@@H](C2[NH+]=c3ccccc3=[NH+]2)CC1=O,C63838975_decoy,CXCR4,Decoy,0,-7.48714,-9.04,-0.95,-7.508018378426281
O=C1[NH+]=c2ccccc2=[NH+][C@H]1/C=C/c1ccccc1C(F)(F)F,C39995833_decoy,CXCR4,Decoy,0,-7.03158,-9.75,-2.7,-9.36850425049295
C[C@H](Cc1ccc2c(c1)OCO2)[C@@H]1[NH+]=c2ccc(F)cc2=[NH+]1,C63846777_decoy,CXCR4,Decoy,0,-7.65694,-6.71,-1.34,-6.205388023535592
COC[C@@H]1CCC[NH+]1CCC1=c2cc(F)ccc2=[NH+][C@@H]1C,C64110979_decoy,CXCR4,Decoy,0,-7.65775,-7.04,-2.1,-7.956592573022048
Fc1ccc(-c2noc(CCC3[NH+]=c4ccccc4=[NH+]3)n2)cc1,C64417209_decoy,CXCR4,Decoy,0,-7.07852,-8.69,-0.94,-8.075420970944476
CC[C@H]1C[NH+](C[C@@H]2C=c3ccccc3=[NH+]2)Cc2cc(OC)ccc2O1,C64622258_decoy,CXCR4,Decoy,0,-8.30186,-6.24,-1.97,-5.391989980477982
CC1=C[C@@H](CN(C)CC2[NH+]=c3ccccc3=[NH+]2)C(=O)N=C1C,C64651026_decoy,CXCR4,Decoy,0,-7.42175,-7.84,-1.13,-7.311110152600611
Fc1ccccc1OCCS[C@@H]1[NH+]=c2ccc(Br)cc2=[NH+]1,C65042823_decoy,CXCR4,Decoy,0,-8.62963,-6.51,-0.59,-7.70820036754753
CSc1ccc(C[NH+](C)Cc2cc(=O)oc3cc(C)c(C(C)C)cc23)cc1,C03571747_decoy,CXCR4,Decoy,0,-9.34884,-9.05,-2.01,-9.649343152552609
CC[NH+](CC)CCO[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1,C03995983_decoy,CXCR4,Decoy,0,-9.60868,-8.11,-1.9,-7.354836604914318
CCCC[NH+](CC(=O)N1CCS[C@H]1c1ccc(F)cc1)Cc1ccccc1F,C04408515_decoy,CXCR4,Decoy,0,-8.12954,-6.99,-3.75,-9.852062316339564
CSc1ccc(/C=N/N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)cc1,C02387626_decoy,CXCR4,Decoy,0,-8.86796,-6.53,-0.77,-6.214901528669108
C=CC[NH+](Cc1ccc(OC)cc1)Cc1cccn1Cc1ccccc1F,C04752134_decoy,CXCR4,Decoy,0,-7.29257,-7.73,-3.06,-7.794432113041402
N#Cc1ccc(Oc2c(F)c(F)c(/C=C/C[NH+]3CCOCC3)c(F)c2F)cc1,C04868154_decoy,CXCR4,Decoy,0,-7.88027,-6.53,-1.93,-5.760664990601649
C[C@@H]1C[C@H](C)C[NH+](CCOCCOc2ccc(Cl)c3ccccc23)C1,C04906570_decoy,CXCR4,Decoy,0,-9.05435,-7.91,-1.95,-7.185146310273953
COc1ccc(C(=O)N2C[NH+](CCC(C)C)Cc3c2sc(C)c3C)cc1,C05612024_decoy,CXCR4,Decoy,0,-7.06905,-7.62,-2.11,-8.321957385142168
Cc1ccc(C[NH+](C)Cc2cc(=O)n3c(-c4ccccc4)csc3n2)cc1,C06647324_decoy,CXCR4,Decoy,0,-7.86764,-7.53,-1.17,-6.934788808669713
CCc1cc2c(N3CC[NH+](C/C=C\c4ccccc4)CC3)ncnc2s1,C02026788_decoy,CXCR4,Decoy,0,-8.88817,-7.36,-1.24,-7.297021058176831
Cc1cc(Br)cc(C)c1OCCOCC[NH+](C)Cc1ccccc1,C02823430_decoy,CXCR4,Decoy,0,-8.33755,-7.7,-3.2,-7.615049020299929
COc1ccc(-c2nc(C[NH+](C)[C@@H](C)c3cccs3)c(C)o2)c(F)c1,C12431765_decoy,CXCR4,Decoy,0,-8.35403,-8.26,-2.27,-7.682884910831444
CCOc1ccc(Br)cc1[C@H]1N2C[C@@]3(CC)C[NH+]1C[C@@](CC)(C2)C3=O,C19327522_decoy,CXCR4,Decoy,0,-8.94252,-7.98,-1.81,-8.591969910396713
Cc1cc(I)ccc1OCCCC[NH+]1CCN(C)CC1,C20652530_decoy,CXCR4,Decoy,0,-8.29775,-6.72,-1.86,-7.818868932662047
Cc1cccc(N(CC(=O)c2ccc(Br)cc2)C2=[NH+]CCS2)c1,C26506127_decoy,CXCR4,Decoy,0,-8.70332,-7.71,-2.0,-7.708754742720783
Fc1ccc(-n2c3c(c4cc(F)ccc42)C[NH+](CCCCc2ccncc2)CC3)cc1,C29487655_decoy,CXCR4,Decoy,0,-8.61753,-8.24,-4.7,-3.987234049631886
Cc1cccc(C(=O)N2C[C@H](C[NH+]3CCCC3)[C@H](c3cccc(C(F)(F)F)c3)C2)c1,C34697906_decoy,CXCR4,Decoy,0,-7.21176,-9.54,-1.2,-8.408961791764272
CCCSc1nc(N2CC[NH+](CCC)CC2)c2c(C)c(C)sc2n1,C34758457_decoy,CXCR4,Decoy,0,-9.65367,-7.15,-2.0,-8.601961814715489
N#Cc1cccc(C[NH+](Cc2cccn2Cc2cccc(C(F)(F)F)c2)C2CC2)c1,C35499757_decoy,CXCR4,Decoy,0,-7.81853,-8.89,-2.41,-7.215795030888984
Cc1ccc(C2=NN(C(=O)C[NH+](C)C(C)C)[C@@H](c3cccc(F)c3)C2)cc1C,C35787514_decoy,CXCR4,Decoy,0,-7.69725,-8.31,-0.63,-6.999265949374239
O=C(c1ccco1)N1C[C@@H](C[NH+]2CCCC2)[C@@H](c2cccc(C(F)(F)F)c2)C1,C35885749_decoy,CXCR4,Decoy,0,-6.91331,-8.63,-1.97,-7.678821721288224
COc1ccc([C@H]2c3cccn3CCC[NH+]2Cc2cccc(Cl)c2)cc1OC,C36347671_decoy,CXCR4,Decoy,0,-8.6816,-8.68,-1.98,-8.594663623352261
COc1cc(C[NH+]2CCCn3cccc3[C@@H]2c2cc(C)ccc2C)cc(OC)c1,C36348116_decoy,CXCR4,Decoy,0,-8.96807,-8.66,-4.26,-8.60855199551916
CCOC(=O)C1(Cc2ccccc2C(F)(F)F)CC[NH+](CC2CC2)CC1,C12459058_decoy,CXCR4,Decoy,0,-8.62055,-7.85,-1.78,-9.837621370820534
CCN(CC)c1ccc(N2C(=O)/C(=C/C3=c4ccccc4=[NH+]C3)SC2=S)cc1,C38561105_decoy,CXCR4,Decoy,0,-10.6805,-7.28,-1.02,-8.209401648107756
Cc1nc(-c2ccc(F)cc2)sc1-c1ccc(SC[C@H]2CCCC[NH+]2C)nn1,C38719479_decoy,CXCR4,Decoy,0,-9.08925,-7.07,-1.58,-6.21738523248256
CC(C)CN(C[C@H]1C=c2ccccc2=[NH+]C1=O)C(=O)c1ccccc1Br,C38994407_decoy,CXCR4,Decoy,0,-8.01385,-8.31,-1.69,-8.014009141210392
CO[C@H]1CCC[C@]2(CCC[C@H](S(=O)(=O)C(C)C)C2)[NH+]1Cc1ccccc1,C39520756_decoy,CXCR4,Decoy,0,-8.42467,-5.25,-1.58,-6.0173121292808665
O=C(C1=c2ccccc2=[NH+]C1)[C@@H](Sc1ncnc2sccc12)c1ccccc1,C39991064_decoy,CXCR4,Decoy,0,-8.19475,-8.73,-1.38,-8.038940885908733
C[C@@H](c1ccc(Cl)cc1)[NH+](C)Cc1nc(-c2cc(Br)cs2)no1,C40157200_decoy,CXCR4,Decoy,0,-9.20793,-7.04,-1.43,-7.009416305332752
C[NH+](CCCOc1cccc(C#N)c1)Cc1csc(Br)c1,C42362185_decoy,CXCR4,Decoy,0,-9.01302,-7.51,-1.81,-7.302531928142375
C[NH+](CCOc1ccc(CC#N)cc1)Cc1csc(Br)c1,C42362193_decoy,CXCR4,Decoy,0,-8.74937,-7.46,-2.06,-7.125582300846183
Cc1ccsc1C[NH+]1CC[C@@H]2[C@@H](CCC(=O)N2CCc2ccccc2F)C1,C43608096_decoy,CXCR4,Decoy,0,-9.12354,-9.25,-4.64,-8.957281870838106
COc1ccccc1CN1C[C@H]2C[C@@H](c3cccc(SC)c3)[NH+]3CCC[C@]23C1=O,C43641803_decoy,CXCR4,Decoy,0,-9.63198,-8.76,-3.47,-8.273662816213456
COc1ccccc1[C@H](C)[NH+](C)Cc1cc2c(cc1Br)OCCO2,C46865942_decoy,CXCR4,Decoy,0,-8.94819,-8.58,-1.82,-12.000785254766436
Cc1cc(F)ccc1S(=O)(=O)N1CC[NH+]([C@@H](C)Cc2ccccc2)CC1,C49719516_decoy,CXCR4,Decoy,0,-9.06971,-9.7,-1.4,-8.61193145036471
C[NH+](Cc1ccc(C(F)(F)F)cc1)Cc1cc(F)cc2c1OCOC2,C53403198_decoy,CXCR4,Decoy,0,-7.81647,-10.63,-1.14,-8.655473187439775
CC(C)[C@H](C[NH+](C)C)n1c(CCl)nc2cc(Br)ccc21,C49223068_decoy,CXCR4,Decoy,0,-8.01921,-6.0,-3.68,-8.262022590144829
C[C@@H](c1ccc(Cl)cc1Cl)[NH+](C)CCC(=O)N1CCc2sccc2C1,C59808976_decoy,CXCR4,Decoy,0,-10.0427,-8.57,-1.37,-7.727702271760719
CCOc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)Cc2cccs2)cc1,C63697933_decoy,CXCR4,Decoy,0,-9.33511,-8.65,-0.66,-8.693700687438158
CN(C(=O)CCC1=c2ccccc2=[NH+][C@H]1c1ccc(F)cc1)c1cccc(C#N)c1,C63974734_decoy,CXCR4,Decoy,0,-8.85819,-10.11,-2.44,-8.183051830604102
O=C(CCC[C@@H]1CC=CS1)N1CCC(C2=c3ccccc3=[NH+]C2)CC1,C64176303_decoy,CXCR4,Decoy,0,-9.44092,-7.44,-0.84,-7.457912894970307
CCCC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1c1ccc(OCC)cc1,C64568207_decoy,CXCR4,Decoy,0,-8.45133,-8.45,-2.37,-9.377836303044312
C[C@@H]1CSC(N(C(=O)CCC2=c3ccccc3=[NH+]C2)c2ccc(Cl)cc2)=N1,C64691596_decoy,CXCR4,Decoy,0,-8.93388,-7.47,-1.92,-8.796169066745575
C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2ccc(Cl)s2)SC1=S,C66145111_decoy,CXCR4,Decoy,0,-8.67672,-5.71,-2.74,-6.738623809609886
C[NH+](C)CC(C)(C)CN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S,C66145206_decoy,CXCR4,Decoy,0,-8.53251,-5.74,-2.02,-6.247683466169433
Cc1ncsc1C[NH+](C)Cc1csc(Cc2ccc(Cl)cc2)n1,C66565957_decoy,CXCR4,Decoy,0,-9.61466,-7.26,-1.85,-7.794555299354558
CCN1CCN(C(=O)CC2CC[NH+]([C@H](C)c3ccc(F)c(Cl)c3)CC2)CC1,C66568452_decoy,CXCR4,Decoy,0,-9.54614,-7.59,-1.29,-8.117511537450884
CCN(Cc1ccc(C[NH+](C)C)cc1)C(=O)C[C@H](C)c1ccccc1F,C66725872_decoy,CXCR4,Decoy,0,-7.97799,-7.4,-2.85,-9.29213979221147
CC[C@H](C)[NH+](Cc1ccccc1)Cc1cc(=O)n2cc(Cl)ccc2n1,C66864720_decoy,CXCR4,Decoy,0,-8.48738,-8.36,-1.12,-8.642031543802325
COc1cccc(C[NH2+]CCC[NH+]2CCOCC2)c1OCc1ccccc1,C05019608_decoy,CXCR4,Decoy,0,-8.35477,-7.98,-1.73,-8.514418374126079
COc1cc(C[NH2+]CCC[NH+](C)C)cc(Cl)c1OCc1cccs1,C07539914_decoy,CXCR4,Decoy,0,-7.93042,-6.59,-2.07,-6.8823942048122655
CCOc1cc(C[NH2+]CCC[NH+](C)C)cc(Br)c1OCC,C08253820_decoy,CXCR4,Decoy,0,-8.80948,-6.54,-2.01,-9.698698739009242
C=CCOc1c(Br)cc(C[NH2+]CCC[NH+](C)C)cc1OC,C08373825_decoy,CXCR4,Decoy,0,-8.36883,-6.26,-1.53,-8.134895316870978
C=CCOc1ccc(Br)cc1C[NH2+]CCC[NH+]1CCOCC1,C02860807_decoy,CXCR4,Decoy,0,-8.71969,-6.11,-0.92,-4.675510853913523
CCOc1cccc(/C=[NH+]/C[C@H](c2ccccc2OC)[NH+]2CCCC2)c1O,C22769455_decoy,CXCR4,Decoy,0,-9.42397,-7.84,-1.75,-4.474040333660621
C[NH+](C)CC(C)(C)C[NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1,C34995578_decoy,CXCR4,Decoy,0,-7.623,-6.43,-2.45,-6.741815502861971
COc1ccc(-c2ccc(C[NH2+]CCCn3cc[nH+]c3)o2)cc1Cl,C35758959_decoy,CXCR4,Decoy,0,-7.85242,-7.34,-2.02,-6.890927523583167
CC[C@H](O)C[NH+]1C[C@H](C[NH+]2CCC(C)CC2)[C@H](c2ccc(OC)cc2)C1,C35882270_decoy,CXCR4,Decoy,0,-8.84058,-6.95,-0.74,-8.306353616043497
Cc1ccc2c(c1)=C[C@H](C[NH+](CCCO)Cc1cccc(F)c1)C(=O)[NH+]=2,C38806438_decoy,CXCR4,Decoy,0,-7.821,-8.04,-2.33,-8.566299800764348
COCCN1[C@H](C)C(C)=C(C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1NC(=O)C(C)C,C39272611_decoy,CXCR4,Decoy,0,-8.20863,-6.39,-1.94,-7.619336500236976
CCc1cc(C[NH2+]CC2=CN=[NH+][C@@H]2c2ccc3cc(OC)ccc3c2)on1,C39364409_decoy,CXCR4,Decoy,0,-9.72152,-8.81,-2.27,-9.452666404401969
COc1ccc([C@H]2[NH+]=NC=C2C[NH2+]Cc2cccc(OC)c2OC)c(F)c1,C39430151_decoy,CXCR4,Decoy,0,-7.4355,-8.43,-3.61,-3.8168478828038737
Cc1ccc([C@H]2[NH+]=NC=C2C[NH2+]CCc2nc(C)c3c(n2)CCCC3)cc1C,C39442464_decoy,CXCR4,Decoy,0,-9.0638,-9.65,-2.04,-8.46662553729797
CCOC(=O)CNc1ccccc1[C@@H]1[NH+]=c2cc3ccccc3cc2=[NH+]C1=O,C39697804_decoy,CXCR4,Decoy,0,-8.19929,-8.83,-1.47,-8.207766107725867
Fc1cccc(Cl)c1COc1ccc(C[NH2+]CCCn2cc[nH+]c2)cc1,C40719405_decoy,CXCR4,Decoy,0,-9.24751,-6.83,-2.6,-10.182636322545868
COc1cc(C[NH2+]CCCn2cc[nH+]c2)cc(Br)c1OC(C)C,C40719411_decoy,CXCR4,Decoy,0,-8.72222,-6.54,-1.27,-7.905953709764014
COc1ccc([C@H](CNc2cc(C)[nH+]c3ccc(OC)cc23)[NH+](C)C)cc1,C41474285_decoy,CXCR4,Decoy,0,-8.5837,-7.8,-0.77,-8.560488592029344
CCOc1c(Br)cc(C[NH2+][C@H](C)CC[NH+](C)C)cc1OC,C49553913_decoy,CXCR4,Decoy,0,-8.61287,-6.67,-1.97,-10.596057542501676
COc1cccc([C@@H](CNC(=O)CCc2[nH+]cc(-c3ccc(F)cc3)o2)[NH+](C)C)c1,C22683762_decoy,CXCR4,Decoy,0,-8.60697,-8.93,-2.19,-8.025129208856738
O=C(C[NH+]1CCC[C@H]2CCCC[C@@H]21)NC[C@@H]1CC[NH+](CC(F)(F)F)C1,C51476692_decoy,CXCR4,Decoy,0,-7.81823,-8.31,-3.6,-7.497828030528787
CC(C)C[NH2+]Cc1cc(Br)cnc1OCC[NH+]1CCCC1,C51548972_decoy,CXCR4,Decoy,0,-8.84481,-6.74,-4.2,-4.562127184407319
CCC[NH2+]Cc1cc(Br)cnc1OCC[C@H]1CCC[NH+]1C,C51549460_decoy,CXCR4,Decoy,0,-7.59825,-6.7,-1.73,-8.359751567133559
CCCC[NH+](C)CC1CC[NH+](C[C@@H](O)COc2cccc(C)c2)CC1,C52209229_decoy,CXCR4,Decoy,0,-8.34122,-7.69,-1.69,-7.972857973477706
CC[NH+](CC)CCCNc1ccc(-c2ccc(Br)cc2)n[nH+]1,C20723817_decoy,CXCR4,Decoy,0,-8.94864,-7.03,-1.97,-7.330988782593253
C[C@@H](C[NH2+]Cc1cc(Br)c2c(c1)OCO2)C[NH+]1CCCC1,C57994146_decoy,CXCR4,Decoy,0,-8.80908,-7.5,-2.81,-3.993325269205467
C=CCOc1c(Br)cc(C[NH2+]C[C@@H]2CCC[NH+]2CC)cc1OC,C22936682_decoy,CXCR4,Decoy,0,-9.45021,-6.64,-1.89,-8.675878182380233
CCCOc1c(Cl)cc(C[NH2+]C[C@@H]2CCC[NH+]2CC)cc1OCC,C20968154_decoy,CXCR4,Decoy,0,-8.70734,-6.7,-2.45,-3.688904956219848
C[NH+](C)Cc1ccccc1C[NH2+]Cc1ccc(OC(F)F)cc1OC(F)F,C61557460_decoy,CXCR4,Decoy,0,-6.94576,-7.82,-2.09,-7.164708784208276
C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C[NH+]1CCCC1,C62071780_decoy,CXCR4,Decoy,0,-8.22101,-6.93,-1.7,-8.278524061383683
COc1cc(C[NH2+]CC(C)C)cc(Br)c1OCC[NH+](C)C,C62729758_decoy,CXCR4,Decoy,0,-8.04586,-5.97,-1.39,-7.388678629841767
C[NH+](C)[C@H](CNC(=O)CCCC1=c2ccccc2=[NH+]C1)c1cccs1,C63117505_decoy,CXCR4,Decoy,0,-9.20768,-8.08,-2.24,-7.943524377101658
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N/N=C/c1ccc(C(F)(F)F)cc1,C63135129_decoy,CXCR4,Decoy,0,-6.97329,-7.56,-1.69,-6.67457157574833
CCc1cccc(C)c1NC(=O)[C@@H](CC)S[C@@H]1[NH+]=c2cccnc2=[NH+]1,C63558165_decoy,CXCR4,Decoy,0,-8.53912,-8.91,-2.26,-4.155066765282678
CCc1cccc(CC)c1NC(=O)[C@H](CC)S[C@H]1[NH+]=c2cccnc2=[NH+]1,C63558176_decoy,CXCR4,Decoy,0,-8.97139,-8.28,-3.83,-4.430663616120444
COc1ccc2c(c1)=[NH+][C@@H](SCC(=O)NCCCc1ccccc1)[NH+]=2,C63732853_decoy,CXCR4,Decoy,0,-8.03629,-7.3,-1.62,-6.9565184910017805
O=C(CC1=c2ccccc2=[NH+]C1)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C63794371_decoy,CXCR4,Decoy,0,-8.45831,-9.22,-0.38,-8.138831436241844
CC[C@H]1[NH+]=c2ccc(C[NH2+]Cc3cc(OC)c4c(c3)OCO4)cc2=C1C,C64066858_decoy,CXCR4,Decoy,0,-9.3771,-8.44,-2.51,-7.24413980629946
COc1cccc([C@H](CNC(=O)CC2=c3cc(C)ccc3=[NH+][C@H]2C)[NH+](C)C)c1,C64069802_decoy,CXCR4,Decoy,0,-8.96659,-9.36,-2.84,-8.010255720222483
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1cccc(C(F)(F)F)c1)[NH+]=2,C64097669_decoy,CXCR4,Decoy,0,-7.77876,-8.96,-0.98,-7.476847381783839
CCCC1=[NH+][C@H](CCCC(=O)N2CC=C(C3=c4ccccc4=[NH+]C3)CC2)ON1,C64117913_decoy,CXCR4,Decoy,0,-8.49853,-7.44,-1.79,-7.607418204981291
CCCC1=[NH+][C@@H](CCCC(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2C)ON1,C64120306_decoy,CXCR4,Decoy,0,-7.78804,-9.67,-0.62,-8.107459724702089
CC(C)=CC[NH+]1CCNC(=O)[C@H]1CC(=O)N(C)C[C@H]1[NH+]=c2ccccc2=C1C,C64158316_decoy,CXCR4,Decoy,0,-9.42283,-9.03,-1.85,-8.301457069761623
CC1=c2cc(Cl)ccc2=[NH+][C@H]1CN1CC[NH+](CC(C)C)[C@H](CCO)C1,C64636365_decoy,CXCR4,Decoy,0,-9.59482,-8.48,-1.56,-4.121267746697476
CCN1CC[NH+](CCCC[NH2+]Cc2cc(Cl)cc(Cl)c2OC)CC1,C65890890_decoy,CXCR4,Decoy,0,-10.1338,-6.75,-1.07,-9.506495682732693
CCC[NH+]1CCC(N(C)C(=O)NC[C@H](CC(C)C)[NH+](CC)CC)CC1,C66176897_decoy,CXCR4,Decoy,0,-8.49296,-6.91,-2.01,-7.686072081643768
CC[NH+](CC)[C@@H](C)CNC(=O)N(C)C1CC[NH+](C2CCC(C)CC2)CC1,C66178315_decoy,CXCR4,Decoy,0,-7.8936,-7.7,-4.59,-3.624123868143088
CCCC[NH+](C)CC1CC[NH+]([C@@H](C)C(=O)NC2(C#N)CCCCC2)CC1,C66960819_decoy,CXCR4,Decoy,0,-8.57437,-7.43,-1.44,-8.14657812908226
Fc1ccccc1COc1cccc(C[NH2+]CCCCn2cc[nH+]c2)c1,C67216283_decoy,CXCR4,Decoy,0,-7.60444,-8.34,-1.84,-7.717858661471735
COc1cc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)c(-c2ccccc2)cc1OC,C67500476_decoy,CXCR4,Decoy,0,-7.63088,-7.59,-3.25,-8.036756012713015
C[NH2+]CCC[NH2+]Cc1ccc(OCc2c(F)cccc2Cl)c(OC)c1,C05268210_decoy,CXCR4,Decoy,0,-7.7376,-6.42,-3.57,-7.361626113563337
C[NH2+]CCC[NH2+]Cc1cc(Cl)c(OCc2cccs2)c(OC)c1,C07539994_decoy,CXCR4,Decoy,0,-8.58479,-6.02,-2.7,-3.4489983820075394
COc1cc(C[NH2+]C2CCC2)ccc1OC[C@H](O)C[NH+](C)C1CCCCC1,C11764569_decoy,CXCR4,Decoy,0,-9.33822,-7.76,-3.56,-10.275382769116248
COc1ccc(OC[C@@H](O)C[NH+](C)C)c(C[NH2+]Cc2cc(F)ccc2F)c1,C12057269_decoy,CXCR4,Decoy,0,-7.93326,-7.01,-1.68,-7.370624294790162
CCCC[NH+](C)[C@@H](C[NH3+])c1cc(Cl)c(OCC)c(OCC)c1,C32089012_decoy,CXCR4,Decoy,0,-8.87817,-6.89,-3.13,-10.00083845482551
CCCC[NH+](C)[C@H](C[NH3+])c1cc(Cl)c(OCC)c(OCC)c1,C32089015_decoy,CXCR4,Decoy,0,-8.52168,-6.63,-0.91,-10.141097027095446
CCCOc1c(Cl)cc([C@@H](C[NH3+])[NH+](CC)CC)cc1OCC,C32089027_decoy,CXCR4,Decoy,0,-8.163,-6.75,-1.5,-8.392155539409622
CCCOc1c(Cl)cc([C@H](C[NH3+])[NH+](CC)CC)cc1OCC,C32089031_decoy,CXCR4,Decoy,0,-8.43482,-6.59,-1.82,-9.586356485886206
CC[C@@H](C)C[NH+](C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37172676_decoy,CXCR4,Decoy,0,-9.19185,-7.15,-2.53,-4.948861078596765
CCC[C@H](C)[NH+](C)[C@@H](C[NH3+])c1cc(OC)c(OC)cc1Br,C37754985_decoy,CXCR4,Decoy,0,-7.9824,-6.19,-1.58,-8.541898806788549
Cc1ccc(NC(=O)C[NH2+]C[C@H](c2ccccc2)[NH+](C)C)cc1F,C22038313_decoy,CXCR4,Decoy,0,-7.98202,-8.56,-1.66,-4.197155429556026
CCC[NH+](C(C)C)[C@@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37095863_decoy,CXCR4,Decoy,0,-8.97774,-7.13,-1.43,-5.509621036431285
CCCCc1[nH]cc(CN2CC[NH+](CCC(C)C)[C@H](CCO)C2)[nH+]1,C39362351_decoy,CXCR4,Decoy,0,-8.79393,-6.12,-1.98,-7.166800645806107
CC1=C(CC[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCCCC2)[C@@H](C)N=N1,C39380642_decoy,CXCR4,Decoy,0,-8.30989,-7.88,-2.51,-8.18148010382205
CC[NH+]1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]C[C@@H]2C=CN=N2)C[C@@]1(C)CO,C39485379_decoy,CXCR4,Decoy,0,-8.1049,-7.59,-2.2,-8.649465355078478
C[NH+](C)[C@@H](C[NH2+]C[C@@H](O)COCC1=CC[C@@H]2C[C@H]1C2(C)C)c1ccccc1,C22779201_decoy,CXCR4,Decoy,0,-8.34396,-8.16,-1.66,-7.331972166722847
Cc1ccc(C)c(OC[C@H](O)C[NH2+]C[C@@H](c2ccccc2)[NH+](C)C)c1C,C25637822_decoy,CXCR4,Decoy,0,-8.47648,-7.43,-2.59,-7.495473577964752
COc1cc(Br)cc(C[NH2+]CC2CC[NH2+]CC2)c1OC(C)C,C40719569_decoy,CXCR4,Decoy,0,-8.53816,-7.33,-2.18,-9.065384531598784
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OC(C)C,C40719596_decoy,CXCR4,Decoy,0,-9.03018,-6.26,-1.74,-8.240385954514053
C[NH2+]CCC[NH2+]Cc1cc(Cl)c(OCc2cccc(C)c2)c(OC)c1,C40720566_decoy,CXCR4,Decoy,0,-9.02846,-6.17,-1.84,-7.664883818252843
CC[NH+](CC)[C@@H](CNC(=O)N[C@@H](C)Cn1cc[nH+]c1)c1ccccc1Cl,C47927283_decoy,CXCR4,Decoy,0,-8.89144,-7.05,-2.73,-8.466126619141514
COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC(n2cc(C(C)(C)[NH3+])nn2)CC1,C48179673_decoy,CXCR4,Decoy,0,-8.89482,-7.97,-0.77,-7.812609886077479
CCc1ccc([C@@H](CNC(=O)C(=O)Nc2cccc(C[NH+](C)C)c2)[NH+](C)C)cc1,C48846613_decoy,CXCR4,Decoy,0,-7.9022,-7.07,-2.35,-3.700448675649651
COc1cc(C[NH2+][C@H](C[NH+](C)C)C(C)C)cc(Br)c1O,C49195144_decoy,CXCR4,Decoy,0,-8.64494,-6.67,-2.32,-8.61321250997164
COc1cc(C[NH2+][C@@H](C[NH+](C)C)C(C)C)cc(Br)c1O,C49195146_decoy,CXCR4,Decoy,0,-8.19503,-6.55,-1.84,-8.38348381739615
C[C@H](CC[NH+](C)C)[NH2+]C[C@H](O)COc1ccc(Br)cc1,C49557488_decoy,CXCR4,Decoy,0,-8.03944,-6.42,-1.55,-6.638602873488971
C[NH+](C/C=C/C[NH+](C)CC(=O)NC(C)(C)C)CC(=O)NC(C)(C)C,C51905842_decoy,CXCR4,Decoy,0,-7.75289,-6.05,-1.7,-7.602744293678793
O[C@H](C[NH2+]CC[NH+]1CCCC1)COc1cc(Cl)ccc1Cl,C48299045_decoy,CXCR4,Decoy,0,-8.737,-6.9,-1.52,-7.100409491654257
O[C@H](C[NH2+]CC[NH+]1CCCC1)COc1ccc(Cl)c(Cl)c1,C48299154_decoy,CXCR4,Decoy,0,-8.41898,-6.83,-1.95,-7.111401640083744
CC[NH+](CC)[C@@H](C)CNC(=O)NC[C@H](c1ccc(OC)cc1)[NH+]1CCCC1,C47747847_decoy,CXCR4,Decoy,0,-9.56338,-7.96,-2.69,-4.4181975237065885
CCCCc1[nH]cc(C[NH2+]CC[C@H]2C(C)=Nc3ccc(OC)cc32)[nH+]1,C20494684_decoy,CXCR4,Decoy,0,-8.5647,-6.84,-1.25,-7.796497726351327
Cc1ccc(C)c(CS[C@@H]2N=N[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1,C63720211_decoy,CXCR4,Decoy,0,-8.84844,-9.85,-2.26,-7.60073106041175
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@H](SCc2ccc(Cl)cc2)O1,C63761323_decoy,CXCR4,Decoy,0,-9.71514,-8.39,-1.22,-9.230359723303758
Cc1cccc(CS[C@H]2N=N[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1,C63761340_decoy,CXCR4,Decoy,0,-7.77261,-7.92,-3.03,-9.484389598368182
Cc1cccc(CS[C@@H]2N=N[C@@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)c1,C63761341_decoy,CXCR4,Decoy,0,-8.45707,-9.67,-1.16,-7.510384716048186
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@H]1N=N[C@H](SCc2ccc(F)cc2)O1,C63932687_decoy,CXCR4,Decoy,0,-8.89044,-9.49,-1.22,-7.872520402938034
Cc1ccc(CS[C@@H]2N=N[C@H]([C@@H]([NH3+])CC3=c4ccccc4=[NH+]C3)O2)cc1,C64428666_decoy,CXCR4,Decoy,0,-7.21101,-8.94,-3.13,-3.752058214632129
Cc1ccc(CC(=O)N[C@H](CC(C)C)C(=O)NC2[NH+]=c3ccccc3=[NH+]2)cc1,C65305812_decoy,CXCR4,Decoy,0,-7.99172,-7.03,-0.81,-7.4794276837455005
CC(C)C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305844_decoy,CXCR4,Decoy,0,-8.24842,-7.82,-3.11,-3.615942473175645
CC[C@@H](C)[C@@H](NC(=O)c1ccsc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305901_decoy,CXCR4,Decoy,0,-8.95704,-8.41,-1.48,-4.3652487440786425
CC[C@H](C)[C@@H](NC(=O)c1ccsc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305902_decoy,CXCR4,Decoy,0,-8.94308,-8.28,-2.22,-4.293862095852388
CC[C@H](C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305936_decoy,CXCR4,Decoy,0,-7.55328,-9.27,-4.21,-4.223586228513338
CCC[C@@H](NC(=O)c1cc(F)cc(F)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65306024_decoy,CXCR4,Decoy,0,-6.96397,-9.08,-0.78,-7.768338917582219
CCC[C@@H](NC(=O)Cc1ccccc1F)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65306026_decoy,CXCR4,Decoy,0,-7.72202,-8.89,-1.84,-8.199151984034915
CC[NH+](CC)CCCC[NH2+]Cc1c[nH]nc1-c1ccc(Cl)cc1,C65934604_decoy,CXCR4,Decoy,0,-8.46477,-6.44,-3.04,-9.531313573922027
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CC[NH+](CCC)C1,C66701236_decoy,CXCR4,Decoy,0,-9.54361,-6.54,-1.67,-7.709893076339478
CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](c1cccs1)[NH+](C)C)c1ccco1,C67003404_decoy,CXCR4,Decoy,0,-8.22121,-7.66,-4.69,-4.301431095350473
Cc1nn(-c2ccc(F)cc2F)c(C)c1C[NH2+]C[C@H](O)C[NH+]1CCC(C)CC1,C67122458_decoy,CXCR4,Decoy,0,-9.61314,-8.06,-2.57,-4.808105396734739
CCCCn1nc(C)c(C[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)c1Cl,C67122496_decoy,CXCR4,Decoy,0,-8.6744,-5.94,-1.56,-6.64718650043941
CNC(=O)COc1ccccc1C[NH2+]C[C@H](CC(C)C)[NH+]1CCCC1,C67187133_decoy,CXCR4,Decoy,0,-8.67469,-7.14,-1.33,-8.714990479201381
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[NH+](C/C=C/c2ccccc2)CC1,C06638562_decoy,CXCR4,Decoy,0,-8.14377,-9.1,-1.39,-7.015490181435859
COc1ccc(NC(=O)C[NH+]2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)cc1Cl,C09245479_decoy,CXCR4,Decoy,0,-8.62227,-8.72,-4.23,-7.240005392454448
C[C@H](C(=O)Nc1ccc2c(c1)OCCO2)[NH+]1CCN(c2ccc(C(F)(F)F)c[nH+]2)CC1,C09384640_decoy,CXCR4,Decoy,0,-8.92966,-8.51,-3.19,-7.281300415856466
COc1ccc(-c2oc3ncn(CC[NH+](C)C)c(=[NH2+])c3c2-c2ccc(OC)cc2)cc1,C09577336_decoy,CXCR4,Decoy,0,-8.45727,-5.84,-1.97,-6.494092182583477
Cc1cc(C)n2cc(C[NH2+]Cc3c(C(=O)N4CCCC4)nc4sccn34)[nH+]c2c1,C20908003_decoy,CXCR4,Decoy,0,-9.05065,-8.98,-2.13,-11.49745019564799
O=S(=O)(c1ccccc1)N1CC[NH+](CC/[NH+]=c2\cc(O)oc3ccccc23)CC1,C22472613_decoy,CXCR4,Decoy,0,-8.70528,-9.81,-1.61,-10.663486394896449
O=C(NCC[NH+]1CCCCC1)c1ccc(C[NH+]2CCn3cccc3[C@H]2c2ccccc2F)o1,C35846110_decoy,CXCR4,Decoy,0,-8.80776,-8.09,-5.05,-9.7490072372564
COc1ccc([C@H]2C[NH+](C[C@H](O)COC(C)C)C[C@@H]2C[NH+]2CCC(C)CC2)cc1,C35882267_decoy,CXCR4,Decoy,0,-8.9359,-8.55,-2.22,-7.456677467427662
COC(=O)[C@@H]1[NH+]=c2ccccc2=C1NC(=O)C[NH+]1CCN(c2ccc(Cl)cc2)CC1,C38582555_decoy,CXCR4,Decoy,0,-9.0029,-8.33,-2.51,-8.109887050923732
COC(=O)[C@H]1[NH+]=c2ccccc2=C1NC(=O)[C@H](C)[NH+]1CCN(c2ccccc2)CC1,C38605754_decoy,CXCR4,Decoy,0,-8.64855,-7.49,-1.53,-7.457224352084133
COC(=O)[C@@H]1[NH+]=c2ccc(Cl)cc2=C1NC(=O)[C@@H](C)[NH+]1CCN(c2ccccc2)CC1,C38609991_decoy,CXCR4,Decoy,0,-9.40348,-7.57,-1.59,-8.246233902013309
CCOC(=O)[C@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)CC[NH+]1CCCC(C)(C)C1,C38611474_decoy,CXCR4,Decoy,0,-9.96553,-8.02,-1.76,-8.451323594976447
COC(=O)[C@H]1[NH+]=c2cc(OC)ccc2=C1NC(=O)C[NH+]1C[C@]2(C)C[C@H]1C(C)(C)C2,C38627020_decoy,CXCR4,Decoy,0,-9.91509,-8.51,-1.47,-4.397007312766715
COC(=O)[C@H]1[NH+]=c2cc(C)ccc2=C1NC(=O)C[NH+]1CCN(c2ccc(F)cc2)CC1,C38685013_decoy,CXCR4,Decoy,0,-9.454,-9.58,-2.25,-8.174270233805798
COC(=O)[C@@H]1[NH+]=c2cccc(C)c2=C1NC(=O)C[NH+]1CCN(c2cccc(Cl)c2)CC1,C38685599_decoy,CXCR4,Decoy,0,-9.54276,-9.26,-2.46,-4.554807167941586
COC(=O)[C@H]1[NH+]=c2ccc(C)cc2=C1NC(=O)CN1CC[NH+](C/C=C/c2ccccc2)CC1,C38688966_decoy,CXCR4,Decoy,0,-9.26114,-8.75,-4.76,-7.984235904252913
CCOP(=O)(N[C@H](c1ccccc1)[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)OCC,C38689174_decoy,CXCR4,Decoy,0,-7.4767,-7.19,-1.8,-3.58635476666526
CCCOc1ccc([C@H]2C[C@@H](C(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N=[NH+]2)cc1,C38826607_decoy,CXCR4,Decoy,0,-9.04286,-8.75,-3.09,-4.125123427305077
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@H]1NCc1ccco1)c1cccc(Cl)c1,C38965067_decoy,CXCR4,Decoy,0,-8.0268,-9.22,-3.52,-4.091407316641373
CCCCN[C@H]1[NH+]=c2ccccc2=[NH+]/C1=N\S(=O)(=O)c1ccc(OC)cc1,C38966537_decoy,CXCR4,Decoy,0,-8.96667,-6.99,-0.89,-8.7599851927216
O=S(=O)(/N=C1\[NH+]=c2ccccc2=[NH+][C@H]1NCc1ccco1)c1ccc(F)cc1,C38980436_decoy,CXCR4,Decoy,0,-8.20824,-8.34,-3.61,-8.949415125834552
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C[C@H](c2cccc(OCc3ccccc3)c2)[NH+]=N1,C39923036_decoy,CXCR4,Decoy,0,-8.24937,-9.51,-1.47,-4.253626421949598
CCOc1ccc2c(c1)=C[C@@H]([C@H]1N=C3C=CC=CN3[C@H]1[NH2+]Cc1ccco1)C(=O)[NH+]=2,C39980733_decoy,CXCR4,Decoy,0,-8.9147,-8.15,-3.44,-4.0377908905155735
CCOc1ccc2c(c1)=C[C@H]([C@H]1N=C3C=CC=CN3[C@H]1[NH2+]Cc1ccco1)C(=O)[NH+]=2,C39980734_decoy,CXCR4,Decoy,0,-8.51491,-8.18,-3.23,-3.823374144401573
CCOc1ccc2c(c1)=C[C@@H](c1[nH+]c3cc(C)ccn3c1NCCOC)C(=O)[NH+]=2,C39982293_decoy,CXCR4,Decoy,0,-8.12476,-7.45,-2.98,-4.450213320842292
O=S(=O)(NCCCC1[NH+]=c2cc3ccccc3cc2=[NH+]1)c1ccc2c(c1)OCCO2,C40011829_decoy,CXCR4,Decoy,0,-10.4764,-9.57,-0.92,-9.018939055769884
CC[NH+](Cc1ccc(OC)c(OC)c1)Cc1cc(O)oc2c/c(=[NH+]\C(C)=O)ccc1-2,C45772623_decoy,CXCR4,Decoy,0,-8.99792,-7.41,-2.39,-8.289886331146391
O=C1[NH+]=c2ccc(S(=O)(=O)N[C@H](c3ccc(F)cc3)c3cccs3)cc2=[NH+]C1=O,C39780951_decoy,CXCR4,Decoy,0,-8.59077,-9.52,-1.14,-8.755865416895329
COc1ccc([C@@H]2C[C@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)N=[NH+]2)c(OC)c1,C63302950_decoy,CXCR4,Decoy,0,-8.53906,-7.41,-0.77,-7.339020132360817
COc1ccc([C@@H]2C[C@@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)N=[NH+]2)c(OC)c1,C63302952_decoy,CXCR4,Decoy,0,-8.37278,-7.95,-2.6,-4.248245811812637
CCCSc1ccc2c(c1)=[NH+][C@@H](NC(=O)CSc1nc(C)cc(C)n1)[NH+]=2,C63308921_decoy,CXCR4,Decoy,0,-9.08104,-8.07,-1.69,-7.188099105846559
COC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)CCCC1=c2ccccc2=[NH+]C1,C63384354_decoy,CXCR4,Decoy,0,-9.90198,-8.56,-2.68,-4.81453183246168
COc1cc(C(=O)Nc2ccccc2C2[NH+]=c3ccccc3=[NH+]2)cc(OC)c1OC,C63637944_decoy,CXCR4,Decoy,0,-8.02112,-8.94,-2.52,-3.948251314164615
CCOc1ccc(CNC(=O)C2CCN(C3[NH+]=c4ccccc4=[NH+]3)CC2)cc1OC,C63695146_decoy,CXCR4,Decoy,0,-8.20175,-8.85,-1.63,-8.062514388674213
O=C(Cc1ccc(Cl)cc1)Nc1nnc(SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)s1,C63752007_decoy,CXCR4,Decoy,0,-9.74566,-9.54,-0.93,-9.86135137945278
Cc1cc2c(cc1C)=[NH+][C@H](CSc1nnc(NC(=O)C(C)(C)C)s1)C(=O)[NH+]=2,C63752062_decoy,CXCR4,Decoy,0,-8.93787,-7.62,-2.81,-7.436198041204619
CCCC(=O)Nc1nnc(SC[C@@H]2[NH+]=c3cc(C)c(C)cc3=[NH+]C2=O)s1,C63752069_decoy,CXCR4,Decoy,0,-9.14134,-7.49,-2.14,-3.7686763064552338
CCOc1ccc(/C=N/NC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)cc1OC,C63962998_decoy,CXCR4,Decoy,0,-8.9824,-7.18,-1.87,-9.333304529809588
CCn1nc(C(=O)N2CCOCC2)c2c1CC[C@@H]([NH2+]CCC1=c3ccccc3=[NH+]C1)C2,C64002129_decoy,CXCR4,Decoy,0,-8.41702,-9.02,-2.48,-4.922967087261854
CC[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C64061498_decoy,CXCR4,Decoy,0,-8.83909,-7.59,-2.27,-3.955588690414016
C[C@@H](C(=O)NCC1[NH+]=c2ccccc2=[NH+]1)n1nc(-c2ccc(F)cc2)ccc1=O,C64411037_decoy,CXCR4,Decoy,0,-8.14584,-7.36,-2.29,-6.783964603308577
O=C(NCC1CCC(C2[NH+]=c3ccccc3=[NH+]2)CC1)[C@@H]1C=C(c2ccco2)N=N1,C64414477_decoy,CXCR4,Decoy,0,-7.025,-9.88,-0.23,-8.005452034385554
COc1ccc2c(c1)=[NH+][C@@H](C(=O)N1CCC(CC(=O)NCC[C@@H](C)[NH+]3CCCC3)CC1)C=2,C64540912_decoy,CXCR4,Decoy,0,-9.55908,-9.02,-1.96,-4.369792943857598
Cc1ccc2c(c1)=[NH+][C@@H](SCc1noc(CCC(=O)Nc3c(F)cccc3F)n1)[NH+]=2,C64604281_decoy,CXCR4,Decoy,0,-8.77874,-8.24,-1.82,-7.25414557725043
Cc1ccc2c(c1)=[NH+][C@H](SCc1noc(CCC(=O)Nc3ccc(F)cc3F)n1)[NH+]=2,C64604295_decoy,CXCR4,Decoy,0,-8.72748,-9.51,-2.95,-7.727082315475787
CC1=c2ccccc2=[NH+][C@H]1C[NH+]1CCC(n2nccc2NC(=O)[C@H]2CCOC2)CC1,C64625794_decoy,CXCR4,Decoy,0,-8.82498,-9.83,-1.58,-8.364488418543191
CC[C@H](NC(=O)c1cn(Cc2ccccc2F)nn1)[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1,C64636604_decoy,CXCR4,Decoy,0,-8.37127,-9.35,-1.58,-12.539645631296802
CC(=O)N1CCCSc2ccc(S(=O)(=O)NCCC3[NH+]=c4ccccc4=[NH+]3)cc21,C64952232_decoy,CXCR4,Decoy,0,-8.7906,-8.17,-1.8,-7.628650245654367
CCN(CC[C@@H]1[NH+]=c2ccc(C)cc2=[NH+]1)C(=O)[C@H]1C=C(c2ccccc2O)N=N1,C65421546_decoy,CXCR4,Decoy,0,-8.99562,-8.19,-3.33,-4.103117761520485
CC[NH+](CC)[C@@H](CNC(=O)N(C)C1CC[NH+](C2CCOCC2)CC1)CC(C)C,C66176901_decoy,CXCR4,Decoy,0,-8.8397,-7.75,-3.12,-9.62534980565319
CCOC(=O)[C@@]1(Cc2ccccc2)[NH2+][C@@H](c2ccc(F)cc2)[C@H]2C(=O)N(C)C(=O)[C@H]21,C04883453_decoy,CXCR4,Decoy,0,-8.12363,-8.64,-1.5,-9.26171061489581
COc1cc2c(cc1OC)[C@H]1C[NH2+]C[C@@H]1[C@@H](c1cc(OC)c(OC)c(OC)c1)C2,C05022895_decoy,CXCR4,Decoy,0,-9.24009,-6.61,-1.26,-7.500627456358285
CSc1ccc(C[NH+](C)CC(=O)Nc2cc(Cl)ccc2-n2cncn2)cc1,C08066231_decoy,CXCR4,Decoy,0,-9.14394,-7.71,-3.75,-2.998994864728368
CC[NH+](CC)CCN1C(=O)C(=O)/C(=C(/O)c2cc(C)ccc2C)[C@@H]1c1ccncc1,C06078415_decoy,CXCR4,Decoy,0,-9.08569,-8.15,-2.04,-8.268498385337676
COc1ccc(C(=O)C[C@]2(O)C(=O)N(C[NH+]3CCCCCC3)c3ccccc32)cc1,C08569918_decoy,CXCR4,Decoy,0,-8.12002,-9.03,-1.72,-7.411655220154641
Cc1ccsc1C[NH+](C)CC(=O)Nc1c(C#N)c(C)c(C)n1C[C@H]1CCCO1,C09256800_decoy,CXCR4,Decoy,0,-9.10658,-7.62,-3.63,-7.84155741795132
C[C@H](Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(F)cc1)C(=O)Nc1ccccc1F,C09641044_decoy,CXCR4,Decoy,0,-9.38466,-8.56,-2.06,-4.4627470165813925
COc1ccc(N2CC[NH+](CCNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1,C11900589_decoy,CXCR4,Decoy,0,-10.0048,-8.15,-1.18,-7.225253843897063
CCOc1cc2c(cc1C[NH+]1CCC(NC(C)=O)(c3ccccc3F)CC1)OCO2,C12292806_decoy,CXCR4,Decoy,0,-8.85294,-9.15,-1.69,-9.624121642291788
Cc1ccc(Cn2cnc3sc4c(c3c2=O)CC[C@H]([NH2+]CCCn2ccnc2)C4)cc1,C12242488_decoy,CXCR4,Decoy,0,-9.30906,-7.0,-2.46,-6.598880805868368
Cc1cccc(C)c1OC[C@@H](O)C[NH+]1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1,C13022880_decoy,CXCR4,Decoy,0,-8.04954,-8.68,-1.86,-7.145072859524396
Cc1noc2nc(-c3cccs3)cc(C(=O)N[C@H](C)C[NH+](C(C)C)C(C)C)c12,C13642135_decoy,CXCR4,Decoy,0,-8.64764,-7.97,-0.65,-8.655234537481617
CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H]([NH2+]CC1(c3ccccc3)CCOCC1)C2,C14535971_decoy,CXCR4,Decoy,0,-9.68756,-7.73,-1.09,-9.251224619677544
CC(C)Cn1nc(C(=O)N2CCOCC2)c2c1CC[C@H]([NH2+]CCc1ccccc1F)C2,C14751796_decoy,CXCR4,Decoy,0,-8.98579,-8.63,-2.6,-12.886321073336854
CCOC(=O)[C@]1(Cc2ccccc2)[NH2+][C@H](c2ccccc2F)[C@H]2C(=O)N(CC)C(=O)[C@@H]21,C12635494_decoy,CXCR4,Decoy,0,-7.88222,-5.52,-2.15,-2.9822261562790024
COc1ccc(OC)c([C@H](O)C[NH+]2CCC(c3noc4cc(F)ccc34)CC2)c1,C19551140_decoy,CXCR4,Decoy,0,-8.78609,-9.68,-3.12,-7.865011283295524
COc1cccc2c1OCC(CN1CCC([NH+]3CCC(C(=O)NC(C)C)CC3)CC1)=C2,C20906778_decoy,CXCR4,Decoy,0,-9.04963,-7.79,-0.84,-6.995392977656572
COc1ccc([C@@H](CNC(=O)c2cc(=O)c3cc(Cl)ccc3o2)[NH+](C)C)cc1,C20932298_decoy,CXCR4,Decoy,0,-8.98844,-9.29,-2.01,-11.039450658734358
CCOC(=O)N1CCC(C(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)CC1,C22619213_decoy,CXCR4,Decoy,0,-9.54781,-8.06,-4.07,-2.575450160786452
Cc1cccc(OCCNC(=O)C[NH+]2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1,C23004885_decoy,CXCR4,Decoy,0,-9.0518,-9.88,-1.96,-7.559916238639929
C[NH+]1CCN(c2nnc(SCC(=O)Nc3ccccc3C(F)(F)F)s2)CC1,C23139716_decoy,CXCR4,Decoy,0,-7.67823,-6.67,-2.48,-6.592963904303274
CCOC(=O)N1CCC([NH2+]Cc2cc3ccc(F)cc3n(CC(C)C)c2=O)CC1,C23339270_decoy,CXCR4,Decoy,0,-9.83108,-8.01,-1.33,-11.988846068686009
CC1CC[NH+]([C@@H](CNC(=O)Cn2c(=O)n(C)c3ccccc32)c2cccs2)CC1,C24924986_decoy,CXCR4,Decoy,0,-8.66765,-8.8,-1.55,-8.298104873532912
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NC[C@H](c3ccsc3)[NH+](C)C)c12,C25331844_decoy,CXCR4,Decoy,0,-9.66363,-8.37,-2.21,-8.669546743921657
COc1ccc([C@@H]2CCC[NH+]2CC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1,C28973255_decoy,CXCR4,Decoy,0,-8.35851,-9.31,-3.85,-4.374006353390186
CCOc1ccc(NC(=O)[C@H](C)[NH+]2CCN(c3ccc(Br)cn3)CC2)cc1,C30201572_decoy,CXCR4,Decoy,0,-9.40676,-8.15,-2.05,-9.163045032945654
COc1ccc([C@H](CNS(=O)(=O)c2ccc(C)cc2)N2CC[NH+](C)CC2)cc1,C22579376_decoy,CXCR4,Decoy,0,-9.05582,-7.99,-3.65,-8.227202171233019
Cc1ccc(NC(=O)COc2coc(C[NH+]3CCc4ccccc4C3)cc2=O)c(C)c1,C04583862_decoy,CXCR4,Decoy,0,-8.27531,-8.87,-3.69,-7.308054340462151
COc1ccc(F)cc1S(=O)(=O)NC[C@@H](c1ccc2c(c1)CCN2C)[NH+](C)C,C38670090_decoy,CXCR4,Decoy,0,-8.50819,-8.7,-2.51,-4.121595872844145
O=C(Cn1c(=O)oc2ccccc21)NC[C@H](c1ccsc1)[NH+]1CCCCCC1,C38673588_decoy,CXCR4,Decoy,0,-9.50343,-8.86,-0.26,-8.006009569333333
Cc1ccc(N2C[C@@H](C(=O)NC[C@@H](c3cccn3C)[NH+]3CCCCCC3)CC2=O)cc1C,C38677618_decoy,CXCR4,Decoy,0,-9.07805,-9.06,-2.84,-8.036776957452343
Cc1ccc([C@H](CNC(=O)COc2ccc(Br)cc2)N2CC[NH+](C)CC2)o1,C22938369_decoy,CXCR4,Decoy,0,-9.51853,-8.18,-1.92,-8.977384402532351
CCn1cnnc1-c1cccc(NC(=O)[C@H](c2ccccc2)[NH+]2CCSCC2)c1,C48302759_decoy,CXCR4,Decoy,0,-8.82593,-9.27,-1.91,-4.139728864436219
N#Cc1cc(I)c(OCCC[C@@H]2CCC[NH2+]2)c([N+](=O)[O-])c1,C52765294_decoy,CXCR4,Decoy,0,-6.97042,-6.67,-2.53,-3.2332914691880683
Cc1ccc(C)c(OC[C@@H](O)CN2CCN(c3cc(C)[nH+]c(C(C)C)n3)CC2)c1,C29632305_decoy,CXCR4,Decoy,0,-8.75046,-7.73,-2.81,-6.6506366573712254
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCC[NH+]3CCCCC3)c2C)cc1,C59280381_decoy,CXCR4,Decoy,0,-7.49114,-7.67,-1.86,-7.501407178848328
C[C@H](Cn1cc[nH+]c1)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1,C52749707_decoy,CXCR4,Decoy,0,-8.59691,-8.04,-3.49,-8.214916052313725
COc1ccccc1[C@@H](CNC(=O)Cc1cn2ccsc2n1)[NH+]1CCCCC1,C59782611_decoy,CXCR4,Decoy,0,-8.95997,-8.65,-2.3,-5.2302904699154045
CC(C)Oc1ccc(Cl)cc1C(=O)NCc1ccc(C(=O)N2CC[NH+](C)CC2)cc1,C59994739_decoy,CXCR4,Decoy,0,-7.99893,-8.75,-2.41,-7.880050432283876
C[C@@H]1[NH+]=c2ccc(F)cc2=C1CCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1,C63279877_decoy,CXCR4,Decoy,0,-8.44268,-8.37,-2.5,-8.390244314913058
COc1ccc2c(c1)OC(=O)[C@@H](CCC(=O)NCCC1=c3cc(F)ccc3=[NH+]C1)[C@H]2C,C63490744_decoy,CXCR4,Decoy,0,-8.27206,-9.74,-0.95,-7.394479196805773
CCOc1ccccc1NC(=O)[C@@H]1CC(=O)N(CCC2=c3cc(F)ccc3=[NH+]C2)C1,C63557574_decoy,CXCR4,Decoy,0,-7.01024,-9.38,-1.75,-6.888226265696534
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1,C63731041_decoy,CXCR4,Decoy,0,-9.1514,-8.98,-2.01,-9.062882304904935
O=C(Cn1cnc2scc(-c3cccs3)c2c1=O)NCCC1=c2ccccc2=[NH+]C1,C63731164_decoy,CXCR4,Decoy,0,-10.7459,-9.74,-1.95,-11.263612031266602
Cc1cnc(C)c(-c2ccc3c(c2)C[C@H](CNC(=O)CCC2=c4ccccc4=[NH+]C2)O3)n1,C64006923_decoy,CXCR4,Decoy,0,-8.88484,-10.24,-3.1,-8.827795971465205
c1ccc2c(c1)=[NH+]CC=2C1=NN[C@@H](SC[C@@H]2CCCCO2)N1C[C@@H]1CCCO1,C64055081_decoy,CXCR4,Decoy,0,-8.92117,-8.28,-2.43,-3.933513247038533
CN(C[C@@H]1C=c2cc(F)ccc2=[NH+]1)C(=O)[C@@H]1C=C(COc2c(F)cccc2F)ON1,C64093545_decoy,CXCR4,Decoy,0,-7.41697,-9.89,-1.77,-4.152765644956375
COc1cccc([C@@H](CN2C(=O)[C@@H](C)NC2=S)C2=c3ccccc3=[NH+]C2)c1OC,C64155885_decoy,CXCR4,Decoy,0,-6.79951,-7.57,-1.97,-7.973697115536757
Cc1nc(NC(=O)CCC2=c3ccccc3=[NH+]C2)sc1-c1nccn1C(F)F,C64353841_decoy,CXCR4,Decoy,0,-9.33703,-7.94,-2.3,-7.288498869817847
CC[NH+]1CCN(CCCNC(=O)c2ccc(-c3ccc4c(c3)CCN4C(C)=O)cc2)CC1,C65026996_decoy,CXCR4,Decoy,0,-8.23375,-7.03,-3.37,-5.939463411081557
CC[NH+](CC)CC(=O)N1CC[C@]2(CCC[NH+](CCC3CCCCC3)C2)C1,C12714653_decoy,CXCR4,Decoy,0,-8.4492,-6.58,-0.94,-7.209799160251471
O=C(C1CC1)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[NH+](C2CCCC2)C1,C14965662_decoy,CXCR4,Decoy,0,-9.0915,-7.34,-0.54,-7.829847521892496
COc1ccc(/C=[NH+]/CC[C@]2(c3ccccc3)C[C@@H](C)[NH+](C)C[C@@H]2C)cc1,C13381831_decoy,CXCR4,Decoy,0,-9.38019,-8.17,-2.04,-8.125442203431302
CC[NH+](CC1=Cc2cc(Cl)ccc2OC1)CC1CCN(C2CC[NH+](C)CC2)CC1,C15077010_decoy,CXCR4,Decoy,0,-9.74727,-8.11,-3.29,-7.434690024240559
C[C@H](/[NH+]=C/c1ccc(N(C)C)cc1)[C@H](C)/[NH+]=C/c1ccc(N(C)C)cc1,C02252306_decoy,CXCR4,Decoy,0,-8.16013,-7.54,-1.54,-4.390111323936319
COc1cc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)ccc1OCc1ccccc1,C39252991_decoy,CXCR4,Decoy,0,-8.73793,-6.75,-1.04,-5.9325191836389175
Cc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C/c1ccc(N3CCCCC3)cc1)[NH+]=2,C39351887_decoy,CXCR4,Decoy,0,-8.71333,-7.31,-0.41,-6.233435770133757
Cc1cc(/C=C(/C#N)C2[NH+]=c3ccccc3=[NH+]2)c(C)n1[C@@H]1S[C@H]2CCCCC2=C1C#N,C39353201_decoy,CXCR4,Decoy,0,-8.18314,-8.74,-1.16,-7.75876974988246
CC(C)Oc1ccc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)c(OC(C)C)c1,C39370759_decoy,CXCR4,Decoy,0,-8.23628,-8.27,-2.77,-7.638321418077201
N#C/C(=C/c1ccc(OCc2ccccc2)cc1)C1[NH+]=c2ccccc2=[NH+]1,C39412157_decoy,CXCR4,Decoy,0,-8.22563,-8.69,-2.29,-4.051786640443159
COc1cc(/C=C(/C#N)[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)ccc1OCc1ccccc1,C39412175_decoy,CXCR4,Decoy,0,-8.43694,-7.8,-2.95,-6.393801575360092
COc1ccc(-c2nc(-c3ccc4c(c3)=[NH+]C(=O)[NH+]=4)cs2)cc1,C39422729_decoy,CXCR4,Decoy,0,-7.82758,-8.26,-0.93,-6.466356392986066
CCOc1cccc(-c2nc(-c3ccc4c(c3)=[NH+]C(=O)[NH+]=4)cs2)c1,C39439035_decoy,CXCR4,Decoy,0,-7.76451,-9.29,-1.14,-3.6850547083958767
COCC[NH+]1CCC(C[NH+](CC2CCCC2)C[C@H]2CCCO2)CC1,C15067196_decoy,CXCR4,Decoy,0,-8.4476,-6.93,-0.96,-8.128620963117651
N#C/C(=C\[C@@H]1CN(Cc2ccc(Cl)cc2Cl)c2ccccc21)C1[NH+]=c2ccccc2=[NH+]1,C39702041_decoy,CXCR4,Decoy,0,-9.25294,-9.77,-3.14,-7.674899749779137
COc1cccc(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)c1OC,C39708035_decoy,CXCR4,Decoy,0,-7.24424,-8.1,-1.06,-6.559921814060195
C#CCOc1ccc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)cc1OC,C39709631_decoy,CXCR4,Decoy,0,-8.05669,-7.29,-2.03,-6.60695786857211
Clc1ccc([C@H]2[NH+]=c3ccc(/N=C/c4ccccc4)cc3=[NH+]2)c(Cl)c1,C39709907_decoy,CXCR4,Decoy,0,-9.66626,-7.82,-1.74,-7.583529278252243
O=C1[NH+]=c2ccc(C(=O)/C=C/c3ccccc3C(F)(F)F)cc2=[NH+]1,C39751846_decoy,CXCR4,Decoy,0,-7.45972,-9.83,-1.03,-10.434531294676544
Cc1cccc(Cn2cc(/C=C(\C#N)C3[NH+]=c4ccccc4=[NH+]3)c3ccccc32)c1,C39934786_decoy,CXCR4,Decoy,0,-9.6082,-8.85,-0.99,-7.40737008379425
CCOc1cc(Br)c(/C=C(\C#N)[C@@H]2[NH+]=c3ccc(C)cc3=[NH+]2)cc1OC,C39934836_decoy,CXCR4,Decoy,0,-8.30116,-8.23,-1.74,-7.741357001690365
Cc1ccc(C(F)(F)C(F)(F)c2ccccc2C2[NH+]=NN=[NH+]2)cc1,C39939810_decoy,CXCR4,Decoy,0,-6.24935,-9.06,-2.04,-7.267437940248767
CCOc1ccc(/C=C(/C#N)[C@H]2[NH+]=c3ccc(C)cc3=[NH+]2)c(OCC)c1,C39964797_decoy,CXCR4,Decoy,0,-6.99365,-7.96,-1.08,-7.663175850659573
Cc1cc2c(cc1C)=[NH+]C(/C(C#N)=C\c1ccc(OCC(C)C)cc1)[NH+]=2,C39973144_decoy,CXCR4,Decoy,0,-8.89731,-8.8,-0.55,-8.172688247794982
C#C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2C[NH+](Cc1ccco1)Cc1ccco1,C43525180_decoy,CXCR4,Decoy,0,-7.74487,-7.55,-1.01,-8.565072252934845
CC[NH+](Cc1coc(-c2cccc(Cl)c2)[nH+]1)C[C@@H]1CCOC1,C52072433_decoy,CXCR4,Decoy,0,-8.84385,-6.7,-1.97,-8.057723364958095
C[C@H](C(=O)N1C[C@H](C)O[C@@H](C)C1)[NH+]1CCC(CC[NH+](C)C)CC1,C56523539_decoy,CXCR4,Decoy,0,-7.79494,-6.65,-1.49,-6.448854712133435
CC[C@@H]1c2ccsc2CC[NH+]1Cc1c(C)[nH+]c2cc(C)ccn12,C36741534_decoy,CXCR4,Decoy,0,-9.09499,-7.11,-0.96,-7.475363338309861
CCOc1ccccc1N1C[C@H](C2[NH+]=c3ccccc3=[NH+]2)CC1=O,C63060531_decoy,CXCR4,Decoy,0,-7.52761,-8.53,-2.29,-3.5531487052976827
Cc1ccc2c(c1)=[NH+][C@@H](SCC(=O)c1cc(C)c(C)cc1C)[NH+]=2,C63110678_decoy,CXCR4,Decoy,0,-7.73788,-8.1,-1.7,-7.331151685853789
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N1CCC[C@H]2CCCC[C@@H]21,C63162761_decoy,CXCR4,Decoy,0,-8.46655,-9.71,-0.77,-7.171011143340408
CCOc1ccc(C(=O)N2CCC(C3[NH+]=c4ccccc4=[NH+]3)CC2)cc1,C63206021_decoy,CXCR4,Decoy,0,-8.14429,-6.61,-1.96,-6.512862414090441
Cc1cc(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)ccc1N1CCCC1,C63206034_decoy,CXCR4,Decoy,0,-8.67448,-8.73,-0.46,-6.509245645461722
COc1ccc(N2C[C@H]([C@H]3[NH+]=c4ccc(C)cc4=[NH+]3)CC2=O)cc1,C63221925_decoy,CXCR4,Decoy,0,-7.89481,-7.64,-1.73,-3.1948589907981013
FC(F)(F)c1ccc(/C=N/N2C(=S)[NH+]=N[C@H]2c2cc[nH+]cc2)cc1,C38906361_decoy,CXCR4,Decoy,0,-8.07285,-5.65,-2.09,-5.8678832959316845
CC(=C/c1ccccc1)/C=N/N1C(=S)[NH+]=N[C@H]1c1cc[nH+]cc1,C38917671_decoy,CXCR4,Decoy,0,-7.82963,-6.11,-0.3,-5.761387790036179
S=C1[NH+]=N[C@H](c2cc[nH+]cc2)N1/N=C/C(Cl)=C\c1ccccc1,C38918589_decoy,CXCR4,Decoy,0,-8.8258,-7.99,-4.39,-8.574542939480214
C=CCc1ccc(OCC2[NH+]=c3cc(C)c(C)cc3=[NH+]2)c(OC)c1,C63521189_decoy,CXCR4,Decoy,0,-8.45122,-8.25,-1.76,-4.075479185660798
FC(F)(F)c1ccc2c(c1)=[NH+][C@@H](SCc1cc(Cl)cc3c1OCOC3)[NH+]=2,C63591071_decoy,CXCR4,Decoy,0,-7.23696,-9.89,-2.25,-8.414954421479736
CCOc1ccc2c(c1)=[NH+][C@H](SCC(=O)c1ccc(-c3ccccc3)cc1)[NH+]=2,C63613602_decoy,CXCR4,Decoy,0,-7.63395,-9.77,-1.3,-7.431757450670793
CCOc1ccc2c(c1)=[NH+][C@H](SCC(=O)C1=CC[C@@H](F)C=C1)[NH+]=2,C63637412_decoy,CXCR4,Decoy,0,-7.29261,-7.7,-1.05,-3.669066269445176
COc1ccc2c(c1)=[NH+][C@H](SCC(=O)N1CCCCCC1)[NH+]=2,C63726128_decoy,CXCR4,Decoy,0,-7.28373,-6.34,-0.73,-6.214372512738389
O=C1[NH+]=c2ccccc2=[NH+][C@H]1CS(=O)(=O)c1ccc2ccccc2c1,C63825238_decoy,CXCR4,Decoy,0,-7.43823,-10.16,-1.85,-7.519682718644859
C[NH+](Cc1cc(-c2ccncc2)no1)C[C@@H]1CCC[NH+]2CCCC[C@H]12,C63848113_decoy,CXCR4,Decoy,0,-8.94407,-8.08,-2.2,-8.056350817501627
CC(C)CN(Cc1ccsc1)C(=O)[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O,C63856865_decoy,CXCR4,Decoy,0,-8.09077,-7.38,-0.99,-7.395588847327102
CCOc1ccc2c(c1)=[NH+][C@H](SCC1=N[C@@H]3SC=CN3C1)[NH+]=2,C64383629_decoy,CXCR4,Decoy,0,-8.56863,-7.66,-1.16,-3.4619351691327926
O=C(Oc1ccccc1)C1CCN(C2[NH+]=c3ccccc3=[NH+]2)CC1,C64481513_decoy,CXCR4,Decoy,0,-7.50574,-6.77,-0.27,-6.181168637353117
CSCc1ccc(C(=O)N(C)CC[C@H]2[NH+]=c3ccc(F)cc3=[NH+]2)o1,C65459281_decoy,CXCR4,Decoy,0,-7.61309,-7.77,-3.41,-8.011317993218332
CCN(CC[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1)C(=O)c1csc(C)n1,C65534410_decoy,CXCR4,Decoy,0,-8.61949,-7.08,-1.45,-7.437791200684984
C=CCN(CC=C)C(=O)[C@H](C)[NH+]1CCC(C[NH+](C)CCCC)CC1,C66960706_decoy,CXCR4,Decoy,0,-8.37999,-6.63,-2.7,-6.981460969899119
C[C@H](C(=O)NCC[NH+]1CCOCC1)[C@@H]1CC[C@]2(C)Cc3sc(NC(=O)C4CC4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840755_decoy,CXCR4,Decoy,0,-9.88392,-7.62,-2.73,-4.314036675764168
CCc1cccc2c1NC(=O)[C@]21[NH2+][C@@H](CCC(N)=O)[C@H]2C(=O)N(Cc3ccccc3OC)C(=O)[C@H]21,C02136688_decoy,CXCR4,Decoy,0,-9.98318,-8.85,-1.81,-9.758900770814614
CC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)NCC[NH+]1CCOCC1,C04222360_decoy,CXCR4,Decoy,0,-11.4438,-7.74,-3.66,-4.768162521822174
C[C@]12CC[C@H]3[C@@H](CC[C@@]4(O)C[C@@H](O)CC[C@]34/C=[NH+]/Cc3ccncc3)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1,C08744510_decoy,CXCR4,Decoy,0,-10.7215,-9.75,-2.58,-9.607643463030463
CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](CC(N)=O)[NH2+][C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1,C08789556_decoy,CXCR4,Decoy,0,-9.39165,-7.37,-0.81,-6.36290243566572
COc1ccc2c3c1O[C@@H]1[C@]34CC[NH+](C)[C@H](C2)[C@]42C=C[C@@]1(OC)c1c(O)c(SCCO)cc(O)c12,C08789705_decoy,CXCR4,Decoy,0,-10.6077,-9.52,-0.8,-15.657608079007131
CC[NH+]1CCc2c(sc(NC(=O)[C@H]3CCCN3S(=O)(=O)c3ccc(Cl)cc3)c2C(N)=O)C1,C08869021_decoy,CXCR4,Decoy,0,-9.90478,-8.8,-1.76,-9.290715578274408
COC(C/[NH+]=C/[C@]12CC[C@H](O)C[C@]1(O)CC[C@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O)OC,C08914083_decoy,CXCR4,Decoy,0,-11.5565,-9.37,-2.05,-9.930807081230242
O=C(CSc1nnc(-c2ccc(F)cc2)n1CC[NH+]1CCOCC1)Nc1ccc2[nH]c(=O)[nH]c2c1,C09477320_decoy,CXCR4,Decoy,0,-10.2844,-8.18,-1.18,-8.02306367718884
Cc1cc(-c2ccccc2)cc(C)[n+]1CC(=O)Nc1cc(Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O,C13804364_decoy,CXCR4,Decoy,0,-11.5274,-8.45,-3.43,-8.572764281313429
O=C(CC[C@@H]1CNC(=O)[C@@H]2C[C@H](NC(=O)c3ccc(F)c(Cl)c3)C[NH+]12)NCc1ccc(F)cc1,C15707660_decoy,CXCR4,Decoy,0,-9.8355,-8.81,-1.68,-7.950991310428024
CCOc1ccc(/C=N/NC(=O)c2ccc(N)cc2)cc1C[NH+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C20616161_decoy,CXCR4,Decoy,0,-8.9146,-9.45,-1.63,-8.953838783741663
Cc1nn(C(C)C)c(C)c1/C=N/Nc1nc(SCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)n[nH]1,C20905207_decoy,CXCR4,Decoy,0,-9.70555,-7.7,-3.97,-4.337763359186975
C[C@H](c1ccc(S(N)(=O)=O)cc1)[NH+](C)CC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1,C23259790_decoy,CXCR4,Decoy,0,-9.5902,-10.01,-2.5,-10.809318832852252
COc1cccc(/C=[NH+]/CCNC(=O)c2cc3n(n2)[C@H](C(F)(F)C(F)(F)F)C[C@@H](C)N3)c1O,C22711529_decoy,CXCR4,Decoy,0,-8.77812,-7.97,-3.43,-7.812775611122583
C[NH+]1CCN([C@H]2C[C@@]3(C)[C@@H](CC[C@H]4[C@H]3CC[C@]3(C)[C@@H](O)[C@@H](N5CC[NH+](C)CC5)C[C@@H]43)C[C@H]2O)CC1,C33932987_decoy,CXCR4,Decoy,0,-10.3686,-6.16,-3.01,-5.391982821883274
COc1ccc(NC(=O)CSc2nc3n[nH]c(C)c3c(N)[n+]2-c2ccc(Cl)c(C)c2)cc1OC,C37867483_decoy,CXCR4,Decoy,0,-10.2526,-9.48,-1.99,-9.453275950375744
O=C1[NH+]=c2c(Br)cc(Br)cc2=C1NNC(=O)c1nc(=O)[nH]c2ccccc12,C13301111_decoy,CXCR4,Decoy,0,-9.55284,-10.05,-1.81,-8.53253749524108
COc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4ccccc4OC(C)=O)CC34CC[NH2+]CC4)c2c1,C39598964_decoy,CXCR4,Decoy,0,-9.4143,-10.23,-1.54,-10.110088736295705
COc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4c(Cl)cccc4Cl)CC34CC[NH2+]CC4)c2c1,C39598972_decoy,CXCR4,Decoy,0,-9.59927,-8.87,-2.04,-9.109546520442668
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)[C@@H](C)Oc4ccccc4)CC34CC[NH2+]CC4)c2c1,C39599101_decoy,CXCR4,Decoy,0,-8.8081,-10.55,-1.45,-8.70870510278679
C[C@H](CCCC(C)(C)O)NC(=O)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39631292_decoy,CXCR4,Decoy,0,-9.22223,-8.45,-1.87,-9.668980643809723
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)ccc1Br,C39631637_decoy,CXCR4,Decoy,0,-9.83675,-8.51,-4.91,-4.573731187261317
Cc1cc(-c2onc(C)c2C(=O)N2C[C@@H](C(=O)N[C@H](C)CCCC(C)(C)O)C3(CC[NH2+]CC3)C2)no1,C39631880_decoy,CXCR4,Decoy,0,-9.47565,-8.25,-2.77,-9.149126763085883
Cc1nn(C)c2ncc(C(=O)N3C[C@@H](C(=O)N[C@@H](C)CCCC(C)(C)O)C4(CC[NH2+]CC4)C3)c(Cl)c12,C39632078_decoy,CXCR4,Decoy,0,-10.8795,-8.08,-2.56,-9.50146737364778
CC(C)[NH+](CCNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2)C(C)C,C39634734_decoy,CXCR4,Decoy,0,-8.70887,-7.52,-2.09,-7.702929749975211
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2)C(C)C,C39634739_decoy,CXCR4,Decoy,0,-9.22804,-9.39,-3.75,-9.189755370178249
Cc1ccc(Cl)c(C(=O)N2C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)c1F,C39634784_decoy,CXCR4,Decoy,0,-10.9811,-8.18,-2.44,-4.72911808057381
Cc1cc(C(=O)N2C[C@H](C(=O)NCCNc3ccccc3)C3(CC[NH2+]CC3)C2)ccc1Br,C39655425_decoy,CXCR4,Decoy,0,-9.27441,-8.62,-3.12,-7.656514319164185
Cc1ccc2[nH]cc(CCNC(=O)[C@H]3CN(C(=O)c4ccc(N5CCOCC5)nc4)CC34CC[NH2+]CC4)c2c1,C39656128_decoy,CXCR4,Decoy,0,-10.2706,-9.22,-1.82,-9.634876658408173
CC1=C(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)[C@@H](c2ccccc2)NO1,C39656192_decoy,CXCR4,Decoy,0,-9.82937,-10.52,-1.83,-9.398903522898824
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)N[C@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663240_decoy,CXCR4,Decoy,0,-9.8671,-8.73,-2.14,-11.083917300395008
C[C@@H]1[NH+]=c2ccc(C#N)cc2=C1CCNC(=O)[C@@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39674721_decoy,CXCR4,Decoy,0,-9.42455,-10.47,-2.59,-4.426662376717675
CC(=O)N1CCC(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)CC1,C39676451_decoy,CXCR4,Decoy,0,-10.3855,-8.96,-2.97,-10.925083698511946
Cc1ccc(F)cc1C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C2(CC[NH2+]CC2)C1,C39676473_decoy,CXCR4,Decoy,0,-8.60557,-10.59,-2.16,-8.594743195003916
CC1=C[C@H](C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(Cl)cc34)C3(CC[NH2+]CC3)C2)NN1C,C39676534_decoy,CXCR4,Decoy,0,-10.848,-9.73,-2.61,-10.156609915426422
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CC12CC[NH2+]CC2,C39693385_decoy,CXCR4,Decoy,0,-8.12285,-8.33,-2.62,-8.884649672176156
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2,C39693505_decoy,CXCR4,Decoy,0,-9.61664,-10.13,-1.24,-10.391856669679608
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C44713749_decoy,CXCR4,Decoy,0,-8.70658,-9.41,-1.78,-8.43827110758475
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)c3c(C)n[nH]c3C)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C44714038_decoy,CXCR4,Decoy,0,-9.47564,-7.58,-1.34,-7.234885342867187
C[C@H](Sc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C45486293_decoy,CXCR4,Decoy,0,-9.3995,-8.36,-3.08,-4.345254375032784
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(C)c(F)c4F)CC34CC[NH2+]CC4)[nH]c2c1,C39695787_decoy,CXCR4,Decoy,0,-9.10123,-11.01,-2.56,-8.931447037906539
COc1ccc(OC)c(C(=O)N2C[C@@H](C(=O)N[C@@H](C)c3nc4ccc(C)cc4[nH]3)C3(CC[NH2+]CC3)C2)c1,C39695827_decoy,CXCR4,Decoy,0,-8.20052,-8.35,-1.68,-7.838626905873846
NC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C58775347_decoy,CXCR4,Decoy,0,-9.11224,-8.89,-1.93,-4.578376459716024
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CC2=c4ccccc4=[NH+]C2)(C(=O)[O-])[NH2+][C@H]3c2ccccc2O)cc1C,C63472801_decoy,CXCR4,Decoy,0,-9.07251,-10.53,-1.59,-8.696144070243976
COc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)N[C@@H]3NN[C@H](Cc4ccccc4)S3)CC1=O)C[NH+]=2,C63557992_decoy,CXCR4,Decoy,0,-9.62978,-8.81,-2.64,-8.134254705741021
CNS(=O)(=O)c1ccc(NC(=O)[C@@H](CC2=c3ccccc3=[NH+]C2)NC(=O)c2cccs2)cc1,C64707688_decoy,CXCR4,Decoy,0,-9.97584,-8.44,-1.88,-9.539750735932502
Cc1cc(-[n+]2c(SCC(=O)Nc3ccc(C)c(Cl)c3)nc3n[nH]c(C)c3c2N)ccc1Cl,C33860609_decoy,CXCR4,Decoy,0,-9.28266,-10.19,-1.48,-8.304266791826551
CC[C@H](Sc1nc2n[nH]c(C)c2c(N)[n+]1-c1ccc(Br)cc1)C(=O)NCc1ccco1,C33750351_decoy,CXCR4,Decoy,0,-11.0692,-8.69,-2.0,-11.28820660033692
COc1ccc(OC)c(NC(=O)CSc2nc3[nH]nc(C)c3c(N)[n+]2-c2ccc(Cl)c(C)c2)c1,C33594504_decoy,CXCR4,Decoy,0,-10.9211,-8.09,-2.57,-8.89311983579715
Cc1ccc(C)c(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)c1,C04330637_decoy,CXCR4,Decoy,0,-10.1959,-6.21,-2.69,-7.79045938924427
CCC[NH+]1CCc2c(sc(NC(=O)CCSc3ccc(F)cc3)c2C(N)=O)C1,C05192823_decoy,CXCR4,Decoy,0,-10.6344,-8.29,-1.38,-12.299561512236876
CCC[NH+]1CCc2c(sc(NC(=O)Cc3ccc(C)cc3C)c2C(N)=O)C1,C05267933_decoy,CXCR4,Decoy,0,-9.32074,-8.56,-2.38,-4.311292835143011
C[C@H]([NH3+])[C@](C)(O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1,C01563590_decoy,CXCR4,Decoy,0,-7.92818,-7.82,-2.16,-7.693069501442999
C[C@@H]([NH2+]CC(=O)Nc1ccccc1C(=O)Nc1ccc(F)cc1)c1ccccc1,C07336553_decoy,CXCR4,Decoy,0,-8.61903,-9.46,-1.39,-9.10580454295726
COc1ccc2[nH+]c(C)cc(NCCc3ccc(S(N)(=O)=O)cc3)c2c1,C08491242_decoy,CXCR4,Decoy,0,-9.84963,-9.43,-3.84,-12.350236004538582
C[C@H]([NH2+][C@@H](C)c1ccccc1Br)c1nc(N)nc(N(C)C)n1,C08777713_decoy,CXCR4,Decoy,0,-8.44673,-7.52,-1.92,-8.510682529064985
CC(C)[NH+]1CCc2c(sc(NC(=O)c3ccc(Br)s3)c2C(N)=O)C1,C09390601_decoy,CXCR4,Decoy,0,-9.81714,-5.47,-1.81,-6.437869736645284
CC(C)[C@H]([NH2+]CC(=O)N1C[C@H](C(N)=O)Oc2ccccc21)c1ccc(Cl)cc1,C10139598_decoy,CXCR4,Decoy,0,-9.89564,-7.84,-1.96,-10.025403315893117
COc1ccc2c(c1)OC1(CC[NH+](C[C@@H](O)c3c[nH]c4cc(C)ccc34)CC1)C[C@@H]2O,C12329699_decoy,CXCR4,Decoy,0,-10.2853,-10.38,-1.45,-7.815192754959524
C[C@@H]1CCc2c(sc(NC(=O)C[NH+]3C[C@H](C)C[C@@H](C)C3)c2C(N)=O)C1,C13745044_decoy,CXCR4,Decoy,0,-9.95438,-7.85,-1.26,-8.20363406990797
O[C@H](C[NH2+]C[C@H](O)[C@@H]1CCc2cc(F)ccc2O1)[C@@H]1CCc2cc(F)ccc2O1,C14951683_decoy,CXCR4,Decoy,0,-9.71014,-10.51,-1.83,-9.499268115926492
Cc1ccc(F)cc1C[C@H]([NH3+])COc1cncc(-c2ccc3[nH]nc(C)c3c2)c1,C14961691_decoy,CXCR4,Decoy,0,-8.7206,-10.62,-1.92,-8.08798301358881
CC(C)[C@H]([NH2+]CC(=O)NCC(=O)Nc1ccc(F)c(F)c1)c1cccs1,C29202925_decoy,CXCR4,Decoy,0,-8.4779,-8.11,-1.82,-7.112907208581011
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc(Cl)c2C)cc1,C30499494_decoy,CXCR4,Decoy,0,-8.6764,-7.35,-1.93,-8.314549038635738
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc(Cl)c2C)cc1,C30499498_decoy,CXCR4,Decoy,0,-8.77696,-8.36,-1.18,-8.062362315835163
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc(C)cc2Cl)cc1,C30500355_decoy,CXCR4,Decoy,0,-8.62655,-8.86,-1.8,-8.607437302179848
CCOc1c(Br)cc(Cl)cc1NC(=O)[C@@H]([NH3+])[C@H](C)CC,C37020131_decoy,CXCR4,Decoy,0,-8.81749,-6.47,-1.83,-8.920456694340537
C[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)cc1)c1ccc(I)cc1,C37199370_decoy,CXCR4,Decoy,0,-8.79017,-7.96,-1.58,-7.512131334698287
COC(=O)c1cc(Br)cc(Br)c1NC(=O)CCCCC[NH3+],C37769887_decoy,CXCR4,Decoy,0,-8.36326,-6.45,-1.54,-8.262116894206887
COC(=O)c1cc(Br)cc(Br)c1NC(=O)C[C@@H](C)[NH3+],C37769929_decoy,CXCR4,Decoy,0,-7.99375,-6.83,-1.83,-13.04870718458997
C[C@@H]([NH2+]Cc1cc(Br)ccc1OCC(N)=O)C12CC3CC(CC(C3)C1)C2,C04670905_decoy,CXCR4,Decoy,0,-10.2356,-8.52,-1.86,-8.767566848708157
Nc1ccc(-c2cn3cccc(OCC(=O)NCCc4ccccc4)c3[nH+]2)cc1,C36273729_decoy,CXCR4,Decoy,0,-8.28731,-7.02,-1.72,-7.070106734284744
Cc1ccccc1[C@H](OC[C@H](O)C[NH+]1CCC(C(N)=O)CC1)c1ccccc1,C06559781_decoy,CXCR4,Decoy,0,-8.81244,-8.54,-1.94,-9.050285617316142
CC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3ccc(C)cc23)C2(CC[NH2+]CC2)C1,C39655908_decoy,CXCR4,Decoy,0,-9.70263,-8.13,-2.62,-8.46859836498861
C=CC[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@H]1c1ccc(C)c(C)c1,C39744818_decoy,CXCR4,Decoy,0,-8.37111,-10.15,-3.02,-4.322133963456701
CCOc1c(Br)cc(Cl)cc1NC(=O)[C@@H]([NH3+])C(C)(C)C,C40462942_decoy,CXCR4,Decoy,0,-8.8981,-6.6,-1.7,-3.812395121619348
C[NH2+][C@@H](C)c1cccc(NC(=O)Nc2cccc(I)c2)c1,C41712651_decoy,CXCR4,Decoy,0,-8.59572,-7.8,-1.0,-7.23505166401825
CC(C)[C@@H]([NH2+]CCOc1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)cc1,C42574219_decoy,CXCR4,Decoy,0,-9.18082,-8.66,-2.47,-9.615727705121394
COC(=O)[C@H]([NH3+])Cc1cc(Br)c(Br)c(Br)c1O,C44335551_decoy,CXCR4,Decoy,0,-10.1409,-6.67,-0.82,-9.714775020526275
[NH3+][C@@H](CO)Cc1cn(-c2ncc(C(F)(F)F)cc2Cl)c2ccccc12,C44464910_decoy,CXCR4,Decoy,0,-7.80499,-5.55,-4.34,-2.255931521070647
CCCc1cc(-c2[nH+]c(C)[nH]c2-c2ccc3c(c2)OCCO3)c(O)cc1O,C39550409_decoy,CXCR4,Decoy,0,-9.19076,-9.44,-3.45,-10.415095218205462
Cc1n[nH]c2cnc(-c3cncc(OC[C@@H]([NH3+])Cc4ccc(F)c(F)c4F)c3)cc12,C45290259_decoy,CXCR4,Decoy,0,-8.30492,-7.36,-1.26,-6.534047100636636
CC(C)NC(=O)c1ccccc1NC(=O)C[NH2+][C@H](c1cccs1)C(C)(C)C,C52838958_decoy,CXCR4,Decoy,0,-8.45528,-7.47,-3.1,-8.132881012045804
C[C@H](C(=O)N[C@H](C)c1ccc(Cl)cc1Cl)[NH+]1CCC(CC(N)=O)CC1,C52941237_decoy,CXCR4,Decoy,0,-9.77965,-8.44,-0.97,-14.519451770161824
CCC(CC)NC(=O)[C@H](C)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1,C53020372_decoy,CXCR4,Decoy,0,-9.66831,-8.32,-2.38,-8.044856847741682
Cc1cc(O[C@H](C)C(=O)N/N=C2\[NH+]=C(N)c3ccccc32)cc(C)c1Cl,C16269388_decoy,CXCR4,Decoy,0,-9.41272,-7.47,-4.27,-3.8739739404303895
CC(=O)Nc1ccc(F)c(NC(=O)N[C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)c1,C56608583_decoy,CXCR4,Decoy,0,-8.63276,-8.84,-1.12,-13.24768944825849
CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)c1,C56946815_decoy,CXCR4,Decoy,0,-9.19378,-9.45,-2.21,-8.64374132898245
C[NH+](C)[C@H](CNC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(F)cc1,C56950424_decoy,CXCR4,Decoy,0,-7.58674,-8.91,-2.24,-9.644291900667522
Cc1cccc(C(=O)N[C@H](C(=O)N[C@H](C)c2[nH]cc(-c3ccccc3)[nH+]2)C(C)C)c1,C60199737_decoy,CXCR4,Decoy,0,-8.5136,-9.07,-1.79,-8.237320897617773
C[NH+]1CCCC[C@H]1CNS(=O)(=O)c1cc(Cl)cc(N)c1Br,C61882443_decoy,CXCR4,Decoy,0,-9.30597,-7.59,-0.76,-11.174649669869993
NC(=O)CC1CCN(C(=O)NC2CC[NH+](CC3CCCCC3)CC2)CC1,C62528802_decoy,CXCR4,Decoy,0,-8.28657,-6.18,-1.43,-6.895892112740519
C[C@H]([NH3+])[C@H]1CCCCN1CC(=O)Nc1ccc(Br)cc1Br,C63195509_decoy,CXCR4,Decoy,0,-9.39045,-6.73,-1.59,-7.947854423875417
O=C(N[C@@H]1Nc2ccc(NC(=O)[C@H]3C=c4ccccc4=[NH+]3)cc2S1)c1ccccc1,C63600780_decoy,CXCR4,Decoy,0,-7.66001,-7.77,-2.63,-3.696913260928186
C[C@@H]1CC[C@H]2[C@@H](CCC[NH+]2CC(=O)Nc2ccccc2SCC(N)=O)C1,C64515529_decoy,CXCR4,Decoy,0,-9.42739,-7.7,-2.78,-8.534421116163589
CC(C)[NH+](CCC(=O)NC(N)=O)Cc1ccc(-c2ccccc2F)s1,C64988167_decoy,CXCR4,Decoy,0,-8.81165,-6.69,-1.5,-9.300338231649578
CC(C)CNC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2cccc(Cl)c2)CCOCC1,C66389333_decoy,CXCR4,Decoy,0,-9.80792,-8.62,-1.62,-8.792276763119286
Cc1ccc(NC(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1C(=O)NC(C)C,C66686831_decoy,CXCR4,Decoy,0,-9.36114,-7.65,-4.78,-7.898033575569674
CC1CC[NH+](C[C@H](O)CNC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1,C67613343_decoy,CXCR4,Decoy,0,-8.06186,-8.2,-1.91,-7.182826920210989
CC(C)CNC(=S)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2c1cc(-c2ccc(N(C)C)cc2)nn1C,C08635357_decoy,CXCR4,Decoy,0,-11.1383,-8.33,-2.2,-9.098029859760256
COc1ccccc1NC(=O)N1[C@@H](C(=O)NCC[NH+]2CCCC2)CS[C@@H]1c1ccccc1C,C09251698_decoy,CXCR4,Decoy,0,-7.95594,-9.51,-3.69,-9.23309270017462
CC[NH+](CC)CCCn1c(C)cc2c(c1=O)[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2,C09329583_decoy,CXCR4,Decoy,0,-8.32195,-7.02,-2.77,-7.526440134253374
Cc1nc(C[NH+](C)Cc2ccc(C(=O)N[C@H](c3ccccc3)c3ccc(Cl)cc3)c(=O)[nH]2)cs1,C12201170_decoy,CXCR4,Decoy,0,-9.30471,-7.48,-2.62,-7.434589474256056
CC[NH+](CC(=O)Nc1c(F)cccc1F)Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)[nH]1,C12858961_decoy,CXCR4,Decoy,0,-8.09405,-7.28,-4.52,-7.310637921413613
O=C(NC(=S)NC[C@H](c1ccc(F)cc1)[NH+]1CCOCC1)c1ccc(Cl)cc1Cl,C03168506_decoy,CXCR4,Decoy,0,-10.5409,-9.35,-3.55,-10.039583173319125
CC[NH+](CC)CCNC(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Br)cc1,C13621869_decoy,CXCR4,Decoy,0,-10.2157,-6.3,-3.2,-4.258427934407639
CC[NH+](CC)CCCNC(=O)c1nn2c(c1Cl)N[C@H](c1ccc(Cl)cc1)C[C@@H]2C(F)(F)F,C02754850_decoy,CXCR4,Decoy,0,-9.121,-7.17,-2.27,-6.926651410827945
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)NC[C@@H](c1ccco1)[NH+]1CCCCC1,C15988738_decoy,CXCR4,Decoy,0,-9.15764,-9.11,-3.24,-8.743920061663975
CCC[NH+](CC(=O)Nc1ccc(F)c(F)c1F)Cc1nc2scc(-c3ccccc3)c2c(=O)[nH]1,C16590081_decoy,CXCR4,Decoy,0,-10.3009,-8.97,-1.59,-8.432242743549681
CC[NH+]1CCN(c2c(Cl)cccc2NC(=S)NC(=O)c2ccc(OC)c(Br)c2)CC1,C20977574_decoy,CXCR4,Decoy,0,-10.4074,-7.33,-1.84,-8.614934429052514
CC(C)c1ccc(NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCN3C)N2CC[NH+](C)CC2)cc1,C22734565_decoy,CXCR4,Decoy,0,-8.83785,-7.72,-1.89,-7.772987894500186
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NC[C@H](c1ccccc1)[NH+]1CCCC1,C23741643_decoy,CXCR4,Decoy,0,-10.929,-8.64,-3.64,-5.215442129900299
COc1ccccc1[C@@H](CNC(=O)[C@H](CCSC)NC(=O)c1ccccc1Cl)[NH+]1CCCC1,C23980730_decoy,CXCR4,Decoy,0,-9.22052,-8.59,-1.48,-9.380456904760516
FC(F)(F)c1ccc2c(NC3CCC([NH2+]Cc4cccnc4)CC3)ncc(-c3ccsc3)c2n1,C24904276_decoy,CXCR4,Decoy,0,-10.0018,-7.22,-3.1,-4.469691628707572
COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)[NH+](C)CC(=O)Nc1ccccc1SC,C31035800_decoy,CXCR4,Decoy,0,-9.48254,-8.6,-2.24,-10.494358579219169
COc1cccc(CSc2nnc([C@H]([NH3+])Cc3ccccc3)n2-c2cc(Cl)ccc2C)c1,C35707222_decoy,CXCR4,Decoy,0,-10.8061,-9.54,-2.34,-9.29859258713463
COc1ccc(C[NH+](C)Cc2nc3sc(C(=O)Nc4ccc(C)cc4C)c(C)c3c(=O)[nH]2)cc1F,C24072046_decoy,CXCR4,Decoy,0,-8.23076,-9.99,-3.51,-4.545842621845513
C=C[C@](C)(O)C[NH+](Cc1ccccc1)Cc1nc2scc(-c3cccc(OC)c3)c2c(=O)[nH]1,C35746198_decoy,CXCR4,Decoy,0,-10.5025,-8.92,-3.24,-9.608848223843742
Cc1ccccc1-c1csc2nc(C[NH+](C[C@H](O)COc3ccccc3)C(C)C)[nH]c(=O)c12,C35747235_decoy,CXCR4,Decoy,0,-8.99944,-7.98,-1.71,-8.274529802539439
CC(C)OC[C@H](O)C[NH+](Cc1ccccc1)Cc1nc2sc3c(c2c(=O)[nH]1)CCCCC3,C35781312_decoy,CXCR4,Decoy,0,-9.90512,-8.5,-1.19,-8.319555192663145
CC(C)COC[C@@H](O)C[NH+](Cc1nc2scc(-c3ccccc3Cl)c2c(=O)[nH]1)CC(C)C,C36205415_decoy,CXCR4,Decoy,0,-10.0102,-6.91,-2.33,-8.070058674632776
C#CCOC[C@@H](O)C[NH+](CCC(C)C)Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)[nH]1,C36207791_decoy,CXCR4,Decoy,0,-10.0799,-6.92,-1.96,-4.329711206839024
CCOc1ccc([C@H]2CC(c3ccc(C)cc3C)=NN2C(=O)C[NH+]2CCC(C(N)=O)CC2)cc1,C36342575_decoy,CXCR4,Decoy,0,-8.94336,-9.93,-2.68,-5.813860131919265
Cc1sc2nc(CS[C@H](C)C(=O)NC[C@H](c3ccccc3)[NH+]3CCCC3)[nH]c(=O)c2c1C,C36750555_decoy,CXCR4,Decoy,0,-9.85569,-8.62,-3.47,-8.054982508095648
Cc1sc2nc(CS[C@H](C)C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)[nH]c(=O)c2c1C,C27603063_decoy,CXCR4,Decoy,0,-10.7303,-8.76,-3.85,-5.39654726403379
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@H]([NH2+]CCO)C[C@@H](c3ccc(C(C)C)cc3)N21,C39560910_decoy,CXCR4,Decoy,0,-9.19853,-4.88,-0.78,-5.437820152218506
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(OC(F)(F)F)cc3)CC23CC[NH2+]CC3)cc1C,C39609211_decoy,CXCR4,Decoy,0,-8.57613,-7.57,-1.96,-6.820170244164816
O=C(NCCCc1ccccc1)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39623620_decoy,CXCR4,Decoy,0,-8.541,-8.83,-1.09,-7.953206100921413
CCOc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39652659_decoy,CXCR4,Decoy,0,-9.16744,-10.26,-1.55,-8.865670641003925
CC[C@H](C(=O)N1C[C@H](C(=O)NC[C@@H](C)Oc2ccccc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39665259_decoy,CXCR4,Decoy,0,-9.42392,-9.05,-2.38,-9.329541972224634
Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC23CC[NH2+]CC3)cc1,C39666024_decoy,CXCR4,Decoy,0,-8.23106,-10.49,-2.59,-8.325840292508948
COc1ccc(CC[C@@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)cc1,C39675205_decoy,CXCR4,Decoy,0,-9.03368,-9.5,-3.73,-8.333988748440095
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(C)c(F)c3)CC23CC[NH2+]CC3)cc1,C39675311_decoy,CXCR4,Decoy,0,-9.48045,-8.17,-3.18,-8.781790338538048
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3c(F)ccc(Cl)c3F)CC23CC[NH2+]CC3)cc1,C39675523_decoy,CXCR4,Decoy,0,-8.9927,-9.14,-2.39,-8.425135372918978
Cc1ccc(C)c(-c2csc3nc(C[NH+](CC(C)C)C[C@@H](O)COC(C)C)[nH]c(=O)c23)c1,C35746476_decoy,CXCR4,Decoy,0,-10.3373,-7.96,-5.35,-4.486672340581047
COc1cc(C[NH2+]CCOCCO)cc(Br)c1OCc1c(Cl)cccc1Cl,C40733729_decoy,CXCR4,Decoy,0,-9.56684,-6.02,-2.5,-8.140217932815725
CC(=O)[C@H]1CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCCc5c[nH]c[nH+]5)CC[C@@]4(C)[C@@H]3CC[C@@]12C,C43741661_decoy,CXCR4,Decoy,0,-10.4514,-9.36,-2.05,-10.222604909208904
Cc1ccccc1[C@@H](OC[C@H](O)C[NH+]1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1,C45793870_decoy,CXCR4,Decoy,0,-8.52744,-8.48,-2.7,-8.983373040252744
COc1ccccc1[C@@H](CNC(=O)Nc1cc(N2CCCC2=O)ccc1Cl)[NH+]1CCCC1,C58893842_decoy,CXCR4,Decoy,0,-9.54501,-10.01,-2.99,-4.849952505967945
CC[NH+]1CCN(c2c(Cl)cccc2NC(=S)NC(=O)c2cc(Br)ccc2OC)CC1,C59723886_decoy,CXCR4,Decoy,0,-10.5395,-8.19,-2.09,-9.160799214782422
Cc1ccc(C(=O)N/C(=C\[C@@H]2CN(C)c3ccccc32)C(=O)NCCC2=c3ccccc3=[NH+]C2)cc1,C63354506_decoy,CXCR4,Decoy,0,-9.21839,-10.57,-2.13,-5.061135935596599
CC[C@@H](C)[C@H](NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@H]2[C@H]2c3ccccc3C(=O)N21)C(=O)NCC(C)C,C63383931_decoy,CXCR4,Decoy,0,-9.81703,-8.14,-3.27,-4.491171174159878
COc1ccc([C@@H](CNC(=O)C[C@@H](NC(C)=O)c2ccc(C)cc2)C2=c3ccccc3=[NH+]C2)cc1,C63403674_decoy,CXCR4,Decoy,0,-9.05244,-8.93,-2.26,-8.938905285852952
Cc1ccc(Cl)cc1N1N=NN[C@@H]1SCC(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1,C63478706_decoy,CXCR4,Decoy,0,-10.6485,-9.63,-2.15,-4.8831556736095525
COc1ccc(CNC(=O)[C@H]2[NH+]=c3ccccc3=C2NC(=O)c2ccc(Cl)cc2)cc1OC,C63752640_decoy,CXCR4,Decoy,0,-9.39601,-7.97,-1.84,-7.482359878972755
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1F,C63819074_decoy,CXCR4,Decoy,0,-7.97499,-8.53,-1.93,-7.918725871843763
COc1ccc(OC)c(CNC(=O)[C@H]2[NH+]=c3ccc(C)cc3=C2NC(=O)c2ccc(F)cc2)c1,C64395755_decoy,CXCR4,Decoy,0,-9.01743,-9.45,-3.43,-10.742854295219429
COc1ccc2cc(C(=O)N3CCC(CC(=O)NCCC4=c5cc(C)ccc5=[NH+]C4)CC3)[nH]c2c1,C64518501_decoy,CXCR4,Decoy,0,-9.44234,-10.11,-3.47,-4.867650699891734
COc1cccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC3)c1,C65074854_decoy,CXCR4,Decoy,0,-9.82425,-9.38,-2.0,-9.326064991870137
C[NH2+][C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)N[C@H](CO)CC(C)C,C01692687_decoy,CXCR4,Decoy,0,-8.38161,-7.22,-1.74,-7.857859565296063
CC[C@H](C)c1ccc(NC(=O)c2csc([C@@H]([NH3+])CC(C)C)n2)cc1,C06603792_decoy,CXCR4,Decoy,0,-9.49199,-7.47,-4.05,-8.834972746264715
CCN(CC)c1ccc(C[NH2+]CCc2ccc(S(N)(=O)=O)cc2)cc1,C06703012_decoy,CXCR4,Decoy,0,-8.87441,-7.48,-2.63,-8.36595385483615
C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)[NH+](C)Cc1ccccc1OC(F)(F)F,C25243208_decoy,CXCR4,Decoy,0,-7.0471,-9.18,-2.42,-7.4515912636238735
COc1ccc(C)cc1C[NH+](C)[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C29158880_decoy,CXCR4,Decoy,0,-9.9896,-8.08,-1.69,-8.69760455690233
C=CCNC(=O)[C@@H](C)[NH2+]C[C@H](c1ccccc1)c1c[nH]c2ccccc12,C28804340_decoy,CXCR4,Decoy,0,-8.3665,-8.66,-2.11,-10.661761398045169
C=CCNC(=O)[C@H](C)[NH2+]C[C@H](c1ccccc1)c1c[nH]c2ccccc12,C28804343_decoy,CXCR4,Decoy,0,-8.37643,-8.44,-2.39,-10.712739543180822
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc(C)c2)cc1,C30498891_decoy,CXCR4,Decoy,0,-7.56281,-8.32,-3.37,-7.673131664946187
CCCN[C@@H](c1ccc(/C=[NH+]/C(CC)(CO)CO)cc1)C(Cl)(Cl)Cl,C17421768_decoy,CXCR4,Decoy,0,-9.91714,-5.62,-2.96,-3.883170831530963
CSc1cccc(NC(=O)C[NH+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c1,C32542191_decoy,CXCR4,Decoy,0,-10.1071,-8.98,-2.37,-6.16712568257207
COc1ccc([C@@H](C)NC(=O)CCCCCC[NH3+])cc1Br,C37045580_decoy,CXCR4,Decoy,0,-7.88241,-7.05,-1.85,-3.853980466237517
OCCNCC[NH2+]Cc1ccccc1OCc1c(Cl)cccc1Cl,C40719875_decoy,CXCR4,Decoy,0,-8.87205,-7.44,-1.77,-10.107856773787422
CC[C@H](CO)[NH2+]Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(C)cc1,C40743581_decoy,CXCR4,Decoy,0,-9.20566,-7.59,-1.52,-9.911583097852931
CC[NH+](CCOc1cccc(Br)c1)C[C@@H](C)/C(N)=N/O,C42445269_decoy,CXCR4,Decoy,0,-7.34488,-7.03,-1.75,-7.295281296384403
CCCCNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccco1,C43606732_decoy,CXCR4,Decoy,0,-8.72629,-7.55,-1.93,-8.74370618310424
CC[NH+](CC)[C@H](C)CNC(=O)Nc1cccc(NC(=O)C(C)(C)C)c1,C44012010_decoy,CXCR4,Decoy,0,-7.89563,-7.26,-2.46,-4.094527292885384
C[C@H]([NH2+][C@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(OC(F)F)cc1,C44803551_decoy,CXCR4,Decoy,0,-6.23942,-8.6,-2.69,-7.114648479411926
C[NH+](C)[C@@H](CNC(=O)NNC(=O)Cc1ccc(Cl)cc1)c1ccsc1,C46347485_decoy,CXCR4,Decoy,0,-9.30201,-8.26,-1.94,-4.613761305922781
CC(C)CNC(=O)c1ccc(NC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1,C47730594_decoy,CXCR4,Decoy,0,-8.84326,-8.08,-1.59,-11.269408317151662
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)C[NH+]1CCC(CC(N)=O)CC1,C48026444_decoy,CXCR4,Decoy,0,-9.05027,-7.74,-1.33,-7.822134633976944
CCCNC(=O)c1cccc(NC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c1,C48078389_decoy,CXCR4,Decoy,0,-8.70366,-8.65,-2.24,-7.833286186273175
CC(C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1,C48106775_decoy,CXCR4,Decoy,0,-7.95413,-7.53,-0.82,-3.9082642195449298
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)C(C)C)cc1,C16518688_decoy,CXCR4,Decoy,0,-7.46631,-8.55,-3.75,-7.129018522376344
CC[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)C(=O)Nc1cc(C)on1,C51164888_decoy,CXCR4,Decoy,0,-7.79144,-8.89,-1.6,-8.380077342784348
CC[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)C(=O)Nc1cc(C)on1,C51164889_decoy,CXCR4,Decoy,0,-8.26473,-8.9,-0.36,-8.372782381876887
CCC[NH2+][C@H](C)c1cc(Br)ccc1OC[C@@H](C)C(N)=O,C52067683_decoy,CXCR4,Decoy,0,-7.88451,-7.13,-0.32,-11.040584897603289
CC[NH+](CC)[C@H](CNC(=O)C(C)(C)NC(=O)NC)c1ccccc1Cl,C53272542_decoy,CXCR4,Decoy,0,-7.93952,-6.77,-1.66,-10.224468133679196
CC[C@@H](C)NC(=O)c1ccc(NC(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1,C54477435_decoy,CXCR4,Decoy,0,-8.05996,-7.85,-1.17,-4.851728690412712
CC(C)c1ccc(C[NH+](C)[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1,C58288884_decoy,CXCR4,Decoy,0,-8.05494,-8.63,-1.88,-7.733299186673522
CC[NH+](CC)[C@@H](CNC(=O)NC[C@H](O)c1ccc(F)c(F)c1)c1ccsc1,C59119236_decoy,CXCR4,Decoy,0,-10.2772,-8.0,-1.76,-8.576985188530465
C=CCNC(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1,C48149415_decoy,CXCR4,Decoy,0,-8.73359,-6.54,-5.49,-3.7946175374865136
CCNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](c2ccc(CC)cc2)[NH+](C)C)c1,C61263205_decoy,CXCR4,Decoy,0,-8.92213,-8.7,-3.02,-9.378429285980198
CCCNC(=O)c1ccc(NC(=O)NC2CC[NH+](CC(F)F)CC2)cc1,C61774908_decoy,CXCR4,Decoy,0,-7.54468,-6.43,-1.9,-6.4226091756478745
C[C@@H](CC[NH+](C)C)NC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2,C62506980_decoy,CXCR4,Decoy,0,-8.75287,-6.92,-3.03,-3.910417021245145
CCC(CC)NC(=O)COc1ccc(CC[NH3+])cc1Br,C62703731_decoy,CXCR4,Decoy,0,-8.15215,-6.72,-2.33,-7.773823525250717
CC[C@@H]([NH3+])Cc1ccc(OCC(=O)NC(C)(C)C)c(Br)c1,C62705072_decoy,CXCR4,Decoy,0,-8.52416,-7.61,-2.57,-8.866553022142837
CC(C)C[NH2+]Cc1cc(Br)ccc1OC[C@@H](C)C(N)=O,C62729986_decoy,CXCR4,Decoy,0,-8.08772,-7.23,-2.03,-7.989382752254885
O=C(COC[C@H]1Nc2ccccc2S1)N[C@@H](Cc1[nH]cc[nH+]1)c1ccccc1,C39758631_decoy,CXCR4,Decoy,0,-8.03165,-7.74,-1.54,-7.90344006181656
NC(=O)COc1cccc(C[NH2+]C(c2ccccc2)c2ccccc2)c1,C63993100_decoy,CXCR4,Decoy,0,-8.15179,-6.94,-3.62,-6.460492352024499
CCN1[C@@H](c2ccc(Cl)cc2)[C@@H](C[NH2+]CC(C)(C)CO)C[C@@]1(C)CO,C19144750_decoy,CXCR4,Decoy,0,-8.94481,-8.58,-1.38,-16.174373389800834
CCC(CC)(CNC(=O)C(=O)NNc1ccc(Cl)cc1Cl)[NH+](C)C,C65100267_decoy,CXCR4,Decoy,0,-8.78609,-5.9,-1.75,-7.39445691642249
CC[NH+](CC)Cc1ccc(C(=O)NNC(=S)Nc2ccccc2C(C)C)cc1,C66122630_decoy,CXCR4,Decoy,0,-9.04775,-7.52,-3.51,-9.255636208400247
CC[NH+](CC)[C@@H](CNC(=O)NCCc1cccc(O)c1)c1ccco1,C66232771_decoy,CXCR4,Decoy,0,-8.06309,-7.83,-1.41,-6.939989728412709
COCC/[NH+]=C(/N)NCc1ccc(-c2ccc(Br)cc2)o1,C66244243_decoy,CXCR4,Decoy,0,-8.18065,-7.33,-1.98,-7.56060119452175
C[C@H](C[NH+](C)CCC(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1,C66853880_decoy,CXCR4,Decoy,0,-9.93881,-9.62,-1.62,-13.582832671838132
COc1cc(C[NH2+][C@H](C(N)=O)c2ccc(F)cc2)ccc1OCc1ccccc1,C66938867_decoy,CXCR4,Decoy,0,-7.79759,-9.15,-1.5,-10.03277343859744
O[C@@H](C[NH2+]Cc1c[nH]nc1-c1cc2ccccc2o1)COc1cccc(F)c1,C67224283_decoy,CXCR4,Decoy,0,-8.31947,-9.18,-2.01,-7.777656608077624
CC[NH+](CC)[C@H](C(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1,C67246393_decoy,CXCR4,Decoy,0,-7.72036,-7.27,-3.19,-3.860440559551511
COc1cccc(CCCNC(=O)N[C@H](C)c2[nH]cc(-c3ccccc3)[nH+]2)c1,C67423511_decoy,CXCR4,Decoy,0,-7.91835,-9.39,-1.34,-7.75213619896805
CCCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2ccsc2)[NH+](C)C)c1C,C67584887_decoy,CXCR4,Decoy,0,-9.56566,-7.05,-2.09,-7.396389254999124
CC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)c2ccc(Cl)cc2)c1C,C04548231_decoy,CXCR4,Decoy,0,-8.04792,-8.41,-0.82,-7.869269060523348
CCOC(=O)c1c(NC(=O)c2cccc(F)c2)sc(C(C)=O)c1C,C00474797_decoy,CXCR4,Decoy,0,-7.91111,-7.01,-1.68,-7.049927601354976
COC(=O)c1sc(NC(=O)CSc2ccccc2)c(C#N)c1C,C04750376_decoy,CXCR4,Decoy,0,-8.87309,-7.71,-2.55,-7.333247903157373
CC[C@@H](C)N(CC(=O)Nc1nccs1)C(=O)c1ccc(Cl)cc1,C04873619_decoy,CXCR4,Decoy,0,-8.44074,-5.49,-1.19,-7.204938728508119
COc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1cccs1,C01922365_decoy,CXCR4,Decoy,0,-8.36537,-7.45,-3.41,-7.265001473257308
CC[C@@H](C)NC(=O)c1cc(OC)c(OC)c(OC)c1Br,C05953896_decoy,CXCR4,Decoy,0,-6.62518,-6.74,-2.32,-3.298717658961176
COc1cc(/C=C/C(=O)Nc2ccc(F)c(F)c2)cc(OC)c1OC,C06377739_decoy,CXCR4,Decoy,0,-8.69918,-8.86,-1.85,-7.411611388303683
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(C#N)cc1)c1ccc(F)cc1,C06638313_decoy,CXCR4,Decoy,0,-7.60167,-8.99,-1.3,-8.693492158184112
COc1cc(C(C)=O)ccc1O[C@H](C)C(=O)Nc1cccc(Cl)c1,C07200793_decoy,CXCR4,Decoy,0,-8.90931,-7.41,-1.57,-7.770309639323763
CCn1c(S[C@@H](C)C(=O)Nc2ccc(Cl)cc2)nnc1C1CC1,C07618420_decoy,CXCR4,Decoy,0,-8.38342,-6.21,-1.88,-6.842596215074338
CCn1c(S[C@@H](C)C(=O)Nc2ccc(C)cc2C)nnc1C1CC1,C07841261_decoy,CXCR4,Decoy,0,-7.89695,-6.44,-1.47,-5.9417679659420335
COc1ccc(NC(=O)Cc2c(C)nn(CC(C)C)c2C)cc1Cl,C07955999_decoy,CXCR4,Decoy,0,-7.76274,-8.21,-1.64,-10.253011582491238
O=C1CSC(N/N=C/c2ccccc2OCC2=CC[C@H](F)C=C2)=N1,C03255921_decoy,CXCR4,Decoy,0,-8.25433,-8.95,-1.41,-8.605861444967102
C[C@@H](NC(=O)CSc1nnc(-c2cccs2)o1)c1cccs1,C06462755_decoy,CXCR4,Decoy,0,-9.64597,-6.96,-2.68,-8.161918677797617
CCOc1ccc([C@H](C)NS(=O)(=O)c2ccc(Cl)nc2)cc1,C10675228_decoy,CXCR4,Decoy,0,-7.43988,-7.49,-3.1,-6.472562258335076
O=C(COc1ccc(F)cc1)NCc1cc(-c2ccc(F)cc2)on1,C11613462_decoy,CXCR4,Decoy,0,-6.93288,-9.5,-4.09,-7.328668895795381
COC(=O)c1sccc1NC(=O)[C@@H](C)Oc1ccccc1Cl,C12380973_decoy,CXCR4,Decoy,0,-7.53879,-7.38,-2.91,-8.037167554170495
O=C(OCC(=O)c1ccc(F)cc1F)c1cc(-c2ccccc2)[nH]n1,C09338255_decoy,CXCR4,Decoy,0,-7.61104,-9.06,-1.68,-7.371765957543008
COc1cc(Cl)c(C)cc1NC(=O)COC(=O)c1ccsc1,C12600651_decoy,CXCR4,Decoy,0,-9.03001,-6.52,-1.01,-8.40736090655888
Cc1ccc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)cc1,C12549669_decoy,CXCR4,Decoy,0,-5.72986,-7.75,-1.72,-5.998640227735873
COC[C@@H](C)NC(=O)c1c(C)noc1-c1cccc(C(F)(F)F)c1,C22349107_decoy,CXCR4,Decoy,0,-6.21669,-7.52,-2.51,-7.435451675837245
Cc1ccc(C)c(OCC(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)c1,C23156468_decoy,CXCR4,Decoy,0,-7.75644,-8.98,-1.15,-7.774360260640794
COC[C@H](C)NC(=O)c1cn(-c2ccccc2)nc1-c1ccc(C)cc1,C24177163_decoy,CXCR4,Decoy,0,-7.56867,-8.07,-0.49,-8.502024686926266
C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccnn1Cc1cccs1,C28403601_decoy,CXCR4,Decoy,0,-7.98163,-7.26,-2.08,-7.365702175543941
O=C(CCc1ccco1)Nc1cc(C(F)(F)F)ccc1-n1cccn1,C29769290_decoy,CXCR4,Decoy,0,-6.18284,-8.39,-0.85,-8.70103463573874
COC(=O)[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(C)C,C35154485_decoy,CXCR4,Decoy,0,-8.07918,-6.99,-1.32,-10.109784288693383
COC(=O)[C@H](NS(=O)(=O)c1cc(Cl)cc(Cl)c1)C(C)C,C35154556_decoy,CXCR4,Decoy,0,-8.19039,-7.54,-2.4,-11.18648306496657
O=C(NCc1ccco1)c1csc(COc2ccccc2Cl)n1,C36084005_decoy,CXCR4,Decoy,0,-7.97862,-7.46,-2.39,-3.882975009341661
COc1cccc(NC(=O)N(Cc2ccsc2)Cc2ccco2)c1,C44446468_decoy,CXCR4,Decoy,0,-7.48861,-7.75,-3.25,-9.08593885343642
COc1ccc(C)cc1CS(=O)(=O)[C@@H](C)C(=O)Nc1ccccc1,C44642721_decoy,CXCR4,Decoy,0,-7.52814,-8.05,-1.84,-3.849462781499529
CCc1ccc(O[C@@H](C)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1,C44821862_decoy,CXCR4,Decoy,0,-7.41912,-9.25,-1.52,-9.841126406285928
COc1cc([C@@H](C)NC(=O)c2ccc(Cl)nc2)ccc1OC(C)C,C31515214_decoy,CXCR4,Decoy,0,-8.10559,-7.56,-4.17,-7.277780543313392
CCc1ccccc1NC(=O)[C@H](C)S(=O)(=O)c1cccc(OC)c1,C47641416_decoy,CXCR4,Decoy,0,-7.44446,-7.96,-2.22,-3.914435429558645
CCSc1ccc(CC(=O)Nc2nnc(-c3ccsc3)o2)cc1,C49449231_decoy,CXCR4,Decoy,0,-9.43222,-7.41,-1.61,-11.068592032220488
COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)s1)c1ccccc1,C33911117_decoy,CXCR4,Decoy,0,-7.51438,-6.65,-2.46,-6.754369416625962
Cc1ccc(N2CC[C@H](C(=O)N[C@@H](C)CCc3ccco3)C2=O)cc1,C53121405_decoy,CXCR4,Decoy,0,-8.15623,-9.06,-1.55,-4.326457006367591
Cc1cccc(OC[C@H](C)NC(=O)/C=C/c2c(C)nn(C)c2Cl)c1,C53185224_decoy,CXCR4,Decoy,0,-7.78991,-8.45,-1.78,-3.9132540248598975
CC(C)NC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)c2ccccc2)cc1,C54249123_decoy,CXCR4,Decoy,0,-7.75084,-6.79,-1.93,-6.331897727964254
COc1cccc(CNS(=O)(=O)c2ccc(Cl)s2)c1OC,C56118782_decoy,CXCR4,Decoy,0,-8.37699,-7.61,-1.04,-7.111380163600229
COC(=O)c1c(NC(=O)Cc2ccc(OC)c(F)c2)sc(C)c1C,C14637257_decoy,CXCR4,Decoy,0,-7.77354,-7.29,-2.05,-9.38540983585849
C#Cc1cccc(N(CC(=O)NC)C(=O)COc2cc(C)ccc2C)c1,C63830107_decoy,CXCR4,Decoy,0,-7.12514,-8.16,-3.82,-8.014868190699774
CC[C@@H](c1cccc(OC)c1)N(C)C(=O)C(=O)c1c[nH]c2ccccc12,C65010313_decoy,CXCR4,Decoy,0,-7.48941,-7.71,-1.67,-6.560300690870387
CCOCCOc1ccc([C@@]2(C)Nc3ccccc3C(=O)N2C)cc1,C66128251_decoy,CXCR4,Decoy,0,-7.02014,-7.44,-1.97,-6.590362757919496
Cn1ncc(C(=O)Nc2ccc(OCC(F)(F)F)cc2)c1C(F)F,C66280776_decoy,CXCR4,Decoy,0,-6.35677,-8.16,-2.74,-7.378496071499465
Cc1cccc(C2(NC(=O)CSCc3noc(C)n3)CCCC2)c1,C66511550_decoy,CXCR4,Decoy,0,-7.63838,-8.58,-3.57,-8.184496931965734
CC(=O)c1cccc(S(=O)(=O)Nc2cc(F)ccc2OC(C)C)c1,C66586175_decoy,CXCR4,Decoy,0,-7.0803,-8.18,-1.2,-7.59662368936082
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)/C=C/c1cccc(OC(C)C)c1,C66634035_decoy,CXCR4,Decoy,0,-8.79098,-8.25,-2.15,-8.155649330403289
CCOC(=O)C(C)(C)NS(=O)(=O)c1ccc(Br)cc1,C66938019_decoy,CXCR4,Decoy,0,-7.09798,-6.95,-1.79,-8.765522972779895
CCOc1ccc(F)cc1NC(=O)/C=C/c1ccc(-n2ccnc2)cc1,C67192945_decoy,CXCR4,Decoy,0,-8.56236,-8.64,-3.2,-4.29966470698878
O=C(NCCOc1cccc(F)c1)c1ccn(-c2cccc(F)c2)n1,C67548277_decoy,CXCR4,Decoy,0,-7.10013,-7.13,-2.24,-3.3256621575413527
COc1ccc(OC[C@@H](O)C[NH2+]C[C@H](O)c2ccccc2)c(C(C)(C)C)c1,C06906305_decoy,CXCR4,Decoy,0,-7.99077,-7.86,-1.6,-6.923274196216327
CCc1ccc([C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NC)c2cccc(F)c2)cc1,C07615030_decoy,CXCR4,Decoy,0,-7.76306,-6.09,-1.36,-6.50631283877819
CC(=O)Nc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)cc1,C08326997_decoy,CXCR4,Decoy,0,-8.60948,-8.15,-1.61,-9.831591545713884
O=C([O-])[C@@H](C[NH2+]C1CC1)[C@H]([NH2+]C1CC1)c1ccc(Cl)cc1Cl,C08377221_decoy,CXCR4,Decoy,0,-7.82849,-6.57,-1.55,-9.741738812504709
C=CCNC(=O)NC(=O)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl,C09502975_decoy,CXCR4,Decoy,0,-8.46104,-7.7,-2.05,-9.03262621855652
CCNC(=O)NC(=O)[C@H](C)[NH2+][C@H](CCCc1ccccc1)c1ccccc1,C12667461_decoy,CXCR4,Decoy,0,-8.70147,-8.03,-2.18,-4.383937282261662
CC(C)[NH+](CCNS(=O)(=O)c1cc(N)ccc1Cl)C(C)C,C21515665_decoy,CXCR4,Decoy,0,-8.51455,-6.46,-3.26,-3.6462068123664215
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2F)cc1,C30498573_decoy,CXCR4,Decoy,0,-7.66985,-8.15,-0.89,-10.975370824678214
CCC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2F)cc1,C30498575_decoy,CXCR4,Decoy,0,-7.51662,-8.81,-2.77,-7.820040654660507
CCOc1ccc(-c2nc3ccc(NC(=O)C[NH3+])cn3c2CC)cc1,C31958822_decoy,CXCR4,Decoy,0,-8.372,-7.29,-2.05,-7.764864725380554
CCCCOc1ccc(-c2nc(NC(=O)CC[NH3+])sc2C)cc1,C31963667_decoy,CXCR4,Decoy,0,-8.77475,-6.1,-2.44,-3.768915094230167
COc1ccc(-c2cc3ccc(O)c(C[NH2+]CCO)c3oc2=O)cc1,C32501414_decoy,CXCR4,Decoy,0,-7.4666,-8.7,-1.16,-7.639427783183512
CCOc1cc(C[NH2+]C(C)(C)C)c(Br)cc1OCC(N)=O,C36612901_decoy,CXCR4,Decoy,0,-7.72634,-6.4,-2.95,-6.933278722162287
CCCNC(=O)[C@@H](C)Oc1c(Br)cc(C[NH3+])cc1OC,C36814886_decoy,CXCR4,Decoy,0,-8.7952,-6.73,-1.19,-8.863948002309304
CC(C)C[NH+](C)CCCC(=O)Nc1c(N)cc(Cl)cc1Cl,C37098980_decoy,CXCR4,Decoy,0,-7.81078,-7.27,-2.08,-10.264470056015687
CCCC[C@H]([NH3+])C(=O)Nc1ccc(C(=O)OCC)cc1Br,C37619914_decoy,CXCR4,Decoy,0,-8.501,-6.86,-3.05,-4.137020346179319
CCC[C@@](C)([NH3+])C(=O)N[C@H](C)c1ccc(OC)c(Br)c1,C37622659_decoy,CXCR4,Decoy,0,-8.51441,-7.54,-3.08,-9.936241365339129
C=CCNC(=O)[C@H](C)Oc1c(Br)cc(C[NH3+])cc1OCC,C37712091_decoy,CXCR4,Decoy,0,-8.03815,-6.69,-1.83,-4.029853439052954
C#CCNC(=O)COc1c(Cl)cc(Cl)cc1C[C@@H]([NH3+])CC,C37729052_decoy,CXCR4,Decoy,0,-8.98344,-6.64,-1.96,-4.086726444494634
CC(C)C[C@@H]([NH3+])C(=O)Nc1cc(Cl)c(OC(F)F)c(Cl)c1,C37767362_decoy,CXCR4,Decoy,0,-7.43792,-7.22,-1.35,-7.92593611026598
COc1ccc(-c2nc3ccc(N)cn3c2C[NH+](C)CCO)cc1C,C36273219_decoy,CXCR4,Decoy,0,-7.88522,-8.65,-3.88,-4.231750757880623
CCCNC(=O)C[NH2+]C[C@H](O)COc1cccc(Br)c1,C37892118_decoy,CXCR4,Decoy,0,-8.03216,-6.29,-0.77,-7.797956132459007
CC[NH+](CC)CCN[C@@H](C(N)=O)c1ccc(OC)c(Br)c1,C38052273_decoy,CXCR4,Decoy,0,-8.2177,-6.79,-2.33,-7.299214803454744
C[NH+](Cc1csc(Br)c1)C[C@H](O)COc1cccc(N)c1,C42360335_decoy,CXCR4,Decoy,0,-9.41038,-7.02,-3.51,-3.941903073060933
CC[NH+](CC/C(N)=N/O)Cc1cc(Br)ccc1OC,C42453261_decoy,CXCR4,Decoy,0,-7.54166,-6.37,-1.87,-9.290596068307536
C[C@@H](C[NH+](C)CCOc1ccc(Br)cc1)/C(N)=N/O,C42458407_decoy,CXCR4,Decoy,0,-7.93302,-5.47,-1.88,-6.978369193419823
CCCNC(=O)CC[NH2+]Cc1cc(Br)c(O)c(OC)c1,C44351632_decoy,CXCR4,Decoy,0,-8.383,-7.19,-1.94,-8.112393467975277
C[C@H](c1ccc(Cl)cc1)[NH+](C)CC(=O)Nc1ccc(C(N)=O)cc1,C46583893_decoy,CXCR4,Decoy,0,-8.65588,-8.53,-4.15,-4.322484589963282
CNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1,C46817822_decoy,CXCR4,Decoy,0,-5.94053,-8.45,-1.59,-7.138279721312696
CC[NH2+]CCC[NH2+][C@](C)(C(=O)[O-])c1ccccc1Br,C48844977_decoy,CXCR4,Decoy,0,-6.64135,-6.36,-2.06,-7.723752335434584
CC(C)C[C@@H](C[NH+](C)C)NS(=O)(=O)c1cc(N)ccc1Cl,C49554483_decoy,CXCR4,Decoy,0,-8.36765,-6.82,-1.94,-9.30365825931936
Cc1nn(CCCC[C@](C)([NH2+]C(C)C)C(N)=O)c(C)c1Br,C50595056_decoy,CXCR4,Decoy,0,-8.4041,-6.93,-4.38,-7.861718460532764
Cc1cc(OC[C@H](O)C[NH+](C)CC(N)=O)c(C(C)C)cc1Cl,C51827103_decoy,CXCR4,Decoy,0,-9.19249,-7.06,-1.33,-9.74977758093164
O[C@@H](C[NH2+][C@H]1CCCC[C@@H]1O)COc1ccc(Cl)c(Cl)c1,C52014251_decoy,CXCR4,Decoy,0,-8.7363,-6.51,-1.05,-7.426017344708794
OCC1([NH2+]C[C@@H](O)COc2c(Cl)cccc2Cl)CCCC1,C53069584_decoy,CXCR4,Decoy,0,-8.26831,-7.47,-2.25,-10.936414769818033
C[NH+](C)[C@H](CNC(=O)NNc1cccc(C#N)c1)c1ccc(F)cc1,C56937408_decoy,CXCR4,Decoy,0,-7.6508,-9.53,-2.03,-7.510189944087596
CCOc1c(Br)cc(Br)cc1CNCC[NH2+]CCO,C22074904_decoy,CXCR4,Decoy,0,-8.60987,-6.55,-2.06,-9.456547135568307
Cc1ccc(-n2nc(C)c(/C=N/NC(=O)[C@@H]([NH3+])CC(C)C)c2C)cc1,C59165707_decoy,CXCR4,Decoy,0,-8.35294,-8.18,-3.29,-4.01116878409658
CCCn1c(S[C@@H](c2ccc(Br)s2)[C@@H](C)[NH3+])n[nH]c1=O,C61594933_decoy,CXCR4,Decoy,0,-7.79188,-7.0,-2.0,-7.3961180262106225
COc1cc(C[NH2+]CC(C)C)cc(Br)c1OCCC(N)=O,C62729768_decoy,CXCR4,Decoy,0,-8.46997,-6.66,-1.44,-8.142195923112666
CC(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1OC[C@@H](C)C(N)=O,C62732941_decoy,CXCR4,Decoy,0,-9.01958,-7.29,-1.94,-10.433327627632432
C[C@H](C/C(N)=N/O)[NH+](C)CCOc1ccc(Br)cc1,C63089819_decoy,CXCR4,Decoy,0,-7.28633,-6.08,-2.2,-6.577994536945062
COc1ccc([C@H](CNS(N)(=O)=O)C2=c3ccccc3=[NH+]C2)cc1,C64025460_decoy,CXCR4,Decoy,0,-8.55006,-8.38,-0.75,-8.507586841694186
CC(C)C[NH+]1CCC(NC(=O)N2CCC[C@H](CCC(N)=O)C2)CC1,C66120811_decoy,CXCR4,Decoy,0,-8.22369,-6.48,-2.91,-6.962549137743378
COc1ccc(CCNC(=[NH2+])NCc2ccc(N(C)C)c(F)c2)cc1,C66243769_decoy,CXCR4,Decoy,0,-9.22644,-7.19,-1.39,-4.125745977089279
[NH2+]=C(NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)Nc1ccccc1,C66244260_decoy,CXCR4,Decoy,0,-9.38811,-7.6,-1.0,-9.90783373214471
CC(C)OCc1cccc(C[NH2+][C@@H](C(N)=O)c2ccc(F)cc2)c1,C66939679_decoy,CXCR4,Decoy,0,-8.27973,-7.51,-3.7,-8.06310332737475
COc1ccc([C@H](C)[NH2+][C@@H](C(N)=O)c2ccc(F)cc2)cc1OC,C66939725_decoy,CXCR4,Decoy,0,-7.90962,-7.67,-1.55,-3.570553846952512
CC(C)(C)OCc1cccc(C[NH2+][C@H](C(N)=O)c2ccc(F)cc2)c1,C66940582_decoy,CXCR4,Decoy,0,-8.50988,-7.91,-2.86,-7.975608489689852
Cc1cccc(C(=O)NNC(=O)NC[C@H](c2cccs2)[NH+](C)C)c1,C67359286_decoy,CXCR4,Decoy,0,-9.3128,-6.5,-2.69,-3.898701487725981
CC[C@H](CO)[NH2+]C[C@H](O)COc1ccc(Br)cc1,C04279517_decoy,CXCR4,Decoy,0,-7.74426,-6.73,-1.86,-7.2110739081635025
Cc1cc(OC[C@H](O)C[NH2+]C[C@H](C)O)c(C(C)C)cc1Cl,C02624425_decoy,CXCR4,Decoy,0,-9.38371,-7.91,-1.65,-10.93206603264734
Cc1ccc(-n2nc(C(F)(F)F)c3cc(C(=O)NCC[NH3+])sc32)cc1,C06770079_decoy,CXCR4,Decoy,0,-8.10298,-8.94,-2.75,-4.185464996061081
Cc1cc([C@H](C)[NH2+]Cc2ccc(S(N)(=O)=O)cc2)c(C)s1,C20553424_decoy,CXCR4,Decoy,0,-8.07512,-7.64,-2.83,-7.053102631631175
CC[C@H](C)[NH2+]Cc1cc(Br)ccc1OCC(N)=O,C20873076_decoy,CXCR4,Decoy,0,-7.77123,-6.91,-0.93,-8.408123570346051
CCc1c(-c2ccc(C)cc2)nc2ccc(NC(=O)CC[NH3+])cn12,C31958745_decoy,CXCR4,Decoy,0,-7.51044,-5.62,-0.54,-5.200337395985913
CC[C@@H](C)[C@@H]([NH3+])C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C35266490_decoy,CXCR4,Decoy,0,-8.50359,-6.72,-1.56,-6.417777963277795
C[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)s1,C35285770_decoy,CXCR4,Decoy,0,-9.65434,-6.04,-1.97,-5.568393777947776
C[C@H](C(=O)Nc1ccc(Cl)c(N)c1)[NH+](C)Cc1cccs1,C35716617_decoy,CXCR4,Decoy,0,-8.28677,-7.55,-1.42,-7.844808981329352
CCOc1c(Br)cc(Cl)cc1NC(=O)[C@H]([NH3+])C(C)C,C37020123_decoy,CXCR4,Decoy,0,-8.7816,-6.42,-2.45,-7.8690392122608115
CC(C)[NH2+][C@](C)(C(N)=O)c1cc2cc(Br)ccc2o1,C37446514_decoy,CXCR4,Decoy,0,-8.43619,-7.65,-1.28,-8.359314949313987
C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1ccc(S(N)(=O)=O)cc1,C37508116_decoy,CXCR4,Decoy,0,-8.37907,-7.83,-1.0,-3.8757229676503897
COc1ccc([C@@H](C)NC(=O)C[C@@H](C)[NH3+])cc1Br,C37608728_decoy,CXCR4,Decoy,0,-7.15923,-7.25,-1.16,-10.32335847370419
CC[C@H]([NH3+])Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC(C)C,C37726030_decoy,CXCR4,Decoy,0,-6.11425,-7.36,-1.54,-7.901238220274925
Cc1ccc(OC[C@H](O)C[NH2+][C@@H](C)CO)c(Br)c1,C37888677_decoy,CXCR4,Decoy,0,-8.42887,-6.9,-1.69,-8.506465858013252
C[C@@H]([NH2+]CCS(N)(=O)=O)c1ccc(Br)s1,C38002325_decoy,CXCR4,Decoy,0,-8.66044,-5.46,-1.11,-7.678161166410757
CC[C@H]([NH2+]Cc1c[nH]nc1C)c1cc(Br)ccc1O,C38011171_decoy,CXCR4,Decoy,0,-7.24261,-7.11,-2.59,-7.614778011242816
CC[C@@H](C)NC(=O)CC[NH2+]C[C@H](O)c1cccc(Br)c1,C38014429_decoy,CXCR4,Decoy,0,-9.08831,-7.31,-2.39,-8.467223915190193
CC(C)NC(=O)[C@@H](C)Oc1c(Cl)cc(Cl)cc1C[C@H](C)[NH3+],C37728982_decoy,CXCR4,Decoy,0,-8.83255,-7.02,-1.17,-10.621171532511871
CC(C)(C)OC(=O)N[C@@H](CC[NH3+])c1ccc(Br)cc1,C39795869_decoy,CXCR4,Decoy,0,-8.12586,-6.51,-4.3,-3.718749986124093
CC(C)c1ccccc1NS(=O)(=O)c1ccc([C@H](C)[NH3+])cc1,C20188017_decoy,CXCR4,Decoy,0,-7.91716,-8.4,-1.94,-8.554257457076897
CC(C)c1ccc(NS(=O)(=O)c2ccc([C@H](C)[NH3+])cc2)cc1,C20188021_decoy,CXCR4,Decoy,0,-7.84116,-8.63,-1.03,-11.039286074253654
C[C@@H](CNS(=O)(=O)c1cc(Br)ccc1N)[NH+](C)C,C40348205_decoy,CXCR4,Decoy,0,-7.65785,-6.64,-1.13,-7.914964255727576
CSCC[C@H]([NH3+])C(=O)Nc1ccc(OCC(F)(F)F)cc1,C40462833_decoy,CXCR4,Decoy,0,-8.10479,-5.54,-3.54,-6.436335548872522
C[C@@H]([NH2+]C(C)(C)C(N)=O)c1cc2cc(Br)ccc2o1,C40674210_decoy,CXCR4,Decoy,0,-7.56974,-7.52,-1.4,-11.352272243884237
C[NH2+]Cc1ccc(Br)cc1N(CC(N)=O)CC(C)C,C42691800_decoy,CXCR4,Decoy,0,-7.65117,-6.33,-2.59,-8.648187203339813
Cc1n[nH]c(S[C@@H](C[NH3+])c2ccc(Br)cc2)n1,C42959883_decoy,CXCR4,Decoy,0,-9.48537,-7.23,-2.08,-8.484730774261267
CC[C@H]([NH3+])[C@@H](Sc1nc(C)n[nH]1)c1ccc(Br)cc1,C42959907_decoy,CXCR4,Decoy,0,-8.58335,-6.9,-1.47,-7.708836625780429
C[NH+](C)C(C)(C)CNS(=O)(=O)c1c(Cl)cc(N)cc1Cl,C43411131_decoy,CXCR4,Decoy,0,-8.58811,-7.17,-1.84,-9.092658968520023
CCC[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(CC[NH3+])cc1Cl,C43490821_decoy,CXCR4,Decoy,0,-8.40451,-6.54,-2.2,-9.37883812922446
CC(C)CNC(=O)[C@@H](C)Oc1ccc(C[C@@H](C)[NH3+])cc1Cl,C43491368_decoy,CXCR4,Decoy,0,-8.33445,-6.98,-2.05,-8.07136838773301
CC(C)[C@@H](C)NC(=O)COc1ccc(C[C@H](C)[NH3+])cc1Cl,C43491662_decoy,CXCR4,Decoy,0,-8.28386,-6.99,-2.43,-4.082634857923026
COC(=O)[C@@H]([NH3+])Cc1cc(I)ccc1O,C44330981_decoy,CXCR4,Decoy,0,-7.32608,-6.46,-0.04,-7.728968171180384
COC(=O)[C@H]([NH3+])Cc1cc(I)c(C)cc1O,C44335257_decoy,CXCR4,Decoy,0,-7.13881,-6.63,-0.7,-3.2434523398208857
Cc1cc([C@@H](C)NS(=O)(=O)c2ccc(C[NH3+])s2)c(C)o1,C44731554_decoy,CXCR4,Decoy,0,-7.74056,-7.13,-1.94,-7.828508029631321
CCC[C@@H](C)NC(=O)COc1ccc(Cl)cc1C[C@H](C)[NH3+],C49289497_decoy,CXCR4,Decoy,0,-8.67147,-7.41,-1.27,-8.499726450855416
C[C@H]([NH3+])Cc1cc(Br)ccc1OCC(=O)NCC(F)(F)F,C49310286_decoy,CXCR4,Decoy,0,-7.51125,-7.23,-1.84,-11.308563093556504
[NH3+]CCc1ccc(S(=O)(=O)/N=c2\[nH]c3c(s2)CCC3)s1,C49548326_decoy,CXCR4,Decoy,0,-8.80093,-7.89,-3.45,-3.794193055485872
CC(C)CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[C@@H](C)[NH3+],C50209223_decoy,CXCR4,Decoy,0,-6.8998,-7.71,-1.89,-7.005996513208145
C[C@H]([NH3+])[C@@H](Sc1ncnc2nc[nH]c12)c1ccc(Cl)s1,C51036249_decoy,CXCR4,Decoy,0,-8.29865,-7.23,-1.34,-7.289080994124653
[NH3+][C@@H](Cc1ccccc1)[C@@H](O)c1cc(Br)c2c(c1)OCO2,C54685689_decoy,CXCR4,Decoy,0,-8.28116,-5.76,-1.59,-2.949346351515489
CCOc1ccc([C@@H](O)CC[NH+](C)Cc2ccccc2)cc1N,C57662812_decoy,CXCR4,Decoy,0,-8.51802,-8.03,-1.71,-8.060825176115634
CC[C@@H](C)NC(=O)COc1ccc(CC[NH3+])cc1Br,C62703677_decoy,CXCR4,Decoy,0,-7.90787,-7.0,-1.91,-7.913112724815988
CC(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1O[C@@H](C)C(N)=O,C62732936_decoy,CXCR4,Decoy,0,-8.86323,-7.3,-1.83,-10.00994296602808
C[C@H](COc1c(Br)cccc1C[NH2+]C(C)(C)C)C(N)=O,C62733503_decoy,CXCR4,Decoy,0,-7.89104,-6.94,-1.4,-10.28572848087781
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)S[C@@H]1NN=C(N)S1,C39995820_decoy,CXCR4,Decoy,0,-8.00459,-8.49,-1.07,-8.263651373657348
CC[NH+]1C[C@H]2[C@@H](c3ccc4c(c3)CC(C)(C)O4)N[C@](CO)(CCO)[C@H]2C1,C65370832_decoy,CXCR4,Decoy,0,-9.69809,-7.78,-3.94,-4.092180958274302
CC(C)Cc1ccc([C@H]2N[C@](CO)(CCO)[C@H]3C[NH+](C)C[C@@H]23)cc1,C65397859_decoy,CXCR4,Decoy,0,-9.72823,-8.03,-1.32,-10.506126580438206
COCC/[NH+]=C(/N)NCC(C)(C)c1ccc(Br)cc1,C66243236_decoy,CXCR4,Decoy,0,-8.65791,-6.31,-0.84,-7.278128638556638
C[C@H]([NH2+]Cc1ccc(OCC(N)=O)cc1)c1ccc(F)c(Cl)c1,C67251044_decoy,CXCR4,Decoy,0,-9.36487,-8.41,-2.75,-10.869790186001364
CC[C@@H](C)[C@H]([NH3+])c1nc(C(=O)Nc2ccc(Br)cc2)co1,C06933961_decoy,CXCR4,Decoy,0,-8.27026,-7.45,-2.64,-6.590514762403416
COc1cc(/C=N/NC(=[NH2+])SC)cc(Br)c1O,C06004370_decoy,CXCR4,Decoy,0,-8.14961,-6.76,-2.45,-3.505879439390369
CS(=O)(=O)CC[C@@H]([NH3+])C(=O)Nc1cc(Cl)c(Cl)cc1Cl,C20021735_decoy,CXCR4,Decoy,0,-9.34147,-7.12,-2.28,-8.856513441768284
CC[C@@H](CO)[NH2+]C[C@H](O)Cn1c(C)c(C)c2cccc(Cl)c21,C28296729_decoy,CXCR4,Decoy,0,-8.10563,-7.43,-1.81,-8.927975840186283
COC(=O)c1c(NC(=O)C[NH3+])sc(C)c1-c1ccc(C)cc1,C31960043_decoy,CXCR4,Decoy,0,-7.12087,-7.25,-1.28,-7.34771283933701
C[C@H](C(=O)Nc1cc(Cl)ccc1N)[NH+](C)Cc1ccsc1,C35718416_decoy,CXCR4,Decoy,0,-9.2431,-7.48,-1.38,-7.867249680149931
C[C@H]([NH2+]Cc1cc(Br)cs1)c1ccc(S(N)(=O)=O)cc1,C36954960_decoy,CXCR4,Decoy,0,-10.046,-7.55,-2.06,-9.422914960296508
CCOC(=O)c1ccc(NC(=O)[C@@H](C)[NH3+])c(Br)c1,C37016856_decoy,CXCR4,Decoy,0,-7.51859,-7.35,-0.44,-4.805024074623793
COc1c(Br)cc(Cl)cc1NC(=O)[C@@H]([NH3+])C(C)C,C37019691_decoy,CXCR4,Decoy,0,-8.48357,-7.11,-2.3,-9.15092889800704
CC[C@@H]([NH3+])C(=O)Nc1cc(Cl)cc(Br)c1OC,C37019726_decoy,CXCR4,Decoy,0,-8.15475,-7.08,-0.84,-9.845309283449344
Cc1ncsc1[C@H](C)[NH2+][C@@H](C)c1ccc(S(N)(=O)=O)cc1,C37278087_decoy,CXCR4,Decoy,0,-9.07057,-7.28,-1.22,-8.614093944230701
C[C@@H]([NH2+]Cc1cccc(S(N)(=O)=O)c1)c1sccc1Br,C37650045_decoy,CXCR4,Decoy,0,-9.13138,-7.22,-2.11,-7.720153342465597
C[C@H]([NH3+])c1ccc(OCC(=O)Nc2cccc(Br)c2)cc1,C37697489_decoy,CXCR4,Decoy,0,-8.19896,-7.95,-2.01,-8.442874524484388
CC[C@@H](C)NC(=O)[C@H](C)Oc1c(Cl)cc(Cl)cc1CC[NH3+],C37722134_decoy,CXCR4,Decoy,0,-9.34907,-7.44,-0.8,-10.196185095235023
C#CCNC(=O)[C@@H](C)Oc1c(Cl)cc(Cl)cc1CC[NH3+],C37722149_decoy,CXCR4,Decoy,0,-8.39377,-6.65,-3.21,-3.937761112110012
C[C@H](Oc1ccc(Br)cc1C[C@@H](C)[NH3+])C(=O)NC(C)(C)C,C37725293_decoy,CXCR4,Decoy,0,-7.82502,-6.53,-2.17,-3.5856476151910965
CC[C@H]([NH3+])Cc1cc(Cl)ccc1OCC(=O)N[C@@H](C)CC,C37725979_decoy,CXCR4,Decoy,0,-7.93809,-7.37,-3.55,-3.999070362476461
CC[C@@H](C)NC(=O)COc1c(Cl)cc(Cl)cc1C[C@H](C)[NH3+],C37728928_decoy,CXCR4,Decoy,0,-9.02595,-7.34,-0.99,-14.11645263838506
CC[C@@H]([NH3+])Cc1cc(Cl)cc(Cl)c1O[C@@H](C)C(=O)NC,C37729143_decoy,CXCR4,Decoy,0,-8.82598,-7.18,-1.43,-11.412828448068916
CC(C)C[NH2+][C@@H](C(N)=O)c1cc(Br)c2c(c1)OCCO2,C37946309_decoy,CXCR4,Decoy,0,-8.86326,-7.44,-1.1,-12.81721106846796
C[C@H]([NH2+]CCS(N)(=O)=O)c1ccc(Br)s1,C38002324_decoy,CXCR4,Decoy,0,-8.70495,-6.5,-1.06,-8.68931701153536
CC[C@@H](C)NC(=O)CC[NH2+][C@H](CC)c1cc(Br)ccc1O,C38013759_decoy,CXCR4,Decoy,0,-8.40204,-6.74,-1.7,-8.290942471605083
COc1ccc(NC(=O)[C@@H]([NH3+])CCSC)c(C(F)(F)F)c1,C40462540_decoy,CXCR4,Decoy,0,-7.33984,-6.89,-2.81,-6.9991293864956905
C[NH+](CCCC/C(N)=N/O)Cc1cc(Br)cs1,C42399491_decoy,CXCR4,Decoy,0,-7.94996,-5.65,-3.7,-3.4323564347435966
CCC[NH2+]Cc1cccc(Br)c1O[C@@H](C)C(N)=O,C42411781_decoy,CXCR4,Decoy,0,-7.53408,-6.38,-4.32,-4.067305664604754
CCC[NH2+]Cc1ccc(Br)cc1N(CC(N)=O)C(C)C,C42438441_decoy,CXCR4,Decoy,0,-8.15479,-6.24,-3.05,-8.729387092080778
C[C@@H]([NH3+])[C@@H](Sc1nccc(=O)[nH]1)c1ccc(Br)cc1,C42959345_decoy,CXCR4,Decoy,0,-7.90992,-6.54,-2.85,-9.639270498862505
CCN(CC(=O)NC)[C@@H](c1cc(Br)cs1)[C@@H](C)[NH3+],C43285709_decoy,CXCR4,Decoy,0,-8.27271,-5.72,-0.47,-9.973569691119518
CCC(CC)NC(=O)[C@H](C)Oc1ccc(CC[NH3+])cc1Cl,C43490819_decoy,CXCR4,Decoy,0,-8.19091,-6.8,-2.95,-3.936348165967632
CCC[C@H](C)NC(=O)[C@H](C)Oc1ccc(CC[NH3+])cc1Cl,C43490826_decoy,CXCR4,Decoy,0,-8.11791,-6.77,-1.73,-7.752365608546921
CC[C@H]([NH2+]CCCS(N)(=O)=O)c1ccc(Cl)c(Cl)c1,C45069282_decoy,CXCR4,Decoy,0,-9.74984,-7.35,-1.99,-9.194294911071069
CCCNC(=O)CC[NH2+]C[C@@H](O)c1cccc(Br)c1,C45073734_decoy,CXCR4,Decoy,0,-7.59997,-6.14,-0.58,-7.572286689258302
CC[NH2+][C@@](C)(CCSc1ccc(C(F)(F)F)cn1)C(N)=O,C45559318_decoy,CXCR4,Decoy,0,-7.3067,-6.98,-0.95,-10.377133572063164
CC(C)[NH2+][C@@](C)(CSc1ccc(C(F)(F)F)cn1)C(N)=O,C45559362_decoy,CXCR4,Decoy,0,-8.39345,-7.71,-0.78,-7.872258207394791
CC[C@H](C)NC(=O)[C@H](C)Oc1c(Br)cccc1CC[NH3+],C48797922_decoy,CXCR4,Decoy,0,-7.69081,-6.86,-1.95,-11.360174101882524
CCC(C)(C)NC(=O)COc1c(Br)cccc1C[C@@H](C)[NH3+],C49282311_decoy,CXCR4,Decoy,0,-7.84831,-7.51,-5.18,-4.627485061806095
CCC[C@H](C)NC(=O)COc1ccc(Br)cc1C[NH3+],C49287184_decoy,CXCR4,Decoy,0,-8.17261,-6.15,-2.31,-3.644107817011753
C[C@H](NS(=O)(=O)c1ccc(CC[NH3+])s1)c1ccccc1F,C49532566_decoy,CXCR4,Decoy,0,-8.10861,-5.86,-3.51,-5.259882583668677
C[C@H](NS(=O)(=O)c1ccc(C[NH3+])s1)c1cccc(F)c1,C49532570_decoy,CXCR4,Decoy,0,-7.57808,-8.03,-1.84,-7.426094204153363
C[C@@H](NS(=O)(=O)c1ccc(CC[NH3+])s1)c1cccc(F)c1,C49532573_decoy,CXCR4,Decoy,0,-9.11106,-7.89,-1.81,-4.832231352822701
CC[C@@H]([NH3+])[C@@H](Sc1ncnc2nc[nH]c12)c1ccc(Cl)s1,C51036052_decoy,CXCR4,Decoy,0,-9.69455,-6.5,-2.4,-3.7705352406703847
O[C@@H](C[NH2+][C@@H]1CCCC[C@@H]1O)COc1ccc(Br)cc1,C52013887_decoy,CXCR4,Decoy,0,-7.93371,-6.79,-2.03,-7.166654188509883
CC(C)CCNC(=O)[C@H](C)Oc1ccc(Br)cc1[C@H](C)[NH3+],C52066429_decoy,CXCR4,Decoy,0,-7.18755,-6.23,-0.9,-7.379532914928043
CC(C)C[C@H]([NH3+])[C@H](O)c1cc(Br)c2c(c1)OCCCO2,C54929307_decoy,CXCR4,Decoy,0,-8.85707,-7.81,-1.77,-10.458632755220872
C[C@H](NS(=O)(=O)c1ccc(C#CC[NH3+])cc1)c1ccsc1,C61372080_decoy,CXCR4,Decoy,0,-8.40766,-7.56,-2.8,-3.6695096724254697
C=CCNC(=O)[C@H](C)Oc1ccc(C[C@H]([NH3+])CC)cc1Br,C62705194_decoy,CXCR4,Decoy,0,-8.43393,-6.64,-1.66,-8.37862019631175
CC(C)C[NH2+]Cc1ccc(Br)cc1N(CC(N)=O)C(C)C,C62737555_decoy,CXCR4,Decoy,0,-7.65474,-6.46,-3.79,-3.56870499646534
CC(C)(C[NH3+])NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl,C63020566_decoy,CXCR4,Decoy,0,-8.87463,-6.92,-1.74,-8.999729829748482
CS(=O)(=O)c1ccc(Sc2cccc(Cl)c2C(N)=[NH2+])cc1,C63131364_decoy,CXCR4,Decoy,0,-9.13834,-5.95,-2.18,-6.190606792726551
[NH2+]=C(NO)c1cccc(CS(=O)(=O)c2ccc(Cl)cc2)c1,C05992377_decoy,CXCR4,Decoy,0,-10.4475,-6.22,-2.3,-6.434969984187963
COc1cc2c(cc1OC)[C@@H](c1ccc(Cl)cc1N)[NH2+]CC2,C00173398_decoy,CXCR4,Decoy,0,-8.45439,-5.82,-2.65,-5.766519962958167
NC(=[NH2+])c1ccc(Oc2cc(Cl)c(Cl)cc2Cl)nc1,C21047538_decoy,CXCR4,Decoy,0,-10.1521,-6.55,-1.48,-9.632098692655422
Nn1cnc2c(c(-c3ccccc3)cn2-c2ccc(Cl)cc2)c1=[NH2+],C03852038_decoy,CXCR4,Decoy,0,-8.60015,-6.48,-1.11,-5.597416186866894
CCOc1c(Br)cc(C[NH2+][C@@H](C)C(N)=O)cc1Br,C35047440_decoy,CXCR4,Decoy,0,-8.55883,-6.82,-0.68,-9.923965616499178
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1ccc(Br)o1,C35382351_decoy,CXCR4,Decoy,0,-7.58079,-6.79,-1.1,-6.237585320127884
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1ccc(Br)s1,C35382354_decoy,CXCR4,Decoy,0,-8.51353,-7.08,-1.89,-6.1007238257192125
[NH3+][C@H]1C[C@@H]1NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl,C36264249_decoy,CXCR4,Decoy,0,-8.42907,-6.94,-1.88,-10.856081288918324
[NH3+]C1CCC(NS(=O)(=O)c2cc(Cl)sc2Cl)CC1,C36880746_decoy,CXCR4,Decoy,0,-9.30682,-7.11,-1.79,-8.993872402709309
O=C(Nc1ccc(Br)c(C(F)(F)F)c1)[C@H]1C[C@H](O)C[NH2+]1,C37014805_decoy,CXCR4,Decoy,0,-7.2801,-8.49,-2.81,-8.220886224848153
Nc1cc(Cl)cc(Cl)c1S(=O)(=O)N[C@@H]1C[NH+]2CCC1CC2,C37053363_decoy,CXCR4,Decoy,0,-8.79928,-8.2,-1.52,-11.37408628115612
C[C@@H]1C[NH+](C)[C@@H](C)C[C@@H]1Nc1cc(S(N)(=O)=O)ccc1Cl,C37138278_decoy,CXCR4,Decoy,0,-9.60076,-8.17,-3.32,-9.319337620428026
C[C@@H]([NH2+]Cc1ccc(Br)o1)c1ccc2[nH]c(=O)[nH]c2c1,C37163196_decoy,CXCR4,Decoy,0,-7.56243,-7.66,-1.27,-7.15224467008876
CC[C@H]([NH2+]CCS(N)(=O)=O)c1ccc(Cl)c(Cl)c1,C37261812_decoy,CXCR4,Decoy,0,-9.76035,-6.8,-1.39,-9.354782915074804
[NH3+][C@@H](c1ccc2[nH]c(=O)oc2c1)c1ccc(Br)cc1F,C37308652_decoy,CXCR4,Decoy,0,-8.14289,-7.93,-3.19,-6.160926135374745
[NH3+][C@@H](c1ccc2c(c1)NC(=O)CO2)c1ccc(Br)cc1F,C37371494_decoy,CXCR4,Decoy,0,-7.48014,-7.8,-5.59,-2.235921925080031
CCC[NH2+][C@@](C)(C(N)=O)c1cc2cc(Br)ccc2o1,C37513836_decoy,CXCR4,Decoy,0,-7.73934,-6.98,-0.74,-8.114169995797946
[NH2+]=c1oc2cc(O)ccc2cc1C(=O)Nc1ccc(Br)cc1,C04866105_decoy,CXCR4,Decoy,0,-8.43239,-7.63,-1.44,-6.494820439041044
NC(=O)N1CCC([NH2+]Cc2ccc(Br)s2)CC1,C38018282_decoy,CXCR4,Decoy,0,-8.10067,-7.1,-0.55,-7.32864083082331
[NH3+][C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1,C38050129_decoy,CXCR4,Decoy,0,-8.15194,-7.04,-1.45,-7.083592843345886
CC(C)(C)c1ccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2[NH3+])cc1,C38050349_decoy,CXCR4,Decoy,0,-8.19863,-7.69,-2.15,-7.043872471766088
NC(=[NH2+])c1ccc(-n2cc(Br)cn2)cc1C(F)(F)F,C38054392_decoy,CXCR4,Decoy,0,-7.78015,-7.94,-3.73,-3.519890197540396
COc1ccc([C@H]([NH3+])c2ccc3[nH]c(=O)oc3c2)cc1Br,C38074057_decoy,CXCR4,Decoy,0,-6.85332,-7.1,-0.11,-6.098966618288439
COc1ccc([C@H](C)NC(=O)[C@@H]([NH3+])CC(C)C)cc1Br,C37045598_decoy,CXCR4,Decoy,0,-8.13089,-6.84,-1.69,-8.881514314015227
CN(Cc1cc(Br)cs1)c1ccc(C(N)=[NH2+])cn1,C42399498_decoy,CXCR4,Decoy,0,-9.75407,-6.64,-0.75,-7.660629258231679
CC1(C)CC(NC(=O)C(=O)Nc2cccc(Cl)c2)CC(C)(C)[NH2+]1,C42645730_decoy,CXCR4,Decoy,0,-9.40488,-7.11,-3.06,-6.014704559458284
CC1(C)CC(NC(=O)C(=O)Nc2ccc(F)c(Cl)c2)CC(C)(C)[NH2+]1,C42645855_decoy,CXCR4,Decoy,0,-9.28879,-6.41,-2.49,-6.084252478545181
Cc1ccc(C(N)=[NH2+])c(Oc2cc(Cl)c(Cl)cc2Cl)n1,C43401469_decoy,CXCR4,Decoy,0,-8.82835,-7.12,-1.99,-6.198987943269809
Cc1cnc(Sc2ccc(C(N)=[NH2+])c(C(F)(F)F)c2)nc1,C48771660_decoy,CXCR4,Decoy,0,-8.37102,-7.74,-1.61,-8.017733790945629
CNC(=O)[C@@H](CC(C)C)[NH2+]Cc1cccc(Br)c1O,C48797114_decoy,CXCR4,Decoy,0,-7.36873,-6.94,-1.44,-8.09801145312853
CC(C)[C@H](C)NC(=O)COc1ccc(Br)cc1C[NH3+],C49307217_decoy,CXCR4,Decoy,0,-8.01262,-6.77,-0.84,-8.063893368311827
[NH3+]CC(=O)/N=c1/[nH]c(-c2ccc(Br)cc2)cs1,C31959380_decoy,CXCR4,Decoy,0,-8.7104,-6.59,-0.58,-10.18538184466014
[NH3+][C@H]1C[C@@H]1C(=O)Nc1cc(Cl)c(OC(F)F)c(Cl)c1,C50459863_decoy,CXCR4,Decoy,0,-7.32836,-7.44,-0.27,-12.51029833317194
CCC[C@@H]([NH2+]CC)c1cc2[nH]c(=O)[nH]c2cc1Br,C52094650_decoy,CXCR4,Decoy,0,-7.26624,-6.56,-1.46,-7.902888793171197
COCC[C@@H]([NH3+])C(=O)Nc1ccc(Cl)cc1C(F)(F)F,C52790844_decoy,CXCR4,Decoy,0,-6.87113,-7.66,-2.22,-9.91166501937971
COCC[C@@H]([NH3+])C(=O)Nc1c(Cl)cc(Cl)cc1Cl,C52791254_decoy,CXCR4,Decoy,0,-8.60573,-6.41,-3.91,-3.9246819543200737
C[NH+](C)CC1CCN(c2cccc(Cl)c2/C(N)=N/O)CC1,C52905364_decoy,CXCR4,Decoy,0,-8.02711,-6.56,-0.91,-8.979024815426433
COc1ccccc1[C@H](C[NH3+])CC(=O)Nc1ccc(C)cc1C,C57657100_decoy,CXCR4,Decoy,0,-7.80224,-7.76,-4.0,-4.164562511701879
COc1ccccc1[C@@H](C[NH3+])CC(=O)Nc1ccc(C)cc1C,C57657102_decoy,CXCR4,Decoy,0,-7.42418,-7.83,-3.4,-7.838803013329777
COc1ccccc1[C@H](C[NH3+])CC(=O)Nc1cc(C)ccc1C,C57657103_decoy,CXCR4,Decoy,0,-7.89596,-7.79,-1.92,-8.162641005171134
C[C@H](C[NH3+])N1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O,C57845665_decoy,CXCR4,Decoy,0,-8.23875,-6.92,-2.23,-7.563974079713518
C[C@H](C(=O)Nc1c(N)cc(Cl)cc1Cl)[NH+]1CCCOCC1,C61913855_decoy,CXCR4,Decoy,0,-8.90907,-7.78,-0.91,-9.070259502156032
CC[C@@H]([NH3+])Cc1ccc(O[C@H](C)C(=O)NC)c(Br)c1,C62705250_decoy,CXCR4,Decoy,0,-8.11337,-6.48,-1.79,-11.202491664819076
C[C@@H](Oc1ccc(C[NH2+]C(C)(C)C)cc1Br)C(N)=O,C62727935_decoy,CXCR4,Decoy,0,-7.58107,-6.71,-2.78,-6.928102254171846
[NH3+][C@H](c1cn[nH]c1)c1cc2c(cc1Br)OCCCO2,C62776027_decoy,CXCR4,Decoy,0,-8.09233,-7.98,-1.62,-7.975947152942311
[NH3+][C@@H](c1cn[nH]c1)c1cc2c(cc1Br)OCCCO2,C62776028_decoy,CXCR4,Decoy,0,-7.79045,-6.41,-1.53,-6.176723951847989
CC1CCC(C[NH2+][C@@H](C)c2ccc(S(N)(=O)=O)cc2)CC1,C63144696_decoy,CXCR4,Decoy,0,-9.01951,-8.1,-1.64,-8.882497371442383
CC1CCC(C[NH2+][C@H](C)c2ccc(S(N)(=O)=O)cc2)CC1,C63144697_decoy,CXCR4,Decoy,0,-8.88523,-7.16,-1.49,-7.899793975712328
[NH3+][C@@H]1CCC[C@H]1NS(=O)(=O)c1ccc(I)cc1,C63175221_decoy,CXCR4,Decoy,0,-8.26498,-6.72,-2.53,-6.428580030145499
Cc1c(C)c(C)c(S(=O)(=O)N[C@H]2CCC[C@H]2[NH3+])c(C)c1C,C63176254_decoy,CXCR4,Decoy,0,-8.39712,-7.45,-1.77,-3.3133852210595207
CC1(C)CC(NC(=O)c2n[nH]c(C3CC3)c2Br)CC(C)(C)[NH2+]1,C65215033_decoy,CXCR4,Decoy,0,-7.86336,-5.87,-0.9,-5.350716352677183
COc1cc(N[C@@H](C)CCC[NH3+])c2ncc(Br)cc2c1,C01607643_decoy,CXCR4,Decoy,0,-7.99572,-7.12,-0.07,-12.091049857180002
C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[NH+](C)Cc1ccc(Cl)s1,C08158187_decoy,CXCR4,Decoy,0,-8.40613,-6.9,-1.51,-3.77503620040873
CCOc1ccc(Br)cc1C[NH2+]CCNCCO,C22075949_decoy,CXCR4,Decoy,0,-7.65955,-6.41,-1.08,-9.284098282154964
C[C@H]([NH2+][C@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(F)cc1F,C25242358_decoy,CXCR4,Decoy,0,-6.51986,-8.89,-1.14,-8.111112187457016
CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)C[NH3+],C31960004_decoy,CXCR4,Decoy,0,-7.54411,-7.34,-3.05,-3.899513876704777
CC(=O)Nc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2F)cc1,C32811272_decoy,CXCR4,Decoy,0,-7.49292,-8.59,-2.37,-7.1779544203497405
C[C@H]([NH3+])c1nc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)cs1,C33670926_decoy,CXCR4,Decoy,0,-10.1715,-7.23,-4.0,-7.905026045583427
CC(C)C[C@@H]([NH3+])CNS(=O)(=O)c1cc(Cl)ccc1C#N,C36298991_decoy,CXCR4,Decoy,0,-8.75618,-7.65,-2.06,-8.608760393982086
C[C@@H]([NH2+]Cc1csc(Br)c1)c1ccc(S(N)(=O)=O)cc1,C36954939_decoy,CXCR4,Decoy,0,-10.3907,-7.84,-1.74,-9.105084184605442
CC[C@H]([NH3+])C(=O)N[C@@H](C)c1ccc(OC)c(Br)c1,C37045617_decoy,CXCR4,Decoy,0,-9.08651,-6.88,-0.83,-9.296625803990954
CCCC[C@H]([NH3+])C(=O)N[C@H](C)c1ccc(OC)c(Br)c1,C37620592_decoy,CXCR4,Decoy,0,-8.15723,-7.23,-2.5,-9.191595664419236
C[C@@H]([NH2+]Cc1cccc(S(N)(=O)=O)c1)c1ccc(Br)cc1,C37649844_decoy,CXCR4,Decoy,0,-9.1926,-8.09,-0.99,-7.795019687124946
COc1cc(Br)c([C@H]([NH2+]C(C)C)C(N)=O)cc1OC,C37895130_decoy,CXCR4,Decoy,0,-7.52241,-6.47,-2.5,-9.641460131776617
COc1cc(Br)c([C@@H]([NH2+]C(C)C)C(N)=O)cc1OC,C37895131_decoy,CXCR4,Decoy,0,-7.15695,-6.62,-1.8,-9.50485666756416
CC[C@@H](C)[NH2+][C@@H](C(N)=O)c1ccc(OC)c(Br)c1,C38065156_decoy,CXCR4,Decoy,0,-7.64323,-6.74,-1.76,-8.653649999778581
COc1cc(C[NH3+])cc(Cl)c1O[C@@H](C)C(=O)NCC(C)C,C20470650_decoy,CXCR4,Decoy,0,-8.1665,-6.35,-1.99,-3.779356442421252
C[C@H](C#N)C[NH+](C)CCC(=O)Nc1c(Cl)cc(N)cc1Cl,C42454670_decoy,CXCR4,Decoy,0,-7.9853,-7.72,-1.55,-3.837542741727339
CC[C@H]([NH3+])[C@@H](Sc1ncn[nH]1)c1ccc(Br)cc1,C42958737_decoy,CXCR4,Decoy,0,-8.45517,-6.9,-1.66,-8.029050109677033
CC[C@H](C)[C@H]([NH3+])c1nc(C(=O)N[C@H](C)c2ccc3ccccc3c2)co1,C43213432_decoy,CXCR4,Decoy,0,-9.29618,-7.51,-2.63,-7.702051362419408
CC(C)[C@H]([NH3+])c1nc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)co1,C43213759_decoy,CXCR4,Decoy,0,-9.23533,-8.01,-3.47,-4.212576753236945
CC(C)[C@@H]([NH3+])c1nc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)co1,C43216429_decoy,CXCR4,Decoy,0,-9.05009,-9.31,-4.02,-4.381269772128368
CC(=O)Nc1ccccc1O[C@@H](C[NH3+])c1ccc(Br)s1,C43264257_decoy,CXCR4,Decoy,0,-8.34564,-7.03,-1.37,-8.490069232296262
CC[C@@H]([NH3+])[C@@H](Sc1ncn[nH]1)c1ccc(Br)s1,C43283332_decoy,CXCR4,Decoy,0,-8.38125,-6.35,-2.02,-3.4881319999093217
CC(C)C[NH+](CC/C(N)=N/O)Cc1cc(F)ccc1Br,C43418807_decoy,CXCR4,Decoy,0,-8.69016,-7.83,-2.31,-9.147595846431027
CCOC(=O)[C@H]([NH3+])Cc1cc(Br)c(O)c(OC)c1,C44339560_decoy,CXCR4,Decoy,0,-8.81436,-6.41,-1.56,-8.338018043826
CCOC(=O)[C@H]([NH3+])Cc1cc(Br)c(C)c(Br)c1O,C44362095_decoy,CXCR4,Decoy,0,-9.08506,-6.61,-3.15,-3.8167823767875393
CCOC(=O)c1cc(-c2ccc(Cl)cc2)oc1C[C@H]([NH3+])CO,C44464760_decoy,CXCR4,Decoy,0,-7.92237,-6.82,-0.87,-3.6351619830434334
Cn1nc(C(F)(F)F)c(C[C@H]([NH3+])CO)c1Oc1ccc(Cl)cc1,C44465465_decoy,CXCR4,Decoy,0,-7.47049,-7.87,-2.0,-8.335398354765625
C[C@@H]([NH2+]CCCS(N)(=O)=O)c1cc2cc(Br)ccc2o1,C45066521_decoy,CXCR4,Decoy,0,-9.77427,-7.62,-0.89,-9.989853120864788
CCCNC(=O)CC[NH2+][C@@H](CC)c1cc(Br)ccc1O,C45072145_decoy,CXCR4,Decoy,0,-8.43733,-7.13,-1.57,-8.244783332268202
C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)[NH+](C)CC(N)=O,C47628553_decoy,CXCR4,Decoy,0,-7.45732,-7.88,-3.83,-3.880390436336281
CC(C)CCNC(=O)[C@@H](C)Oc1c(Br)cccc1C[NH3+],C48787726_decoy,CXCR4,Decoy,0,-7.6091,-6.4,-1.73,-3.64560898783478
CCC[C@@H](C)NC(=O)[C@@H](C)Oc1c(Br)cccc1CC[NH3+],C48797937_decoy,CXCR4,Decoy,0,-8.12055,-7.49,-2.75,-4.139222165492403
COC[C@H](C)[NH+](C)[C@@H](C)C(=O)Nc1c(N)cc(Cl)cc1Cl,C49025775_decoy,CXCR4,Decoy,0,-8.49269,-7.24,-4.37,-7.962000290739787
CC(C)[C@@H](C[NH+](C)C)NS(=O)(=O)c1ccc(Cl)cc1N,C49192901_decoy,CXCR4,Decoy,0,-7.52792,-6.65,-2.1,-8.862408514705988
CC(C)[C@@H](C[NH+](C)C)NS(=O)(=O)c1cc(N)cc(Cl)c1F,C49192972_decoy,CXCR4,Decoy,0,-8.31945,-6.16,-3.2,-7.670054738470079
CCC(C)(C)NC(=O)COc1ccc(Br)cc1C[C@H](C)[NH3+],C49282293_decoy,CXCR4,Decoy,0,-8.15424,-7.33,-1.98,-8.532889119420382
[NH3+]CCc1cc(Cl)cc(Cl)c1OCC(=O)NCC(F)(F)F,C49310269_decoy,CXCR4,Decoy,0,-8.23042,-6.94,-3.43,-3.93943576225209
C[C@H](NS(=O)(=O)c1ccc(CC[NH3+])s1)c1ccccc1Cl,C49512486_decoy,CXCR4,Decoy,0,-8.04898,-6.47,-2.17,-6.760354517393499
NC(=O)C1CCC([NH2+]CCOc2cccc(Br)c2)CC1,C49596082_decoy,CXCR4,Decoy,0,-8.68643,-7.77,-1.45,-9.760397104469352
NS(=O)(=O)CCC[NH2+]Cc1cc(Br)c(Br)o1,C50361431_decoy,CXCR4,Decoy,0,-9.22834,-6.03,-0.73,-8.796587935018973
CCOc1cc(C[NH3+])cc(Br)c1OCCCCCO,C51020011_decoy,CXCR4,Decoy,0,-9.22526,-6.42,-2.17,-8.98221796516282
CC[C@@H](C)CNS(=O)(=O)c1c(Cl)cc(C#CC[NH3+])cc1Cl,C54491320_decoy,CXCR4,Decoy,0,-8.49148,-7.09,-1.92,-7.581070290013287
CCCn1c(S[C@H](c2cc(Br)cs2)[C@@H](C)[NH3+])n[nH]c1=O,C61594832_decoy,CXCR4,Decoy,0,-8.73694,-6.82,-1.21,-8.099807460785934
CCCn1c(S[C@H](c2cc(Br)cs2)[C@H](C)[NH3+])n[nH]c1=O,C61594834_decoy,CXCR4,Decoy,0,-9.3824,-6.57,-2.37,-8.749267470226965
CCC[NH2+]Cc1cccc(Br)c1O[C@H](CC)C(N)=O,C61675989_decoy,CXCR4,Decoy,0,-7.83116,-6.75,-1.61,-9.463397407138029
CC[C@@H]([NH3+])Cc1ccc(OCCC(=O)NC)c(Br)c1,C62704822_decoy,CXCR4,Decoy,0,-8.69569,-6.27,-4.24,-3.896156417826984
[NH3+]CCOc1cccc(NC(=O)c2cc(Br)ccc2F)c1,C62839231_decoy,CXCR4,Decoy,0,-7.72079,-7.08,-1.93,-7.109907268348961
CC(C)(C[NH3+])NS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1,C63020729_decoy,CXCR4,Decoy,0,-7.09265,-7.3,-1.61,-8.286829400116565
CC1CCC(CNS(=O)(=O)c2ccc(CC[NH3+])s2)CC1,C63147546_decoy,CXCR4,Decoy,0,-8.12429,-6.62,-3.12,-7.817480113553447
C[NH+](CC/C(N)=N/O)Cc1ccc(F)cc1Br,C19834037_decoy,CXCR4,Decoy,0,-7.44332,-5.68,-1.31,-7.679344914203304
Cc1ccc(C)c(NS(=O)(=O)c2cccc([C@@H](C)[NH3+])c2)c1,C20006528_decoy,CXCR4,Decoy,0,-8.12708,-8.41,-1.71,-7.666478123957988
Cc1ccc(NS(=O)(=O)c2ccc([C@H](C)[NH3+])cc2)c(C)c1,C20024632_decoy,CXCR4,Decoy,0,-7.36422,-8.57,-4.03,-3.667304573638656
Cc1ccc(S(=O)(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1C,C20432253_decoy,CXCR4,Decoy,0,-7.58463,-8.38,-2.65,-7.295696520400089
CC[NH+](CC)[C@@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1N,C21508615_decoy,CXCR4,Decoy,0,-6.30722,-7.21,-1.9,-7.214375330272798
COc1cc([C@@](C)(O)C[NH3+])ccc1OCc1ccc(F)cc1,C32201014_decoy,CXCR4,Decoy,0,-7.1684,-8.17,-3.19,-3.600742284743524
COc1cc([C@H](O)C[NH3+])ccc1OCc1ccc(Cl)cc1,C32208865_decoy,CXCR4,Decoy,0,-8.46653,-6.84,-1.39,-8.534434176474312
CC[NH2+]Cc1cc(Br)ccc1O[C@@H](C)C(N)=O,C34659448_decoy,CXCR4,Decoy,0,-7.78159,-6.42,-1.17,-8.60069262484834
CC[NH2+]Cc1cc(Br)ccc1O[C@H](C)C(N)=O,C34659450_decoy,CXCR4,Decoy,0,-7.04977,-6.21,-1.97,-3.2477918540557726
Cc1cccc(C[NH2+][C@H](C)c2cccc(S(N)(=O)=O)c2)c1,C35046486_decoy,CXCR4,Decoy,0,-8.65898,-8.62,-1.66,-8.210157606334654
CC[C@@H](C)[C@H]([NH3+])C(=O)N[C@@H]1CCC[C@H](OCC(F)(F)F)C1,C37005499_decoy,CXCR4,Decoy,0,-7.44751,-7.14,-2.2,-8.220283368858173
CC[C@H](C)[C@H]([NH3+])C(=O)N[C@@H]1CCC[C@H](OCC(F)(F)F)C1,C37005500_decoy,CXCR4,Decoy,0,-7.24074,-7.71,-1.95,-8.463270990768102
CC[C@@H](C)[C@@H]([NH3+])C(=O)N[C@@H]1CCC[C@H](OCC(F)(F)F)C1,C37005501_decoy,CXCR4,Decoy,0,-7.18452,-7.52,-1.71,-8.97366781541622
C[C@H]([NH2+][C@H](C)c1cccs1)c1cccc(S(N)(=O)=O)c1,C37235038_decoy,CXCR4,Decoy,0,-9.06338,-8.18,-1.8,-10.201906742043864
NC(=O)C1CCC([NH2+]C2CCN(CC(F)(F)F)CC2)CC1,C37319460_decoy,CXCR4,Decoy,0,-7.27226,-6.73,-0.97,-7.100050175967261
C[C@@H]([NH3+])c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1,C37697472_decoy,CXCR4,Decoy,0,-7.57356,-8.05,-2.4,-6.951634345925662
CC[C@H]([NH3+])C(=O)Nc1c(C)cc(Br)cc1OC,C37767009_decoy,CXCR4,Decoy,0,-7.66017,-6.99,-2.6,-3.5824334296100258
CC[C@@H](CO)[NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl,C37851499_decoy,CXCR4,Decoy,0,-7.92913,-6.8,-1.8,-3.797401027414767
C[C@H](O)C[NH2+]C[C@H](O)COc1cccc(Br)c1,C37853058_decoy,CXCR4,Decoy,0,-7.19393,-6.3,-2.27,-7.468742300775951
C[C@H](O)C[NH2+]C[C@@H](O)COc1cccc(Br)c1,C37853060_decoy,CXCR4,Decoy,0,-8.04321,-5.95,-1.87,-7.687060623186909
CC(C)C[C@@H]([NH3+])CNS(=O)(=O)c1c(F)cc(F)cc1F,C37909113_decoy,CXCR4,Decoy,0,-7.85128,-7.19,-0.71,-10.535482547184248
CC(C)[NH+](C)[C@H](C)C(=O)Nc1ccc(N)c(C(F)(F)F)c1,C20545576_decoy,CXCR4,Decoy,0,-6.3424,-7.69,-1.71,-7.403932948232873
CC[C@H](C)[C@H]([NH3+])C(=O)Nc1sc2c(c1C#N)CCCCC2,C40853319_decoy,CXCR4,Decoy,0,-9.23818,-7.69,-1.02,-8.924208021011973
COc1ccc(SCCOc2ccc(C(N)=[NH2+])cc2)cc1,C41068845_decoy,CXCR4,Decoy,0,-9.12544,-6.97,-0.73,-7.476124706834712
COc1ccc2[nH]cc([C@H](C[NH3+])c3ccc(N(C)C)cc3)c2c1,C41544104_decoy,CXCR4,Decoy,0,-9.05886,-7.78,-0.93,-9.279871288981669
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)N1CCN(CCO)CC1,C42953500_decoy,CXCR4,Decoy,0,-8.99687,-5.8,-1.13,-5.484657329499647
[NH3+]C[C@@H](Sc1ncn[nH]1)c1ccc(Br)s1,C43283323_decoy,CXCR4,Decoy,0,-7.58915,-6.34,-0.69,-7.261179073374751
CCN(CC(=O)NC)[C@@H](C[NH3+])c1cc(Br)cs1,C43285705_decoy,CXCR4,Decoy,0,-7.75736,-5.77,-1.16,-7.490606970006308
CCOC(=O)[C@H]([NH3+])Cc1c[nH]c2c(F)c(F)c(F)c(F)c12,C44341506_decoy,CXCR4,Decoy,0,-8.48952,-7.9,-0.96,-8.12892648825156
C[C@@H]([NH2+]CCCS(N)(=O)=O)c1cccc(C(F)(F)F)c1,C45066707_decoy,CXCR4,Decoy,0,-7.62357,-8.42,-1.33,-10.17152482829046
CC[NH2+][C@](CSCc1ccco1)(C(N)=O)c1ccccc1,C45548529_decoy,CXCR4,Decoy,0,-7.19296,-6.17,-2.2,-6.921524514410037
CC[NH+](Cc1cccs1)[C@@H](C)C(=O)Nc1cccc(N)c1,C48970007_decoy,CXCR4,Decoy,0,-7.65942,-7.4,-2.67,-7.997160737413753
CCNC(=O)[C@H](C)[NH2+]C[C@H](O)c1cc(Cl)ccc1Cl,C49201527_decoy,CXCR4,Decoy,0,-7.93512,-7.41,-1.68,-8.489007573434215
CCNC(=O)[C@H](C)[NH2+]C[C@@H](O)c1cc(Cl)ccc1Cl,C49201534_decoy,CXCR4,Decoy,0,-7.80831,-6.86,-3.16,-8.469259076189037
C[C@H](NS(=O)(=O)CCC[NH3+])c1ccc(Br)cc1,C49526338_decoy,CXCR4,Decoy,0,-8.19448,-6.31,-2.32,-7.485042999310495
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(C[NH3+])s2)cc1,C49560688_decoy,CXCR4,Decoy,0,-7.6675,-7.64,-2.92,-3.6518068156870176
C[C@@H](CCc1ccco1)NC(=O)c1ccc(C#CC[NH3+])s1,C49572139_decoy,CXCR4,Decoy,0,-8.92325,-6.36,-2.45,-3.687711682567541
Cc1ccc(C[NH2+][C@H](C)c2cccc(S(N)(=O)=O)c2)s1,C50225277_decoy,CXCR4,Decoy,0,-9.43045,-8.23,-3.0,-12.620268962770645
COCC[C@@H]([NH3+])C(=O)Nc1c(F)cc(F)cc1Br,C52791284_decoy,CXCR4,Decoy,0,-7.56787,-6.82,-1.05,-9.468559137673306
COCC[C@@H]([NH3+])C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1,C52809678_decoy,CXCR4,Decoy,0,-8.07318,-7.38,-1.16,-8.176449168630487
COCCN[C@@H](C[NH3+])c1cc(Br)ccc1OC,C53255932_decoy,CXCR4,Decoy,0,-7.98713,-6.44,-3.46,-3.69948101960064
COc1cc(Br)cc(C)c1NC(=O)[C@@H](C)C[NH3+],C54340256_decoy,CXCR4,Decoy,0,-7.45905,-6.72,-2.23,-3.387530291555942
COc1cccc(NC(=O)C[C@@H](C[NH3+])c2ccccc2F)c1,C57630575_decoy,CXCR4,Decoy,0,-7.51997,-7.51,-1.28,-8.099761030474777
COc1cccc([C@H](C[NH3+])CC(=O)Nc2ccc(F)cc2)c1,C57630593_decoy,CXCR4,Decoy,0,-7.07957,-7.75,-2.09,-7.7893005205126675
COc1ccc([C@H](C[NH3+])Nc2ccc(Cl)cc2)cc1OC,C57637715_decoy,CXCR4,Decoy,0,-8.37331,-7.49,-1.57,-7.677103914719996
C[C@H](NS(=O)(=O)c1ccc(C[NH3+])s1)c1ccsc1,C61368811_decoy,CXCR4,Decoy,0,-8.94071,-6.81,-0.94,-7.937014726437866
CCOc1ccc([C@@](O)([C@H](C)[NH3+])C(F)(F)F)cc1OCC,C62784465_decoy,CXCR4,Decoy,0,-6.56575,-6.47,-3.2,-3.290185083378924
[NH3+]CCOc1cccc(NC(=O)c2ccc(F)cc2Cl)c1,C62839194_decoy,CXCR4,Decoy,0,-6.84378,-7.8,-2.14,-6.510154877397604
COc1ccc(C(=O)NCC[C@H](C)[NH3+])cc1Br,C63170070_decoy,CXCR4,Decoy,0,-7.57085,-6.79,-0.5,-6.876934563250852
CC(C)n1cc(Br)cc1C(=O)NCC[C@H](C)[NH3+],C63170207_decoy,CXCR4,Decoy,0,-7.09746,-6.24,-0.27,-7.821230498619555
COCC(=O)NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCOCC1,C08622858_decoy,CXCR4,Decoy,0,-7.78755,-6.53,-1.63,-7.902973938715063
C=CC[NH+](C)C[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNS(C)(=O)=O,C08635561_decoy,CXCR4,Decoy,0,-8.62954,-6.21,-1.86,-3.662735912245685
COc1ccc([C@H](C2=[NH+]CCN2)N2CC[NH+](C)CC2)cc1O,C19684031_decoy,CXCR4,Decoy,0,-7.60694,-6.69,-2.68,-3.0610980492711053
Cc1ccc(S(=O)(=O)C[C@@H](CN2CC[NH+](C)CC2)N2CC[NH+](C)CC2)cc1,C19991341_decoy,CXCR4,Decoy,0,-8.67562,-8.23,-2.75,-8.333740595404882
CCC[NH+]1CCN([C@@H](C[NH3+])c2ccc(OC)c(OC)c2)CC1,C20179739_decoy,CXCR4,Decoy,0,-8.07687,-7.37,-2.68,-7.883994331813609
CC[NH+](CC)CCC[NH2+]CC(=O)N1CCc2sccc2C1,C35099763_decoy,CXCR4,Decoy,0,-8.43753,-6.99,-0.69,-7.154970230452346
C[NH+]1CCN(C(C)(C)C[NH2+]C2CCS(=O)(=O)CC2)CC1,C35652392_decoy,CXCR4,Decoy,0,-7.84044,-6.26,-1.54,-3.0587695517771865
Cc1cc(N)[n+](/C(Nc2ccc(F)c(Cl)c2)=[NH+]/CCc2ccccc2)s1,C35740172_decoy,CXCR4,Decoy,0,-10.7841,-7.26,-1.86,-9.873114916593009
C[C@H]([NH2+]C1CCN(S(C)(=O)=O)CC1)[C@H]1CCC[NH+](C)C1,C36828184_decoy,CXCR4,Decoy,0,-8.56402,-7.0,-2.18,-3.314055650047435
COC1CC[NH+]([C@H](C[NH3+])c2ccc(Br)o2)CC1,C37265832_decoy,CXCR4,Decoy,0,-6.79456,-5.78,-0.94,-2.8386176678684927
CC[C@@H](CC[NH3+])N1CCC[NH+](CCS(=O)(=O)CC)CC1,C37370371_decoy,CXCR4,Decoy,0,-9.42503,-6.31,-1.72,-9.047369905045514
C[NH+]1CC[C@@H](C[NH2+]C[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1,C37894331_decoy,CXCR4,Decoy,0,-8.09389,-7.34,-2.04,-3.595620247694828
COc1ccc([C@@H](C[NH3+])[NH+]2CCC(OC)CC2)cc1Br,C38052124_decoy,CXCR4,Decoy,0,-8.80225,-6.84,-1.22,-10.452622445034615
O=C(NCC[NH+]1CCCCC1)[C@H]1C=C[C@H]([C@@H]2CCC[NH+]2CC2N=CC=N2)S1,C39515334_decoy,CXCR4,Decoy,0,-11.0681,-6.38,-2.2,-3.942676350619985
CC[C@H](C)CC(=O)N1C[C@H](C(=O)N[C@@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663302_decoy,CXCR4,Decoy,0,-9.32122,-8.49,-1.01,-9.050585257918144
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)N[C@@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663304_decoy,CXCR4,Decoy,0,-9.8335,-8.53,-0.37,-9.881684820251133
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)N[C@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39681964_decoy,CXCR4,Decoy,0,-9.55022,-9.0,-1.3,-10.596719633105886
CC[NH+](CC)CC1CCN(C(=O)[C@@H]([NH3+])CCSC)CC1,C40468766_decoy,CXCR4,Decoy,0,-9.08456,-5.46,-0.93,-7.738078080256473
CO[C@@H]1C[NH2+][C@@H](C(=O)NC[C@@H]2CC[NH+](CC(F)(F)F)C2)C1,C40633798_decoy,CXCR4,Decoy,0,-6.72851,-6.2,-2.89,-6.397749587907256
C[NH+](C)CC1CCN(S(=O)(=O)CC2CC[NH2+]CC2)CC1,C42388888_decoy,CXCR4,Decoy,0,-8.06364,-6.33,-1.81,-7.536390935769995
CCN(C(=O)C[NH+]1CCCC[C@@H]1C[NH3+])[C@H]1CCS(=O)(=O)C1,C44558843_decoy,CXCR4,Decoy,0,-7.56463,-6.94,-0.92,-11.78803749188351
C[NH2+]Cc1ccc(S(=O)(=O)N[C@H]2CC[NH+](C3CC3)C2)cc1,C44680670_decoy,CXCR4,Decoy,0,-8.15256,-6.46,-1.34,-7.591275784025735
CC[C@@H](C)NC(=O)[C@@H](C)[NH+]1CCN(CC[NH+]2CCCC2)CC1,C46063406_decoy,CXCR4,Decoy,0,-7.88303,-5.14,-1.42,-6.097783459049891
O=S(=O)(C[C@@H]1CCC[NH2+]C1)N[C@@H]1CC[NH+]2CCCC[C@@H]12,C49646564_decoy,CXCR4,Decoy,0,-8.68034,-7.03,-4.52,-3.619294728132518
CCC[NH2+]C[C@]1(C[NH+](C)[C@@H]2CCS(=O)(=O)C2)CCOC1,C51248962_decoy,CXCR4,Decoy,0,-7.97737,-6.02,-1.18,-3.3088243081243114
Cc1nc(C[NH+](C)C[C@@]2(C[NH2+]CC(C)C)CCOC2)cs1,C51250997_decoy,CXCR4,Decoy,0,-8.38852,-6.02,-0.68,-7.594060782430007
CC(C)NC(=O)NC(=O)[C@H](C)[NH+]1CCC([NH+]2CCCC2)CC1,C51952335_decoy,CXCR4,Decoy,0,-7.56011,-6.34,-1.57,-6.18623817493971
C=CCNC(=O)NC(=O)[C@@H](C)[NH+]1CCC([NH+]2CCCC2)CC1,C51952849_decoy,CXCR4,Decoy,0,-8.24594,-7.8,-1.58,-7.661859059899279
O=S(=O)(C[C@H]1CCC[NH2+]1)N1CC[NH+](C2CCCC2)CC1,C52064017_decoy,CXCR4,Decoy,0,-7.93142,-6.67,-1.41,-3.1276867243459945
CC[NH+](CC)CCOc1ccc(Br)cc1[C@@H](C)[NH3+],C52066332_decoy,CXCR4,Decoy,0,-8.20451,-6.09,-2.34,-7.992709844853439
Cc1oc(C[NH+]2CCS(=O)(=O)CC2)cc1C[NH2+]C(C)(C)C,C52480270_decoy,CXCR4,Decoy,0,-7.90443,-6.84,-1.1,-6.443746662026364
Cc1nc(C[NH+](C)Cc2csc(C[NH2+]C3CC3)n2)cs1,C52505670_decoy,CXCR4,Decoy,0,-9.55505,-5.92,-1.72,-7.734588821325507
Cc1ccc(C[NH+](CCCn2cc[nH+]c2)Cc2ccncc2)o1,C36740245_decoy,CXCR4,Decoy,0,-7.85904,-6.36,-1.82,-7.460833992138569
CC(C)[NH+](C)CC[NH2+]C[C@@H](O)c1ccc(S(C)(=O)=O)cc1,C54112671_decoy,CXCR4,Decoy,0,-7.4596,-6.47,-2.37,-6.845643003843554
CC[C@@H](C)[NH+]1CCN(C2(C[NH3+])CCS(=O)(=O)CC2)CC1,C55064469_decoy,CXCR4,Decoy,0,-9.22169,-6.85,-1.98,-7.285846623441999
CC[C@@H](C)[NH+]1CCN(CC[NH2+][C@@H]2CCS(=O)(=O)C2)CC1,C55075372_decoy,CXCR4,Decoy,0,-7.87705,-7.0,-1.28,-6.60976009467863
CC[C@H](C)[NH+]1CCN(CC[NH2+][C@@H]2CCS(=O)(=O)C2)CC1,C55075375_decoy,CXCR4,Decoy,0,-8.2972,-7.06,-2.49,-3.5394309824254586
CC[C@H](C)[NH+]1CCN(CC[NH2+][C@H]2CCS(=O)(=O)C2)CC1,C55075380_decoy,CXCR4,Decoy,0,-8.0139,-6.83,-1.29,-7.405523752717303
C[C@@H](C[NH+](C)CCc1ccncc1)c1nc(CC[NH3+])cs1,C58008654_decoy,CXCR4,Decoy,0,-8.72408,-6.48,-3.03,-7.468827615730101
C[NH+](C)CCN1CCN([C@@H](C[NH3+])c2cc(Br)cs2)CC1,C61642434_decoy,CXCR4,Decoy,0,-9.57653,-6.15,-1.68,-6.908920327672272
CC(C)[NH2+]CCS(=O)(=O)N1CCN(CC[NH+](C)C)CC1,C61653289_decoy,CXCR4,Decoy,0,-7.785,-5.44,-1.79,-2.973416613660895
CC[NH2+]Cc1c(N2CCn3cc[nH+]c3C2)nc2sccn12,C62254890_decoy,CXCR4,Decoy,0,-7.95138,-6.73,-1.04,-7.251650086653619
O=S1(=O)CC[C@@H]([NH2+]CCN2CC[C@H]([NH+]3CCCC3)C2)C1,C62974456_decoy,CXCR4,Decoy,0,-7.8727,-7.07,-1.1,-6.928990328909247
C[C@@H]([NH3+])[C@@H]1CCCC[NH+]1Cc1nnc(-c2ccc(Br)o2)o1,C63195378_decoy,CXCR4,Decoy,0,-9.27099,-7.61,-2.6,-6.887926351592065
[NH3+]CC[S@@+]([O-])C1=c2ccccc2=[NH+][C@@H]1c1ccc(F)cc1,C63764090_decoy,CXCR4,Decoy,0,-7.55402,-7.44,-1.56,-8.168700986461294
CCC[NH+](CC(=O)NC)CC(=O)NC1CC[NH+](C2CC2)CC1,C64509156_decoy,CXCR4,Decoy,0,-7.92762,-6.65,-4.01,-3.5747006107632617
CC(C)[C@H](Cn1cc[nH+]c1)NC(=O)C[NH+]1CCCN(C)CC1,C65372441_decoy,CXCR4,Decoy,0,-8.33952,-6.34,-0.87,-7.803688786885482
CCc1c[nH+]c(C)nc1N1CCC(O)(Cn2cc[nH+]c2)CC1,C65490559_decoy,CXCR4,Decoy,0,-7.65259,-7.73,-2.38,-8.101315118251147
C[C@H](C[NH2+]Cc1ccc(S(C)(=O)=O)cc1)Cn1cc[nH+]c1,C67500324_decoy,CXCR4,Decoy,0,-7.23406,-7.09,-1.61,-11.801109203509602
C[C@H](C[NH2+]Cc1cn(C)nc1-c1ccncc1)Cn1cc[nH+]c1,C67500403_decoy,CXCR4,Decoy,0,-8.26645,-7.42,-1.44,-8.380202072472935
COc1ccc(C[C@H](NC(=O)C2=C[C@@H](NC(=O)[C@H]([NH3+])C(C)C)[C@@H](O)[C@H](O)C2)C(N)=O)cc1,C03838834_decoy,CXCR4,Decoy,0,-10.7889,-8.52,-2.05,-9.621714571052594
CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C03978082_decoy,CXCR4,Decoy,0,-8.45312,-7.98,-3.61,-3.985019456556664
CN(C)c1ccc(O)c2c1C[C@@H]1C[C@H]3[C@H]([NH+](C)C)C(=O)C(C(N)=O)=C(O)[C@]3(O)C(=O)C1=C2O,C04574557_decoy,CXCR4,Decoy,0,-10.6293,-6.49,-1.32,-7.02850249123341
C[C@H]([NH3+])C(=O)N1CCOCCOCCN(C(=O)[C@@H](C)[NH3+])CCOCCOCC1,C04661805_decoy,CXCR4,Decoy,0,-6.59999,-6.78,-1.0,-6.687109951631538
OC[C@@H]1O[C@@](CO)(Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H]1O,C04802822_decoy,CXCR4,Decoy,0,-8.75077,-8.91,-4.38,-9.837428571827914
NC(=[NH2+])c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc(C(N)=[NH2+])c3)c(N)c2)c1,C04822118_decoy,CXCR4,Decoy,0,-11.8029,-8.39,-2.46,-10.518341158535224
NC(=[NH2+])NCCC[C@@H](NC(=O)C1CCN(C(=O)[C@@H]2CCC[NH2+]2)CC1)C(=O)[O-],C05376846_decoy,CXCR4,Decoy,0,-9.78702,-7.43,-1.55,-4.381857771533875
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3SCC[NH3+],C05492863_decoy,CXCR4,Decoy,0,-10.8746,-9.14,-2.35,-4.6129357558798
COC(=O)[C@H](Cc1c[nH]c2ccc(F)cc12)NC(=O)[C@H]([NH3+])Cc1c[nH]c2ccccc12,C01605772_decoy,CXCR4,Decoy,0,-8.38586,-9.94,-1.76,-7.919913526592148
Cc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC(N)=[NH2+])cc2)cc1,C04798244_decoy,CXCR4,Decoy,0,-9.5348,-8.37,-3.67,-4.684489992374862
C/C=C(/C)C(=O)O[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@]5(O)C[C@H](O)[C@@]6(O)[C@@H](C[NH+]7C[C@@H](C)CC[C@H]7[C@@]6(C)O)[C@]5(O)C[C@@]42O[C@]13O,C08214734_decoy,CXCR4,Decoy,0,-11.9531,-9.91,-4.32,-4.45572005585649
NC(=[NH2+])NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccccc2F)cc1,C07497724_decoy,CXCR4,Decoy,0,-10.3336,-7.93,-2.81,-4.538039631374541
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCCCOc2ccc([N+](=O)[O-])cc2)c1,C08649782_decoy,CXCR4,Decoy,0,-9.11216,-8.8,-2.44,-9.65887427782906
NC(=[NH2+])NS(=O)(=O)c1ccc(NC(=S)NC(=O)/C=C/c2cccs2)cc1,C08763931_decoy,CXCR4,Decoy,0,-12.0509,-8.45,-2.27,-5.55789122761567
N#C/C(=C\Nc1ccc(S(=O)(=O)NC(N)=[NH2+])cc1)c1nc(-c2cccc(Br)c2)cs1,C09010039_decoy,CXCR4,Decoy,0,-11.9088,-9.56,-2.17,-10.55228924742896
OCC(CO)(CO)[NH2+]C[C@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21,C10384387_decoy,CXCR4,Decoy,0,-10.1073,-8.22,-2.94,-3.1202073675705533
CC(C)c1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)NC(N)=[NH2+])cc2)cc1,C10012379_decoy,CXCR4,Decoy,0,-10.8581,-8.87,-3.29,-10.717489969756532
C[NH+](C)[C@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3C[C@@H]12,C11592618_decoy,CXCR4,Decoy,0,-10.2018,-9.2,-2.21,-3.769021683101035
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@@H]12,C11592623_decoy,CXCR4,Decoy,0,-11.607,-10.25,-1.1,-11.770957194530544
C[NH+](C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@@H]3[C@H](O)[C@H]12,C11592625_decoy,CXCR4,Decoy,0,-8.21774,-7.46,-1.52,-5.831618779603443
NC(=[NH2+])NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(Br)cc2)cc1,C09199409_decoy,CXCR4,Decoy,0,-10.4391,-7.66,-2.56,-8.56546668878653
Cc1cc(NC(=O)NC(=O)c2ccccc2NC(=O)[C@H](C)[NH3+])ccc1Oc1ncc(Br)cn1,C17219391_decoy,CXCR4,Decoy,0,-10.857,-7.47,-3.39,-4.449821357710771
OC[C@@H](O)[C@H](O)[C@@H](O)[C@H]1N2C[C@@]3(c4ccccc4)C[NH+]1C[C@@](c1ccccc1)(C2)C3O,C19331503_decoy,CXCR4,Decoy,0,-9.91825,-9.42,-1.63,-9.45272457860128
CCOc1cc(/C=N/Nc2nc(SCC(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)n[nH]2)ccc1O,C20836211_decoy,CXCR4,Decoy,0,-11.0392,-7.29,-4.02,-8.102153406488716
CC(=O)[C@]1([NH3+])Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](O)[C@@H](O)CO2)C1)C(=O)c1ccccc1C3=O,C21982917_decoy,CXCR4,Decoy,0,-8.75757,-9.11,-2.08,-7.700161262304966
C[C@@]1(O)c2c(Cl)ccc(O)c2C(=O)[C@H]2[C@H](O)[C@]3(O)C(=O)[C@@H](C(N)=O)[C@H](O)[C@@H]([NH3+])[C@@H]3C[C@@H]21,C21983286_decoy,CXCR4,Decoy,0,-10.841,-10.08,-4.49,-3.758524067257078
CCC[C@H]1C[C@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C24987189_decoy,CXCR4,Decoy,0,-8.88599,-7.27,-2.14,-7.672607613840668
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)Cl)C1,C33807858_decoy,CXCR4,Decoy,0,-8.55745,-5.96,-0.67,-6.690068111498452
C[C@@]1(O)c2c(Cl)ccc(O)c2C(=O)[C@H]2[C@@H](O)[C@]3(O)C(=O)[C@@H](C(N)=O)[C@H](O)[C@@H]([NH3+])[C@@H]3C[C@@H]21,C35565038_decoy,CXCR4,Decoy,0,-11.5657,-10.05,-1.57,-8.11451794114006
Cc1ccc2[nH+]c3sc(C(=O)Nc4c(C)[nH]c(=O)[nH]c4=O)c(N)c3cc2c1,C04848754_decoy,CXCR4,Decoy,0,-9.51348,-9.75,-1.69,-8.011978860729975
CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C03830997_decoy,CXCR4,Decoy,0,-9.78984,-6.71,-2.88,-4.003829859178952
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O)[NH+](C)C1,C38609328_decoy,CXCR4,Decoy,0,-7.39738,-7.27,-3.73,-3.5219098616920985
NC(=O)c1c(NC(=O)C[NH2+]CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)sc2c1CCCC2,C39220969_decoy,CXCR4,Decoy,0,-9.79801,-9.36,-1.45,-11.89439687884299
O=C1[NH+]=c2ccccc2=[NH+][C@H]1/C(=N\Nc1ccc([N+](=O)[O-])cc1)[C@H](O)[C@H](O)CO,C40151159_decoy,CXCR4,Decoy,0,-8.27986,-8.05,-0.64,-7.469367283845323
O=C(N/N=C(\[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)[C@H](O)[C@H](O)CO)c1ccc(Cl)cc1,C40151213_decoy,CXCR4,Decoy,0,-9.20328,-8.74,-1.03,-8.609536528261204
COc1ccc(C(=O)N/N=C(\[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)[C@H](O)[C@H](O)CO)cc1,C40151250_decoy,CXCR4,Decoy,0,-8.2866,-9.01,-2.69,-4.451959090866891
O=C(N/N=C(/[C@@H](O)[C@H](O)CO)[C@H]1[NH+]=c2cc(Cl)ccc2=[NH+]C1=O)c1ccc(O)cc1,C40151308_decoy,CXCR4,Decoy,0,-10.4207,-8.13,-0.43,-8.697374479834624
NC(=O)C[C@@H]([NH3+])c1c(Sc2n[nH]nc2-c2ccccc2)nc2ccccn2c1=O,C44255311_decoy,CXCR4,Decoy,0,-9.1064,-10.29,-1.07,-9.84880162778244
COc1cc(C[C@@H]([NH3+])CO)cc(-c2cc(C[C@@H]([NH3+])CO)cc(OC)c2O)c1O,C44467019_decoy,CXCR4,Decoy,0,-10.7091,-7.64,-2.97,-4.504335802423507
CCC[C@@H]1C[C@H](C(=O)N[C@@H]([C@@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](C)O)[NH+](C)C1,C44830559_decoy,CXCR4,Decoy,0,-6.81021,-8.05,-2.7,-3.647207411037536
CC[C@@H]1CC[NH2+][C@H](C(=O)N[C@H]([C@H]2O[C@H](SC)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)Cl)C1,C44964071_decoy,CXCR4,Decoy,0,-8.25658,-8.25,-2.62,-9.83689016388424
C/C(=N\NC(N)=[NH2+])c1ccc(NC(=O)Nc2ccc(/C(C)=N/NC(N)=[NH2+])cc2)cc1,C13981739_decoy,CXCR4,Decoy,0,-12.5587,-6.68,-2.34,-4.622474231794367
O=[N+]([O-])c1ccc2c(c1)=[NH+][C@H]([C@@H](O)[C@@H](O)[C@H]1[NH+]=c3ccc([N+](=O)[O-])cc3=[NH+]1)[NH+]=2,C63205474_decoy,CXCR4,Decoy,0,-8.09898,-8.57,-2.71,-3.6160463007128
CC(C)(C)OC(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)OC[C@H]1O[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O,C63361904_decoy,CXCR4,Decoy,0,-9.00772,-9.76,-3.27,-4.695876869239529
O=C(CS[C@@H]1N[C@H](c2ccco2)Nc2cc(=O)[nH]n21)NCC1[NH+]=c2ccccc2=[NH+]1,C63648741_decoy,CXCR4,Decoy,0,-8.58956,-8.91,-1.57,-9.958481007722291
O=C(CS[C@@H]1N[C@@H](c2ccco2)Nc2cc(=O)[nH]n21)NCCC1[NH+]=c2ccccc2=[NH+]1,C63648747_decoy,CXCR4,Decoy,0,-8.44914,-9.46,-1.88,-8.436462049185565
CC(C)(C)OC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)OC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1O,C63712365_decoy,CXCR4,Decoy,0,-7.54582,-8.28,-1.92,-8.012263979953367
NC(=O)c1ccccc1OCC1=[NH+][C@@H](C(=O)NCCC2=c3ccccc3=[NH+]C2)ON1,C63818809_decoy,CXCR4,Decoy,0,-7.93826,-9.74,-1.39,-8.202693567022761
COc1ccc([C@H]2NN/C(=[NH+]\CCC3=c4cc(Cl)ccc4=[NH+]C3)N(N)C2=O)cc1,C63952595_decoy,CXCR4,Decoy,0,-9.05509,-6.78,-2.9,-5.5826013019018825
Cc1ccccc1-[n+]1c(SCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)nc2[nH]nc(C)c2c1N,C33726458_decoy,CXCR4,Decoy,0,-11.8153,-9.32,-4.53,-11.9329588045135
CC[C@H](C)[C@@H]([NH3+])C(=O)N1CCN(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1,C00734234_decoy,CXCR4,Decoy,0,-8.23611,-7.66,-2.52,-7.177927448649081
Cc1ccc(NC2=[NH+][C@@H](C(=O)Nc3ccc(F)c(Cl)c3)CC(=O)N2)cc1,C01427712_decoy,CXCR4,Decoy,0,-9.19919,-7.3,-1.14,-6.099893046122418
NC(=O)Nc1ccc(N2CCN(c3[nH+]cc(C(F)(F)F)cc3Cl)CC2)cc1,C01403425_decoy,CXCR4,Decoy,0,-7.17446,-6.8,-1.78,-6.107768225672527
COc1ccc([C@H](C[NH2+]C[C@@H](O)c2ccccc2)c2c[nH]c3ccccc23)cc1,C06786515_decoy,CXCR4,Decoy,0,-8.38003,-6.94,-2.83,-6.4091875999831895
C[C@@H]([NH2+]CC(=O)Nc1ccccc1C(=O)Nc1ccccc1)c1cccc(F)c1,C09449417_decoy,CXCR4,Decoy,0,-7.53107,-9.66,-3.55,-9.0150007259739
CC(C)[NH2+][C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@]12CCC(=O)NCc1ccco1,C12531709_decoy,CXCR4,Decoy,0,-9.22276,-7.17,-1.36,-7.6450352498378065
C[C@@H](C(=O)NC(N)=O)[NH+](C)Cc1ccc(OCc2ccc(Cl)cc2)cc1,C12905607_decoy,CXCR4,Decoy,0,-8.52366,-7.86,-2.15,-7.651402627640532
Cc1c(F)c(Oc2cccc(F)c2)nc(Oc2cccc(C(N)=[NH2+])c2)c1F,C13474025_decoy,CXCR4,Decoy,0,-9.97499,-8.98,-1.97,-10.317005830410254
C[C@H](C(=O)Nc1ccc(F)cc1)[NH+]1CCC(C(=O)Nc2ccccc2O)CC1,C15043519_decoy,CXCR4,Decoy,0,-7.62557,-9.9,-1.29,-9.747798708496877
CCC(=O)Nc1cc([C@H](O)C[NH+]2CCc3[nH]c4c(C)cccc4c3C2)ccc1OC,C19499308_decoy,CXCR4,Decoy,0,-9.90991,-9.84,-1.06,-12.283157409924272
COc1cccc(C[NH2+][C@@H](C)C23CC4CC(CC(C4)C2)C3)c1OCC(N)=O,C20872498_decoy,CXCR4,Decoy,0,-9.49255,-8.61,-2.67,-4.312160685734459
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2)cc1,C30498775_decoy,CXCR4,Decoy,0,-8.61314,-8.0,-1.39,-10.036728989865065
CCC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2c(C)cccc2C)cc1,C30500017_decoy,CXCR4,Decoy,0,-8.49178,-8.89,-1.62,-12.520760137813587
CC(C)(C)NC(=O)COc1ccc(C[NH2+]C23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)cc1,C18046429_decoy,CXCR4,Decoy,0,-9.52985,-7.94,-1.7,-7.807448149942606
COc1cccc([C@H]2[NH2+][C@@H](c3cccc(OC)c3O)[C@H](C)C(=O)[C@H]2C)c1O,C36047546_decoy,CXCR4,Decoy,0,-8.32362,-8.02,-1.35,-7.790823078450192
Cc1cc(C)cc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)c1,C36629217_decoy,CXCR4,Decoy,0,-10.6081,-8.64,-2.39,-12.29239603058378
CC[C@@H](C)[C@H]([NH3+])C(=O)Nc1c(Br)cc(Br)cc1C(=O)OC,C37769899_decoy,CXCR4,Decoy,0,-8.48607,-6.64,-3.82,-4.080262419669548
CC1(C)C[C@@H](N=C=O)C[C@](C)(CNC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)C1,C38656632_decoy,CXCR4,Decoy,0,-9.40009,-8.88,-2.03,-11.342320671274914
Cc1cccc(CS[C@H]2N=N[C@@H]([C@@H]([NH3+])Cc3c[nH]c4ccccc34)O2)c1,C38661779_decoy,CXCR4,Decoy,0,-8.25784,-6.56,-2.16,-6.263957011505048
CC[NH+]1[C@@H](SCc2nc3ccccc3c(=O)[nH]2)NN[C@@H]1c1ccccc1F,C39356191_decoy,CXCR4,Decoy,0,-8.19274,-9.96,-0.89,-7.8331393689723265
C[C@@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1)C(=O)NC(=O)NC(C)(C)C,C40002633_decoy,CXCR4,Decoy,0,-7.34025,-8.77,-2.36,-8.217904144677732
Cc1ccc(NC(=O)C[NH+](C)Cc2csc(Br)c2)c(N)c1,C42360420_decoy,CXCR4,Decoy,0,-8.52542,-7.53,-1.66,-4.714496585174683
CC(C)[C@H]([NH2+]CCOc1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)cc1,C42574216_decoy,CXCR4,Decoy,0,-9.58565,-8.19,-1.87,-10.051000887941957
Cn1nc(C(F)(F)F)c(C[C@H]([NH3+])CO)c1Sc1ccc(Br)cc1,C44465461_decoy,CXCR4,Decoy,0,-7.62188,-6.78,-2.12,-8.259586703658751
C[C@H]([NH2+]CCCS(N)(=O)=O)c1ccc(Br)cc1Br,C45069299_decoy,CXCR4,Decoy,0,-9.55395,-6.84,-1.45,-11.21294588144312
CC[NH+](CC)[C@@H](C)CNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2,C46280615_decoy,CXCR4,Decoy,0,-8.88632,-6.32,-3.93,-8.105467255847403
CC[NH+](CC)Cc1cccc(NC(=O)c2cc(S(N)(=O)=O)ccc2Cl)c1,C47490170_decoy,CXCR4,Decoy,0,-9.39817,-8.94,-2.34,-10.49264278211874
CCC(=O)Nc1ccc(NC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)cc1,C48082526_decoy,CXCR4,Decoy,0,-9.43776,-8.47,-1.47,-4.706769993542292
CCc1ccc([C@H](CNC(=O)Nc2cc(NC(C)=O)ccc2C)[NH+](C)C)cc1,C48271537_decoy,CXCR4,Decoy,0,-8.99594,-7.48,-1.3,-4.139060841927876
CC(C)[NH+](CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1cccc(Cl)c1,C52906917_decoy,CXCR4,Decoy,0,-10.2056,-7.39,-3.0,-11.735285691884275
COc1cc(OC)c(NC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1Cl,C53954839_decoy,CXCR4,Decoy,0,-8.58057,-8.49,-3.69,-8.097088755414893
CC[NH+](CC(=O)Nc1sccc1C(N)=O)Cc1ccc(Cl)c(Cl)c1,C54347783_decoy,CXCR4,Decoy,0,-9.64044,-7.74,-3.82,-8.377855412723752
CNC(=O)c1ccc(NC(=O)N[C@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)cc1Cl,C56725063_decoy,CXCR4,Decoy,0,-9.12792,-8.84,-3.47,-4.390693356691522
O=C(NCCCCn1cc[nH+]c1)NNc1c(Cl)cc(Cl)cc1Cl,C57379529_decoy,CXCR4,Decoy,0,-9.07744,-6.02,-2.53,-7.361439227003263
CCC(=O)Nc1cccc(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)c1,C58892354_decoy,CXCR4,Decoy,0,-9.30058,-8.02,-2.71,-8.804650982662938
CC(C)C[C@@H]([NH3+])C(=O)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21,C06952418_decoy,CXCR4,Decoy,0,-9.38445,-9.17,-2.57,-4.548251556287552
CC(C)C[C@H]([NH3+])C(=O)N/N=C1/C(=O)N(C/C=C/c2ccccc2)c2ccccc21,C59160895_decoy,CXCR4,Decoy,0,-7.52483,-8.67,-1.34,-10.10282700619336
C[C@H](C(=O)Nc1sccc1C(N)=O)[NH+](C)Cc1ccccc1-c1ccccc1,C60356579_decoy,CXCR4,Decoy,0,-9.56018,-9.37,-1.12,-9.402293147931776
O=C(NC1CC1)c1ccc(N2CC[C@H]([NH2+]Cc3cc(Br)ccc3O)C2)nc1,C49421002_decoy,CXCR4,Decoy,0,-9.39359,-8.75,-3.13,-4.520109374280018
NC(=O)CN1CCC[C@H]([NH2+]Cc2ccc(-c3cccc(Cl)c3Cl)o2)C1,C62257783_decoy,CXCR4,Decoy,0,-9.61106,-7.93,-1.63,-7.297822389902838
C[C@@H]([NH3+])[C@H]1CCCCN1CC(=O)Nc1ccc(Br)cc1Br,C63195510_decoy,CXCR4,Decoy,0,-9.08797,-7.02,-2.01,-8.001614232697586
C[C@H](CCc1ccccc1)NC(=O)[C@@H]1N[C@H](CC2=c3ccccc3=[NH+]C2)NO1,C63295356_decoy,CXCR4,Decoy,0,-8.1321,-8.95,-1.46,-7.161043438396095
CSC(=[NH2+])N/N=C/c1cc(Br)cc(Br)c1O,C08664876_decoy,CXCR4,Decoy,0,-9.08586,-6.54,-0.97,-9.067084902638587
CC(=O)N[C@@H]1Nc2ccc(CC(=O)NCCC3=c4cc(Cl)ccc4=[NH+]C3)cc2S1,C64491146_decoy,CXCR4,Decoy,0,-9.19297,-9.31,-2.45,-9.044351989978084
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)[NH+](C)C)cc1,C65470347_decoy,CXCR4,Decoy,0,-8.93559,-8.32,-2.28,-7.876993142372527
Cc1cc(NC(=O)N[C@H]2CC[NH+](C3CCCC3)C2)ccc1C(=O)NC(C)C,C66682370_decoy,CXCR4,Decoy,0,-9.69519,-7.31,-2.94,-4.062870198360848
CC(=O)Nc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)C[C@H](C)C2)c(F)cc1F,C66981891_decoy,CXCR4,Decoy,0,-9.05363,-8.71,-1.6,-4.391570604357729
CCc1ccc([C@@H](CNC(=O)NNC(=O)c2sccc2C)[NH+](C)C)cc1,C67382827_decoy,CXCR4,Decoy,0,-9.55472,-8.29,-3.31,-8.889282271898718
C=C(C)COc1cccc(NC(=O)C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)c1,C67489256_decoy,CXCR4,Decoy,0,-9.65163,-10.04,-2.77,-9.742041800666485
CC(=O)Nc1ccc(NC(=O)NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c(Cl)c1,C67576606_decoy,CXCR4,Decoy,0,-8.42094,-8.48,-2.42,-7.690441306045171
CCOC(=O)c1c[nH+]c2c(C)cc(Cl)cc2c1NCCC[NH+]1CCOCC1,C01772995_decoy,CXCR4,Decoy,0,-9.91466,-8.38,-0.96,-10.720401244813123
O[C@H](CSc1ccccc1)C[NH+]1CCN(c2ccc(C(F)(F)F)c[nH+]2)CC1,C04324435_decoy,CXCR4,Decoy,0,-8.54305,-8.08,-2.72,-7.52601339525915
C[NH+](C)CCn1cnc2c(c1=[NH2+])[C@H](c1ccccc1Cl)c1ccc(O)cc1O2,C06661004_decoy,CXCR4,Decoy,0,-9.65171,-6.05,-1.83,-6.532571762862448
[NH2+]=c1n(CC[NH+]2CCCCC2)c2ccccc2n1C[C@H](O)c1ccc(Cl)c(Cl)c1,C08670952_decoy,CXCR4,Decoy,0,-9.61459,-8.83,-3.02,-8.7070540334816
O[C@@H](COc1ccc(Cl)cc1C[NH2+]C1CCOCC1)C[NH+]1CCCCCC1,C11818354_decoy,CXCR4,Decoy,0,-9.76493,-7.87,-2.72,-4.194508054595006
O[C@H](COc1ccc(Cl)cc1C[NH2+]C1CCOCC1)C[NH+]1CCCCCC1,C11818355_decoy,CXCR4,Decoy,0,-9.42371,-8.17,-1.2,-8.981155583625396
COc1ccc(C[NH+]2CCN(Cc3[nH+]ccn3-c3cccc(C)c3)C[C@@H]2CCO)c(F)c1,C19221080_decoy,CXCR4,Decoy,0,-9.36646,-10.05,-3.19,-10.436864759862036
C[NH+]1CCC[NH+](CC(=O)N2C[C@H](c3ccc(Cl)cc3)[C@@H](c3csnn3)C2)CC1,C19589194_decoy,CXCR4,Decoy,0,-9.62277,-7.61,-1.38,-11.525771749574346
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1[nH+]c2ccccc2c(=O)n1-c1cc(C)cc[nH+]1,C22132093_decoy,CXCR4,Decoy,0,-8.69282,-10.39,-1.3,-10.43212882543606
CCOc1ccc(Nc2scc(-c3ccc(Br)cc3)[n+]2N2CC[NH+](C)CC2)cc1,C34898254_decoy,CXCR4,Decoy,0,-9.69933,-8.2,-1.8,-7.428471418939336
C[NH+]1CCN(C(=O)c2coc(C[NH+](Cc3ccc(F)cc3)Cc3ccc(F)cc3F)n2)CC1,C36072435_decoy,CXCR4,Decoy,0,-8.7852,-8.65,-2.15,-9.329914381771266
C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](C[NH2+]CCC4=c5cc(O)ccc5=[NH+]C4)[C@H]3C[C@H]12,C38555846_decoy,CXCR4,Decoy,0,-10.1594,-9.61,-1.61,-8.55476596972967
O=C(NCCCO)[C@H]1CCC[NH+]([C@@H]2C(=O)[NH+]=c3ccc(Cl)cc3=C2c2ccccc2)C1,C38573248_decoy,CXCR4,Decoy,0,-9.24274,-8.15,-1.2,-8.330010440354732
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1c1ccc(OCc2ccccc2)cc1,C38819173_decoy,CXCR4,Decoy,0,-8.29541,-7.56,-3.66,-6.824279025875627
CCOC(=O)[C@@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)CC[NH+]1CCC(C)CC1,C39037734_decoy,CXCR4,Decoy,0,-9.81281,-8.13,-0.97,-9.45323488304839
Cc1ccc2c(c1C)=[NH+]C(=O)[C@H](CCNC(=O)C(=O)C1=c3ccccc3=[NH+][C@H]1C)C=2,C39364096_decoy,CXCR4,Decoy,0,-7.72649,-10.04,-1.53,-8.778050032223168
C[NH+](C)CCNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C39626010_decoy,CXCR4,Decoy,0,-9.62076,-8.23,-1.14,-8.47683018787171
Cc1ccsc1C(=O)N1C[C@H](C(=O)NCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39627730_decoy,CXCR4,Decoy,0,-8.95266,-7.81,-1.58,-8.418912202632562
C[C@@H]1CCCC[NH+]1CCCNC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39628419_decoy,CXCR4,Decoy,0,-10.1379,-8.38,-3.59,-4.528525758537799
Cc1ccc(C(=O)N2C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C3(CC[NH2+]CC3)C2)cc1,C39630535_decoy,CXCR4,Decoy,0,-8.45847,-7.18,-4.03,-3.936447685757048
C[NH+](C)CC(C)(C)CNC(=O)[C@@H]1CN(C(=O)c2cccc(Br)c2)CC12CC[NH2+]CC2,C39630636_decoy,CXCR4,Decoy,0,-9.4452,-7.53,-1.3,-8.642976840937305
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39630678_decoy,CXCR4,Decoy,0,-8.90096,-7.49,-0.58,-8.316432002141488
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)c2c(F)ccc(Cl)c2F)CC12CC[NH2+]CC2,C39631107_decoy,CXCR4,Decoy,0,-8.87266,-9.28,-1.18,-7.948443964870028
O=C(N[C@@H]1C[NH+]2CCC1CC2)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39662959_decoy,CXCR4,Decoy,0,-7.70213,-7.43,-1.75,-7.325244668267049
C[NH+](C)C[C@H](NC(=O)[C@@H]1CN(C(=O)c2ccccc2F)CC12CC[NH2+]CC2)c1ccccc1,C39664531_decoy,CXCR4,Decoy,0,-8.75065,-8.89,-0.75,-9.137697103193272
C[NH+](C)C[C@H](NC(=O)[C@H]1CN(C(=O)c2c(F)cccc2F)CC12CC[NH2+]CC2)c1ccccc1,C39664577_decoy,CXCR4,Decoy,0,-8.98444,-8.84,-0.64,-8.467743776191845
C[NH+](C)C[C@@H](NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2)c1ccccc1,C39664638_decoy,CXCR4,Decoy,0,-9.45549,-7.9,-3.33,-8.937188932170008
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C[NH+](C)C)c3ccccc3)C3(CC[NH2+]CC3)C2)ccc1F,C39664736_decoy,CXCR4,Decoy,0,-9.21961,-10.27,-1.73,-9.261006640913806
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C[NH+](C)C)c3ccccc3)C3(CC[NH2+]CC3)C2)c(C)c1,C39664861_decoy,CXCR4,Decoy,0,-9.70436,-8.51,-2.58,-8.771082779924233
Cc1ccsc1C(=O)N1C[C@H](C(=O)N[C@@H](C[NH+](C)C)c2ccccc2)C2(CC[NH2+]CC2)C1,C39664914_decoy,CXCR4,Decoy,0,-10.0075,-8.25,-1.0,-9.57130027866032
Cc1ccccc1C(=O)N1C[C@@H](C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39675551_decoy,CXCR4,Decoy,0,-9.25615,-8.79,-1.67,-9.881330154632982
Cc1ccc(Cl)c(C(=O)N2C[C@H](C(=O)NC[C@@H]3CC[NH+](C)C3)C3(CC[NH2+]CC3)C2)c1F,C39689690_decoy,CXCR4,Decoy,0,-10.6625,-8.19,-0.99,-9.872137454333265
C[NH+]1CC[C@H](CNC(=O)[C@@H]2CN(C(=O)[C@H]3CC=CCC3)CC23CC[NH2+]CC3)C1,C39689798_decoy,CXCR4,Decoy,0,-8.6095,-7.95,-3.09,-3.640810856722523
C[NH+]1CC[C@H](CNC(=O)[C@@H]2CN(C(=O)c3c(F)ccc(Cl)c3F)CC23CC[NH2+]CC3)C1,C39689937_decoy,CXCR4,Decoy,0,-10.473,-8.68,-2.35,-4.552099715919413
S=c1n(-c2ccccc2)sc(N/C(=[NH+]/c2ccccc2)c2ccccc2)[n+]1-c1ccccc1,C02686495_decoy,CXCR4,Decoy,0,-9.63149,-8.49,-2.6,-7.176991729574143
CCOC1CC[NH+]([C@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C50362004_decoy,CXCR4,Decoy,0,-9.23243,-6.19,-0.94,-11.5506838058206
CC[NH+](CC)CCN1C(=O)[C@H](Cc2ccccc2)[NH2+]C12CCN(C(=O)c1ccccc1F)CC2,C36026533_decoy,CXCR4,Decoy,0,-9.56461,-7.58,-2.84,-4.269542379049934
Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)NC[C@@H](C)[NH+]1CCCC[C@H]1C,C58533433_decoy,CXCR4,Decoy,0,-8.30072,-7.41,-4.16,-6.149664172625901
Cc1cccc(OC[C@@H]2N[C@@H](C)[C@H](C(=O)NCC3[NH+]=c4ccccc4=[NH+]3)S2)c1,C63363131_decoy,CXCR4,Decoy,0,-8.58853,-9.22,-2.19,-4.159983281159133
O[C@@H](COc1ccc2c(c1)OCO2)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1,C63500422_decoy,CXCR4,Decoy,0,-9.21139,-8.25,-1.73,-4.450549978240431
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)NC1=CC=CN2C[C@H](c3ccccc3)N[C@@H]12,C63625836_decoy,CXCR4,Decoy,0,-8.65837,-8.4,-1.83,-8.0960561683774
CCS(=O)(=O)c1ccc(C(=O)Nc2ccccc2C2[NH+]=c3ccccc3=[NH+]2)cc1,C63706811_decoy,CXCR4,Decoy,0,-8.54483,-7.44,-1.92,-8.050636627578369
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2cccc(Cl)c2)O1,C63761335_decoy,CXCR4,Decoy,0,-9.29258,-9.42,-2.07,-7.744008357346312
CCOC(=O)[C@@H]1C=C(CC)S[C@@H]1NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1,C63772598_decoy,CXCR4,Decoy,0,-9.11445,-7.36,-1.83,-7.66146422586712
O=C(NCC1[NH+]=c2ccccc2=[NH+]1)[C@@H]1Cc2occc2N1Cc1ccc(F)cc1,C63795359_decoy,CXCR4,Decoy,0,-7.80461,-9.86,-1.76,-8.457663638932315
CCn1cc(C[NH+]2CCC(C(=O)Nc3ccc([C@@H]4C=c5ccccc5=[NH+]4)cc3)CC2)cn1,C64015509_decoy,CXCR4,Decoy,0,-8.46089,-9.79,-2.57,-8.388054349587764
CN(C(=O)CC[C@@H]1CCCN(C(=O)CCC2=c3ccccc3=[NH+]C2)C1)C1CC[NH+](C)CC1,C64058488_decoy,CXCR4,Decoy,0,-8.87081,-7.62,-1.45,-6.891703745477998
COc1ccc(NC(=O)C[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)cc1OC,C64178595_decoy,CXCR4,Decoy,0,-9.38906,-8.49,-2.15,-4.232904503390344
C[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1)c1ccc(N2CC[NH+](C)CC2)c(F)c1,C66390694_decoy,CXCR4,Decoy,0,-7.59194,-9.29,-2.54,-7.427832484311159
CCCCc1[nH]cc(CN2CC[NH+](C)C3(CCN(C(=O)C(C)(C)C)CC3)C2)[nH+]1,C67489833_decoy,CXCR4,Decoy,0,-8.15332,-7.57,-3.86,-6.866894950707801
Cc1ccccc1OC[C@@H](O)Cn1c(=[NH2+])n(CC[NH+]2CCCCC2)c2ccccc21,C01273571_decoy,CXCR4,Decoy,0,-8.32178,-8.76,-1.53,-8.045228515385853
O=S(=O)(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCSCC1)c1ccccc1,C08635620_decoy,CXCR4,Decoy,0,-9.40495,-6.96,-4.38,-7.992281861264757
CC(=O)Nc1cc(C[NH2+]C2C3CC4CC(C3)CC2C4)cc(C(=O)N2CC[NH+](C)CC2)c1,C12331599_decoy,CXCR4,Decoy,0,-8.67784,-9.58,-1.99,-9.02193535833417
O[C@H](COc1ccccc1C[NH+]1CCc2sccc2C1)C[NH+]1CCSCC1,C12719046_decoy,CXCR4,Decoy,0,-10.3034,-7.06,-1.54,-9.28813593673016
[NH2+]=c1n(CC[NH+]2CCCC2)c2ccccc2n1C[C@H](O)COc1ccc(Cl)cc1,C05332288_decoy,CXCR4,Decoy,0,-8.94465,-7.88,-2.67,-8.286167484445576
COc1ccc(C[NH+](Cc2ccncc2)CC2CC[NH+](C3CCN(C)CC3)CC2)c(F)c1,C20452078_decoy,CXCR4,Decoy,0,-10.5455,-8.07,-1.55,-8.632979449292383
CC(C)NC(=O)[C@@H]1C[C@@H]([NH2+]C2C3CC4CC(C3)CC2C4)C[NH+]1Cc1ccncc1,C23362427_decoy,CXCR4,Decoy,0,-9.73039,-7.85,-1.56,-8.383998639399724
CC[NH+](CC)CCNC(=O)[C@H]1CN(C(=O)c2ccccc2C)CC12CC[NH2+]CC2,C39626630_decoy,CXCR4,Decoy,0,-9.0263,-8.66,-0.48,-9.597224202273225
C[NH+](C)CCCNC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39627298_decoy,CXCR4,Decoy,0,-9.18471,-7.75,-1.18,-10.303211493459496
C[NH+](C)CCCNC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39627334_decoy,CXCR4,Decoy,0,-9.1711,-8.77,-2.46,-8.075331083360767
CCC(CC)C(=O)N1C[C@H](C(=O)NCCC[NH+]2CCCC[C@@H]2C)C2(CC[NH2+]CC2)C1,C39628434_decoy,CXCR4,Decoy,0,-9.05655,-7.14,-1.39,-7.755537593919762
CSCCC(=O)N1C[C@@H](C(=O)NCCC[NH+]2CCCC[C@H]2C)C2(CC[NH2+]CC2)C1,C39628498_decoy,CXCR4,Decoy,0,-10.693,-6.47,-2.27,-8.689563393086406
C[NH+](C)CC(C)(C)CNC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39630649_decoy,CXCR4,Decoy,0,-10.2179,-8.07,-1.4,-5.842776059748583
Cc1ccc(C(=O)N2C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)cc1F,C39634771_decoy,CXCR4,Decoy,0,-9.1029,-8.19,-1.58,-8.091915828256809
Cc1ccc(C(=O)N2C[C@H](C(=O)NCC[NH+](C(C)C)C(C)C)C3(CC[NH2+]CC3)C2)cc1C,C39634823_decoy,CXCR4,Decoy,0,-9.21206,-9.17,-1.9,-9.168780086267702
CC(C)[NH+](CCNC(=O)[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC12CC[NH2+]CC2)C(C)C,C39634861_decoy,CXCR4,Decoy,0,-9.64966,-8.08,-2.68,-4.497944361382312
Cc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@@H](c3ccccc3)[NH+](C)C)C3(CC[NH2+]CC3)C2)cc1C,C39675819_decoy,CXCR4,Decoy,0,-9.29127,-9.67,-1.68,-8.944694391409197
Cc1ccsc1C(=O)N1C[C@@H](C(=O)NC[C@H](c2ccccc2)[NH+](C)C)C2(CC[NH2+]CC2)C1,C39675925_decoy,CXCR4,Decoy,0,-10.1366,-9.73,-2.41,-10.26973440825691
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCC2CC[NH+](C3CCCC3)CC2)C2(CC[NH2+]CC2)C1,C39689086_decoy,CXCR4,Decoy,0,-9.83482,-9.04,-3.28,-8.608569381235778
C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CN(C(=O)c3ccccc3C(F)(F)F)CC23CC[NH2+]CC3)C1,C39689587_decoy,CXCR4,Decoy,0,-8.24379,-7.49,-3.51,-3.831008037969811
C[NH+]1CC[C@@H](CNC(=O)[C@@H]2CN(C(=O)c3ccc(F)c(C(F)(F)F)c3)CC23CC[NH2+]CC3)C1,C39689623_decoy,CXCR4,Decoy,0,-9.28771,-9.89,-2.33,-10.524277552537198
CCCCCCC(=O)N1C[C@H](C(=O)NC[C@H]2CC[NH+](C)C2)C2(CC[NH2+]CC2)C1,C39689732_decoy,CXCR4,Decoy,0,-9.18878,-7.89,-1.14,-4.429431814630153
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)c2c(F)ccc(C)c2F)CC12CC[NH2+]CC2,C39695545_decoy,CXCR4,Decoy,0,-10.1113,-8.8,-2.29,-9.52726000585036
CC[C@@H](C(=O)N1C[C@@H](C(=O)NC[C@@H]2CCC[NH+]2CC)C2(CC[NH2+]CC2)C1)c1ccccc1,C39695571_decoy,CXCR4,Decoy,0,-9.71724,-8.41,-4.14,-4.468585301408603
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)c2sccc2C)CC12CC[NH2+]CC2,C39695661_decoy,CXCR4,Decoy,0,-9.86452,-8.48,-1.73,-9.670043515383256
C[C@@H](C(=O)C1=c2ccccc2=[NH+]C1)[NH+]1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1,C39736260_decoy,CXCR4,Decoy,0,-8.63851,-7.61,-1.03,-6.796580050607076
Cc1nc(-c2ccccc2)cc([C@H]2C[NH+]3CC[C@H]2C[C@@H]3C[NH2+]Cc2ccc(CO)o2)n1,C39960782_decoy,CXCR4,Decoy,0,-8.46072,-9.21,-2.62,-9.173977872334763
CSc1cccc(NC(=O)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3CN2CC[NH+](C)CC2)c1,C43527231_decoy,CXCR4,Decoy,0,-9.69019,-8.55,-3.62,-8.40465667575625
C[NH+]1CCN(C[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNC(=S)Nc2ccccc2)CC1,C43527240_decoy,CXCR4,Decoy,0,-9.53304,-8.21,-1.18,-7.46413792000324
C[NH+]1[C@@H](CCC(=O)NCc2ccc(F)cc2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1cccc(Cl)c1,C22922841_decoy,CXCR4,Decoy,0,-9.00596,-9.69,-3.9,-4.639192663257507
C[NH+]1[C@@H](CCC(=O)NCc2ccccc2)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1cccs1,C22922964_decoy,CXCR4,Decoy,0,-9.90521,-7.9,-2.01,-4.481317537955968
C[NH+](C)[C@@H](CNC(=O)CCc1[nH+]cc(-c2ccc(F)cc2)o1)c1ccsc1,C23133370_decoy,CXCR4,Decoy,0,-8.52266,-8.31,-2.43,-7.482348201920706
N#Cc1cccc2c1=[NH+]CC=2C1=CC[NH+](CC[C@H]2OCCc3cc(C(N)=O)ccc32)CC1,C52595189_decoy,CXCR4,Decoy,0,-10.1726,-7.31,-3.14,-6.27221760954494
CC[C@@H](C)[NH+]1CCN([C@@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C55064369_decoy,CXCR4,Decoy,0,-9.78807,-6.73,-0.63,-8.47089239175971
Cc1ccc2cc(CNCCC[NH+]3C[C@@H]4C=C[C@H]3C4)c(N3CCC(O)CC3)[nH+]c2c1,C20783304_decoy,CXCR4,Decoy,0,-9.90071,-8.41,-0.66,-8.665737018247677
O=C(C[NH+]1CCC(C(=O)NC2CC2)CC1)NC[C@@H]1CC[NH+](CC(F)(F)F)C1,C55911506_decoy,CXCR4,Decoy,0,-8.40525,-7.46,-1.66,-7.796365857391609
C[NH+]1CCN(c2cc(CNC(=O)NCCSc3ccc(Cl)cc3)cc[nH+]2)CC1,C48132262_decoy,CXCR4,Decoy,0,-10.156,-7.31,-1.73,-8.89009421952993
CCOC(=O)C1=C2CCC[C@H]2S[C@@H]1NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1,C63254454_decoy,CXCR4,Decoy,0,-8.79572,-8.01,-2.65,-3.940803622106333
CC1=[NH+][C@H](CSc2ccccc2C(=O)N2CC=C(C3=c4ccccc4=[NH+]C3)CC2)ON1,C63403840_decoy,CXCR4,Decoy,0,-8.7386,-10.21,-2.74,-8.432925110022644
O=C(N/N=C(/CSC1[NH+]=c2ccccc2=[NH+]1)c1ccccc1)c1ccncc1,C63637507_decoy,CXCR4,Decoy,0,-9.00833,-8.33,-1.86,-8.422736007761827
CC1=C(C[NH2+]C[C@H](C2=c3ccccc3=[NH+]C2)c2cccs2)[C@@H](C)N([C@@H]2CCS(=O)(=O)C2)N1,C63820459_decoy,CXCR4,Decoy,0,-11.4969,-9.85,-1.01,-12.82238154657673
O=C(NC[C@H]1CCC[NH+](Cc2cccc3c2OCO3)C1)[C@H]1C=c2ccccc2=[NH+]1,C64044979_decoy,CXCR4,Decoy,0,-8.05223,-8.56,-3.6,-3.849981404234129
CC[NH+]1CCN(C(=O)CCC2CCN(C(=O)[C@@H]3[NH+]=c4ccc(C)cc4=C3C)CC2)CC1,C64066685_decoy,CXCR4,Decoy,0,-8.92772,-7.08,-1.5,-6.37864791093921
CC(=O)Nc1ccc(C[NH+]2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2cnn(C(C)C)c2)cc1,C64120643_decoy,CXCR4,Decoy,0,-8.47548,-6.93,-3.04,-6.015566766560003
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)[NH+]1CC=C(C2=c3ccccc3=[NH+]C2)CC1,C64212782_decoy,CXCR4,Decoy,0,-7.60007,-11.31,-1.85,-8.839283797660592
O=C(C[NH+]1CCC[C@@H](C(=O)NC2CC2)C1)NC[C@H]1CC[NH+](CC(F)(F)F)C1,C65244537_decoy,CXCR4,Decoy,0,-7.50737,-8.38,-0.78,-8.445758541305727
C[C@H]([NH2+][C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1)C(=O)Nc1ccccc1,C66390693_decoy,CXCR4,Decoy,0,-6.9309,-8.16,-1.5,-6.483153173831838
CC(C)[C@H](C[NH2+]Cc1cn(C)nc1-c1cc2ccccc2o1)N1CC[NH+](C)CC1,C67187069_decoy,CXCR4,Decoy,0,-8.75579,-8.76,-2.08,-7.841787512137785
COc1cc(OC)c(OC)cc1C[NH2+][C@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C67250827_decoy,CXCR4,Decoy,0,-8.81821,-7.32,-1.61,-7.250500735410077
CC[NH+]1CCC(NC(=O)[C@@H]2CCC[C@H](C(=O)NC3CC[NH+](CC)CC3)C2)CC1,C67571882_decoy,CXCR4,Decoy,0,-8.91137,-6.79,-2.66,-6.99268018521407
O=C1C[C@H]([NH+]2CCN(c3cccc[nH+]3)CC2)C(=O)N1c1ccc(C(F)(F)F)cc1,C04476099_decoy,CXCR4,Decoy,0,-8.20774,-6.8,-1.98,-5.135728786927702
CC[NH+](CC)CCn1c(=[NH2+])n(C[C@@H](O)c2ccco2)c2ccccc21,C04793543_decoy,CXCR4,Decoy,0,-7.56322,-7.5,-2.87,-7.5817495884994734
C[C@@H](C(=O)NC[C@@H]1CCCO1)[NH+]1CCC([NH+]2CCCCC2)CC1,C04969039_decoy,CXCR4,Decoy,0,-8.0466,-7.47,-4.03,-3.5391453262981645
CCC(=O)N1[C@@H](C(=O)NCCC[NH+]2CCCCC2)CSC12CC[NH+](C)CC2,C06943604_decoy,CXCR4,Decoy,0,-8.50139,-7.97,-3.58,-3.831573171522922
CC(C)Cn1c(C[NH+]2CCC([NH+]3CCSCC3)CC2)cnc1S(C)(=O)=O,C11663996_decoy,CXCR4,Decoy,0,-9.67292,-7.84,-3.26,-8.876231811309617
CC(C)NC(=O)C1CC[NH+](C2CCN(C(=O)[C@H]3CCCC[NH+]3C)CC2)CC1,C11839087_decoy,CXCR4,Decoy,0,-9.50588,-7.36,-2.16,-3.947315023207394
C[NH2+]C[C@H](c1cc(OC)c(OC)c(OC)c1)N1CC[NH+](C)CC1,C19862177_decoy,CXCR4,Decoy,0,-7.58192,-7.05,-3.03,-8.211855592861951
C[NH2+]C[C@@H](c1cc(OC)c(OC)c(OC)c1)N1CC[NH+](C)CC1,C19862178_decoy,CXCR4,Decoy,0,-8.20862,-6.92,-1.79,-9.126780486801238
COc1ccc([C@@H](c2[nH+]ccn2C)N2CC[NH2+]CC2)cc1OC,C19931662_decoy,CXCR4,Decoy,0,-7.64256,-7.11,-1.16,-8.574309336459402
CCC(=O)N1[C@@H](C(=O)NCCC[NH+](CC)CC)CSC12CC[NH+](C)CC2,C06943450_decoy,CXCR4,Decoy,0,-8.16124,-6.1,-3.69,-7.288655915959048
O[C@H]1CC[NH+](Cc2cn(C3CC[NH+](Cc4cc(F)ccc4F)CC3)nn2)C1,C20917082_decoy,CXCR4,Decoy,0,-8.46256,-8.13,-2.19,-7.024396192010987
COc1cc([C@@H](C[NH3+])[NH+]2CCCC2)cc(Br)c1OC,C32089087_decoy,CXCR4,Decoy,0,-9.16182,-6.85,-2.4,-3.640652262360955
CC(CC1=[N+](c2ccccc2)[C@](O)(c2ccccc2)CS1)=[NH+]c1ccccc1,C06292592_decoy,CXCR4,Decoy,0,-9.53228,-9.72,-2.63,-8.512858494166302
CC(C)[NH+]1CCN([C@@H](C[NH3+])c2cc(Br)cs2)CC1,C36170855_decoy,CXCR4,Decoy,0,-9.09073,-6.41,-0.67,-7.814129255878903
CC[NH+]1CCC([C@H](C)[NH2+]C2CCN(S(C)(=O)=O)CC2)CC1,C36828190_decoy,CXCR4,Decoy,0,-8.16675,-6.22,-3.13,-3.323748506765649
COc1cc(Br)c([C@H](C[NH3+])[NH+]2CCCC2)cc1OC,C37754876_decoy,CXCR4,Decoy,0,-8.2106,-6.64,-0.98,-9.329313207678984
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39626424_decoy,CXCR4,Decoy,0,-8.93047,-6.75,-0.56,-8.60707268366578
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39626429_decoy,CXCR4,Decoy,0,-8.58178,-7.31,-1.47,-9.261533101673068
CC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCC[NH+](C)C)C2(CC[NH2+]CC2)C1,C39627364_decoy,CXCR4,Decoy,0,-8.16087,-6.86,-0.74,-9.39068642727967
NC1=C(C2[NH+]=c3ccccc3=[NH+]2)C(=O)CN1CCc1ccccc1,C39927489_decoy,CXCR4,Decoy,0,-6.87897,-8.24,-1.06,-6.470892091461543
CC(C)[C@H](C[NH2+]C1CCS(=O)(=O)CC1)N1CC[NH+](C)CC1,C40770246_decoy,CXCR4,Decoy,0,-8.31828,-6.49,-1.13,-7.088182473611497
CC1CC[NH+](C[C@H]2C[NH+]3CC[C@@H]2C[C@@H]3CNS(C)(=O)=O)CC1,C43527096_decoy,CXCR4,Decoy,0,-9.23059,-7.28,-1.16,-3.774076139317089
CC[NH+]1CCN(c2ccc(NC(=O)[C@H](C)n3cc[nH+]c3)c(C)c2)CC1,C46762901_decoy,CXCR4,Decoy,0,-8.63747,-7.28,-2.62,-8.288676290339678
Cc1ccc(/C=C/C(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)o1,C48329605_decoy,CXCR4,Decoy,0,-9.18978,-7.87,-2.15,-8.3750452587767
[NH3+]C[C@@H](c1ccc(Br)cc1)N1CC[NH+](C2CC2)CC1,C48991738_decoy,CXCR4,Decoy,0,-8.59035,-6.19,-0.6,-6.932908869328819
CCS(=O)(=O)Oc1ccc(Cl)cc1C[NH2+]CC[NH+](C)C,C35828839_decoy,CXCR4,Decoy,0,-8.29837,-6.49,-2.28,-8.950070511974815
C[C@H](C[NH3+])C[NH+]1CCCN(S(=O)(=O)C2CCOCC2)CC1,C50198925_decoy,CXCR4,Decoy,0,-7.28048,-6.7,-0.9,-6.7419802478357
O=S(=O)(C[C@H]1CCCC[NH2+]1)N1CC[NH+](C2CCCC2)CC1,C52064005_decoy,CXCR4,Decoy,0,-8.17507,-5.99,-3.13,-2.899282453017749
C[NH+](Cc1cc(Br)cs1)[C@@H](C[NH3+])C1CCOCC1,C52177726_decoy,CXCR4,Decoy,0,-9.71363,-6.38,-1.3,-9.2253755716857
O=S1(=O)CC[C@@H]([NH2+]CCN2CC[NH+](C3CCCC3)CC2)C1,C53388882_decoy,CXCR4,Decoy,0,-8.1076,-7.55,-2.11,-3.305789753901024
CC[NH+]1CCN([C@@H](C[NH3+])c2c(C)nn(-c3ccccc3)c2C)CC1,C53994327_decoy,CXCR4,Decoy,0,-7.11255,-7.68,-2.26,-7.861494797140357
C=CC[n+]1c(-c2ccc(OC)cc2)csc1Nc1cc[nH+]cc1,C59186644_decoy,CXCR4,Decoy,0,-6.73218,-6.25,-3.68,-6.26175956655369
Cc1[nH+]ccn1CCCC(=O)N[C@@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1,C60358895_decoy,CXCR4,Decoy,0,-7.97797,-6.11,-4.05,-2.4070722777694367
CCC[NH+]1CCN(c2ccc([C@@H](C)[NH3+])cc2Br)CC1,C61694458_decoy,CXCR4,Decoy,0,-7.86535,-7.13,-1.39,-7.646572070299182
CC[C@@H](C)[NH+]1CCN(c2ccc([C@H](C)[NH3+])cc2Br)CC1,C61698223_decoy,CXCR4,Decoy,0,-8.74542,-6.26,-0.59,-6.242061926976155
C[C@H]([NH3+])c1ccc(OCC[C@@H]2CCC[NH+]2C)c(Br)c1,C61699639_decoy,CXCR4,Decoy,0,-8.79781,-6.16,-2.88,-3.4833551303708443
C[C@@H]([NH3+])c1ccc(OCC[C@H]2CCC[NH+]2C)c(Br)c1,C61699642_decoy,CXCR4,Decoy,0,-8.04632,-6.58,-1.53,-8.051844161602299
COc1cc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc2c1OCCO2,C62254734_decoy,CXCR4,Decoy,0,-7.64384,-6.12,-1.83,-7.578389260107303
CCO[C@@H](C[NH3+])CC[NH+](C)Cc1cc(Br)cs1,C62741101_decoy,CXCR4,Decoy,0,-8.25601,-4.94,-2.05,-7.40683310139055
CN1CCN(C(=S)SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)CC1,C63393601_decoy,CXCR4,Decoy,0,-7.83861,-7.3,-3.68,-3.40890448251276
CC1=c2cc(C(=O)NCCCN3CC[NH+](C)CC3)ccc2=[NH+][C@@H]1C,C63647286_decoy,CXCR4,Decoy,0,-7.67993,-7.99,-1.28,-7.266127196521819
CC1=c2ccccc2=[NH+][C@@H]1CN(C)C(=O)[C@@H]1CCC[NH+](CC(N)=O)C1,C63855416_decoy,CXCR4,Decoy,0,-8.24957,-7.8,-1.28,-9.630344422540787
O=C(NCCn1cc[nH+]c1)NC[C@@H](c1cccs1)[NH+]1CCCC1,C48302882_decoy,CXCR4,Decoy,0,-9.0235,-7.27,-3.96,-3.882167033758321
O=C(NCC1CC1)C1CCN([C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)CC1,C64410443_decoy,CXCR4,Decoy,0,-7.34682,-7.78,-4.08,-3.542653337283733
Cc1nc(C[NH2+][C@@H](C)CN2CC[NH+](C)CC2)nc2c1CCCC2,C65422681_decoy,CXCR4,Decoy,0,-8.28339,-8.7,-1.54,-9.017872975520312
CC(=O)NCCc1cn(C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)c[nH+]1,C65430466_decoy,CXCR4,Decoy,0,-7.67468,-6.56,-0.98,-7.093463872424279
CN(CC(=O)NC1CC1)C(=O)C[NH+]1CCC[C@H]1C[NH+]1CCCC1,C66536638_decoy,CXCR4,Decoy,0,-8.50267,-6.55,-0.72,-7.475690991444851
C[NH+]1CCN(C[C@H](O)C[NH+]2CCC(NC(=O)CC3CCCC3)CC2)CC1,C66951259_decoy,CXCR4,Decoy,0,-9.02914,-6.93,-1.67,-7.028697501420009
CC[NH+]1CCN(CC[NH2+]Cc2cn(C)nc2-c2ccncc2)CC1,C67187698_decoy,CXCR4,Decoy,0,-8.90428,-7.61,-1.76,-11.465889005407863
COCCn1cnnc1[C@@H](C)[NH2+]C1CCC2(CC[NH2+]CC2)CC1,C67457970_decoy,CXCR4,Decoy,0,-8.6294,-7.34,-1.78,-3.75043355019049
O[C@@H](C[NH+]1CCN(c2ccc(C(F)(F)F)c[nH+]2)CC1)c1ccccc1,C04324388_decoy,CXCR4,Decoy,0,-6.97,-7.41,-2.32,-5.415996186830788
O[C@@H](C[NH+]1CCN(c2c(Cl)c[nH+]cc2Cl)CC1)C(F)(F)F,C04389286_decoy,CXCR4,Decoy,0,-7.3863,-6.95,-0.86,-7.104863996432443
[NH2+]=C(C[NH+]1CCCCC1)NS(=O)(=O)c1cc(Cl)cc(Cl)c1,C04300288_decoy,CXCR4,Decoy,0,-10.1629,-7.97,-1.81,-10.55501423238865
CNc1cc(C(=O)N2CC[C@@]3(CCC[NH+](Cc4cc(OC)ccc4F)C3)C2)cc[nH+]1,C12585508_decoy,CXCR4,Decoy,0,-12.6679,-8.74,-1.6,-10.376320067454513
CC[NH+](CC)Cc1nc(N2CC[NH+](C)CC2)c2c(C)c(C)sc2n1,C14085842_decoy,CXCR4,Decoy,0,-8.57023,-6.73,-1.12,-8.043815155273748
CC(C)(C(N)=O)[NH+]1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1,C05186955_decoy,CXCR4,Decoy,0,-8.29159,-8.35,-4.22,-7.671710848563181
COCC[NH+]1CCC[C@@]2(CC[NH+](Cc3cc(=O)c4ccccc4[nH]3)C2)C1,C20541102_decoy,CXCR4,Decoy,0,-9.61481,-9.19,-3.75,-4.29942256070118
CCC[NH+]1CCN([C@H](C[NH3+])c2ccc(F)c(Br)c2)CC1,C22166434_decoy,CXCR4,Decoy,0,-9.46095,-7.23,-0.96,-8.812783095933545
C(=C/c1cn2cc(C3=[NH+]CCN3)ccc2n1)\c1ccc(C2=[NH+]CCN2)cc1,C27436590_decoy,CXCR4,Decoy,0,-10.3625,-7.99,-4.67,-8.578273320470881
CC[NH2+]Cc1c(C)nn(-c2cccc(F)c2)c1N1CC[NH+](CC)CC1,C35938860_decoy,CXCR4,Decoy,0,-8.306,-7.34,-1.44,-8.392899371796563
COc1ccc(Br)cc1[C@@H](C[NH3+])[NH+]1CCC(N(C)C)CC1,C36191609_decoy,CXCR4,Decoy,0,-8.97684,-6.6,-2.18,-8.842196024817117
Cc1ccc(OC[C@@H](O)C[NH2+]C[C@H]2CC[NH+](C)C2)c(Br)c1,C37894263_decoy,CXCR4,Decoy,0,-9.06921,-7.04,-1.86,-8.207024856616096
Cc1ccc2c(c1C)=[NH+]C(=O)[C@H](CCNC(=O)C(=O)C1=c3ccccc3=[NH+][C@@H]1C)C=2,C39364094_decoy,CXCR4,Decoy,0,-9.4,-8.89,-2.91,-4.16619437129041
O=C(CC[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)OCC(=O)c1ccc(F)cc1,C39741333_decoy,CXCR4,Decoy,0,-6.62179,-9.82,-1.55,-7.944189970663388
O=C(C1=c2ccccc2=[NH+]C1)[C@H]([NH2+]CC[C@@H]1CC=CO1)c1ccccc1,C39752117_decoy,CXCR4,Decoy,0,-8.91635,-8.71,-3.72,-4.436247702292564
C[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+]1CCC[C@@H]1C(=O)N(C)C,C42953562_decoy,CXCR4,Decoy,0,-8.19742,-6.28,-2.22,-7.18272191528278
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+]1CCC[C@@H]1C(=O)N(C)C,C42953565_decoy,CXCR4,Decoy,0,-6.85302,-7.13,-2.58,-7.602071435159271
CC[C@H]([NH3+])[C@@H](c1cccc(Br)c1)N1CC[NH+](C2CC2)CC1,C43021354_decoy,CXCR4,Decoy,0,-9.15468,-8.02,-1.03,-9.99979923120262
CC[C@H]([NH3+])[C@H](c1cccc(Br)c1)N1CC[NH+](C2CC2)CC1,C43021357_decoy,CXCR4,Decoy,0,-8.17509,-8.01,-1.73,-7.698968735632306
CCOC1CC[NH+]([C@H](c2ccccc2Br)[C@H]([NH3+])CC)CC1,C43092440_decoy,CXCR4,Decoy,0,-8.25433,-7.33,-4.74,-9.683132711034782
CCOC1CC[NH+]([C@@H](c2ccccc2Br)[C@H]([NH3+])CC)CC1,C43092446_decoy,CXCR4,Decoy,0,-9.14462,-6.99,-2.73,-9.776242084147553
C[C@@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[NH+](C2CC2)CC1,C43261914_decoy,CXCR4,Decoy,0,-9.24782,-5.85,-0.58,-8.368956552082903
C[C@H]([NH3+])[C@@H](c1ccc(Br)s1)N1CC[NH+](CC2CC2)CC1,C43261930_decoy,CXCR4,Decoy,0,-8.92642,-6.1,-0.94,-7.291192529267874
CC[C@H]([NH3+])[C@H](c1cc(Br)cs1)[NH+](C)CC(=O)N(C)C,C43285459_decoy,CXCR4,Decoy,0,-9.73002,-6.52,-1.23,-10.308210874389037
CC[C@@H]([NH3+])[C@@H](c1cc(Br)cs1)[NH+](C)CC(=O)N1CCCC1,C43286795_decoy,CXCR4,Decoy,0,-8.87494,-5.68,-3.08,-3.3523105367880808
CC[C@H]([NH3+])[C@H](c1cccnc1)[NH+](C)Cc1csc(Br)c1,C43347888_decoy,CXCR4,Decoy,0,-10.096,-7.33,-1.11,-10.247465446314418
Cc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC(=O)N3CCCn3cc[nH+]c3)C2)o1,C43630957_decoy,CXCR4,Decoy,0,-8.42568,-7.2,-1.63,-7.144159796728084
Cc1ccc([C@H]2CSC[C@@H](C(=O)NCCCn3cc[nH+]c3)[NH2+]2)cc1,C44170389_decoy,CXCR4,Decoy,0,-8.04285,-5.86,-1.09,-6.000874096016787
C[NH+]1CCN(c2cc(CNC(=O)C3=Cc4cc(Cl)ccc4OC3)cc[nH+]2)CC1,C48330087_decoy,CXCR4,Decoy,0,-8.89264,-7.05,-2.92,-6.110790181586001
CC(C)(C)[NH+]1CCN([C@@H](C[NH3+])c2ccc(F)c(Br)c2)CC1,C48927037_decoy,CXCR4,Decoy,0,-9.37038,-7.26,-1.38,-7.8405724803998895
COc1ccc(Br)cc1[C@@H](C[NH3+])N1CC[NH+](C2CC2)CC1,C48991910_decoy,CXCR4,Decoy,0,-8.77995,-7.11,-1.77,-9.307970367959747
[NH3+]C[C@@H](c1ccc(F)c(Br)c1)N1CC[NH+](CC2CC2)CC1,C48991986_decoy,CXCR4,Decoy,0,-8.8842,-7.67,-0.52,-11.558259813073622
[NH3+][C@H](COc1cncc(C#Cc2ccncc2)c1)CC1=c2ccccc2=[NH+]C1,C52627727_decoy,CXCR4,Decoy,0,-8.19369,-9.09,-0.97,-7.541390213789329
CCC[NH+]1CCN(CC[C@H]([NH2+]C)c2ccccc2Br)CC1,C54015361_decoy,CXCR4,Decoy,0,-9.30605,-7.32,-2.77,-12.433685040225654
CC[C@@H](C)[NH+]1CCN([C@H](C[NH3+])c2cc(Br)cs2)CC1,C55064049_decoy,CXCR4,Decoy,0,-9.84554,-6.31,-0.62,-12.300071047660174
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2ccc(Br)cc2F)CC1,C55064294_decoy,CXCR4,Decoy,0,-9.07764,-7.12,-1.18,-8.917068557129427
CC[C@H](C)[NH+]1CCN([C@H](C[NH3+])c2cc(Br)ccc2F)CC1,C55064503_decoy,CXCR4,Decoy,0,-9.39939,-7.64,-0.87,-12.323324804676483
CC(C)C[NH+]1CCN([C@@H](C[NH3+])c2ccc(F)c(Br)c2)CC1,C55078192_decoy,CXCR4,Decoy,0,-8.71934,-7.34,-1.57,-7.360753668201515
O[C@@H](C[NH2+]CC[NH+]1CCCCC1)COc1ccc(Br)cc1,C48334150_decoy,CXCR4,Decoy,0,-8.43616,-6.98,-1.28,-8.227593564797166
C[NH+](C)CC1CCN([C@@H](C[NH3+])c2cc(Br)cs2)CC1,C42392299_decoy,CXCR4,Decoy,0,-8.50169,-6.3,-3.64,-7.525771461358722
CC[C@H]([NH3+])[C@H](c1ccc(Br)s1)N1CCC[NH+](C)CC1,C43259311_decoy,CXCR4,Decoy,0,-8.46287,-5.43,-0.91,-6.264258376232734
CCC[NH+]1CCN([C@H](c2cc(Br)cs2)[C@@H](C)[NH3+])CC1,C44418607_decoy,CXCR4,Decoy,0,-8.28852,-6.22,-1.88,-6.844415355513772
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CCC[C@@H]1C[NH+](C)C,C61642073_decoy,CXCR4,Decoy,0,-7.58166,-5.65,-2.13,-7.444745714833053
COc1ccc([C@@H](C[NH3+])N2CCn3cc[nH+]c3C2)cc1Br,C62248828_decoy,CXCR4,Decoy,0,-8.6962,-7.36,-0.98,-9.126518122017607
CC[C@@H]([NH3+])[C@H](c1ccc(Br)s1)N1CC[C@H]([NH+](C)C)C1,C62964040_decoy,CXCR4,Decoy,0,-8.81259,-6.42,-3.54,-8.088436775397744
C[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)N1CC[C@H]([NH+]2CCCC2)C1,C62977526_decoy,CXCR4,Decoy,0,-8.85325,-6.7,-1.84,-7.802514357761976
[NH3+]C[C@H](c1ccc(Br)s1)N1CC[C@H]([NH+]2CCCCC2)C1,C62977709_decoy,CXCR4,Decoy,0,-9.23947,-7.0,-3.79,-6.650118356891937
CC[C@@H]([NH3+])[C@H](c1cc(Br)cs1)N(C)CC[NH+]1CCCC1,C63050812_decoy,CXCR4,Decoy,0,-9.28107,-6.27,-3.1,-9.076999495118844
CCC[NH+]1CCC(N2C[C@H]([NH2+]Cc3ccc(F)cc3F)C[C@H]2C(=O)NCC)CC1,C23358601_decoy,CXCR4,Decoy,0,-8.95849,-8.33,-1.14,-8.079427777536344
C[C@H](NC(=O)c1ccc(F)c(F)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305779_decoy,CXCR4,Decoy,0,-7.41628,-8.3,-1.42,-6.553188269581985
C[NH+](C)CCCn1c(=O)[nH]c2sc3c(c2c1=[NH2+])CC(C)(C)OC3,C02890141_decoy,CXCR4,Decoy,0,-9.19337,-7.08,-1.99,-4.520223862636045
[NH2+]=c1n(CC[NH+]2CCOCC2)c2ccccc2n1C[C@@H](O)c1cccs1,C04663509_decoy,CXCR4,Decoy,0,-8.31711,-7.0,-1.9,-3.7978534708266447
C[NH+](C)CC1(C[NH+](C)C)COc2ccc(Br)cc2C1=O,C05535334_decoy,CXCR4,Decoy,0,-7.44645,-6.09,-0.95,-8.044095273011296
[NH2+]=c1n(CC[NH+]2CCCC2)c2ccccc2n1C[C@@H](O)c1ccco1,C00241422_decoy,CXCR4,Decoy,0,-7.94597,-8.14,-3.06,-4.10096158291875
C=CCn1nc(C(=O)N2CC[NH+](C)CC2)c2c1CC[C@@H]([NH+]1CCC(C)CC1)C2,C19113511_decoy,CXCR4,Decoy,0,-8.96722,-8.88,-1.33,-9.5362494163073
CC(C)C[NH+](C)[C@H](C[NH3+])c1cc(Br)c2c(c1)OCO2,C37108234_decoy,CXCR4,Decoy,0,-9.20747,-7.01,-1.91,-3.7780865580313634
Brc1cc(C[NH2+]CCCn2cc[nH+]c2)cc2c1OCO2,C37300905_decoy,CXCR4,Decoy,0,-8.2931,-7.34,-1.66,-9.10759404340307
C1CC[NH+](C[C@H]2CO[C@@H](CC[C@@H]3OC[C@H](C[NH+]4CCCC4)O3)O2)C1,C37623971_decoy,CXCR4,Decoy,0,-7.99366,-5.88,-3.05,-3.1203105247344047
O[C@@H](C[NH2+]Cc1cc(F)ccc1Br)C[NH+]1CCCC1,C37998654_decoy,CXCR4,Decoy,0,-8.92918,-7.56,-1.1,-11.775855232817973
C[NH+]1CCN(C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNS(C)(=O)=O)CC1,C22926957_decoy,CXCR4,Decoy,0,-8.8191,-6.25,-1.15,-7.504327271714019
CC(=O)N1C[C@H](C(=O)NCC(C)(C)C[NH+](C)C)C2(CC[NH2+]CC2)C1,C39630548_decoy,CXCR4,Decoy,0,-8.49675,-6.98,-1.5,-8.10590823770612
CC[C@@H](C)C(=O)N1C[C@H](C(=O)N[C@@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663041_decoy,CXCR4,Decoy,0,-8.82787,-6.99,-2.57,-7.879333188461491
CC[C@H](C)C(=O)N1C[C@H](C(=O)N[C@@H]2C[NH+]3CCC2CC3)C2(CC[NH2+]CC2)C1,C39663043_decoy,CXCR4,Decoy,0,-9.44283,-7.46,-3.75,-3.967829873414698
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)C(C)C)CC12CC[NH2+]CC2,C39695435_decoy,CXCR4,Decoy,0,-8.93973,-7.75,-0.64,-8.234971831455482
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1CN(C(=O)C2CCC2)CC12CC[NH2+]CC2,C39695513_decoy,CXCR4,Decoy,0,-8.68262,-8.06,-2.6,-3.7769460205737375
CC(=O)N1CCC([NH2+]C[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3c2cc(C3CCCC3)nc(C)n2)CC1,C39960776_decoy,CXCR4,Decoy,0,-10.3718,-8.77,-1.57,-8.410547505154687
CC(=O)c1ccc(NC(=O)C[NH2+]C[C@H](c2ccccc2)[NH+](C)C)cc1,C22030010_decoy,CXCR4,Decoy,0,-8.80059,-8.05,-0.84,-8.629162881377658
C[NH+](C)CC1CCN([C@H](C[NH3+])c2ccccc2Br)CC1,C42392135_decoy,CXCR4,Decoy,0,-9.12027,-7.64,-1.14,-9.71339164208115
C[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+]1CCC(N(C)C)CC1,C42953662_decoy,CXCR4,Decoy,0,-8.43441,-6.89,-3.19,-3.42261370729028
C[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)N1CC[NH+](C2CC2)CC1,C42954577_decoy,CXCR4,Decoy,0,-9.05088,-5.98,-1.83,-7.099834861560039
CC(C)[NH+]1CCN([C@H](c2cccc(Br)c2)[C@H](C)[NH3+])CC1,C43020806_decoy,CXCR4,Decoy,0,-9.00824,-7.79,-1.01,-10.311750445230068
CC[NH+]1CCN([C@@H](c2ccc(Br)s2)[C@@H](C)[NH3+])CC1,C43258888_decoy,CXCR4,Decoy,0,-7.06404,-5.91,-0.23,-6.212827408320824
CC[NH+]1CCN([C@@H](c2cc(Br)cs2)[C@H](C)[NH3+])CC1,C43284604_decoy,CXCR4,Decoy,0,-9.26408,-6.85,-0.49,-10.21258042890369
COc1ccc([C@H]2CCC[NH+]2C[C@H](O)C[NH+]2CCCC2)c(OC)c1,C44907679_decoy,CXCR4,Decoy,0,-8.52318,-6.81,-4.03,-3.777991316614144
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)N[C@H]1CC[NH+]2CCCC[C@H]12,C44966500_decoy,CXCR4,Decoy,0,-8.10169,-8.01,-2.63,-7.569468436059256
C=C(C)CN(CC)C(=O)[C@@H](C)[NH+]1CCN(CC[NH+]2CCCC2)CC1,C46063328_decoy,CXCR4,Decoy,0,-8.59462,-6.59,-1.0,-7.8769406692581745
CC[NH+]1CCN(CC[NH2+]Cc2cc(Br)cs2)CC1,C47889565_decoy,CXCR4,Decoy,0,-8.89646,-5.02,-1.69,-7.031397351380334
NC(=O)C1CCN(C(=O)C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)CC1,C48563466_decoy,CXCR4,Decoy,0,-8.65497,-6.61,-1.65,-6.80158022385754
CC[NH2+]Cc1cc(Br)ccc1OCCn1cc[nH+]c1C,C49329412_decoy,CXCR4,Decoy,0,-7.88441,-6.44,-1.32,-8.543231215958844
Cc1nn(-c2ccccc2)c(C)c1C[NH2+]C[C@H](c1ccco1)[NH+](C)C,C22787445_decoy,CXCR4,Decoy,0,-8.06521,-8.15,-1.79,-8.174707768167881
CC(C)[NH+]1CCN([C@H](C[NH3+])c2cc(Br)c(Br)o2)CC1,C50361913_decoy,CXCR4,Decoy,0,-9.17046,-7.15,-1.06,-13.532809661544745
C[NH2+]C[C@H]1CC[C@@H](C[NH+](C)Cc2csc(Br)c2)O1,C52547660_decoy,CXCR4,Decoy,0,-8.91054,-6.26,-1.05,-9.215648680131665
COc1cc(C[NH2+]CC[NH+]2CCCC2)cc(Br)c1O,C20126734_decoy,CXCR4,Decoy,0,-8.23771,-7.1,-0.93,-7.55593539685489
CC[C@H]([NH3+])[C@@H](c1cc(Br)cs1)N1CCC[NH+](C)CC1,C43284990_decoy,CXCR4,Decoy,0,-8.48048,-6.88,-1.28,-8.14963961211591
CC[NH+]1CCN(C(=O)CCC2CC[NH+]([C@H](C)CSC)CC2)CC1,C12458920_decoy,CXCR4,Decoy,0,-8.71966,-5.58,-1.5,-8.301213359632165
CC(C)CN(CC[NH+](C)C)c1ccc([C@H](C)[NH3+])cc1Br,C61697908_decoy,CXCR4,Decoy,0,-7.85774,-6.38,-1.13,-12.40621009232181
CC[C@@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)Nc1nnc(C)s1,C63165560_decoy,CXCR4,Decoy,0,-7.70021,-8.39,-2.85,-3.7296841418974354
O=C1[NH+]=c2ccc(S(=O)(=O)NCCc3ccc(F)cc3)cc2=[NH+]1,C63427072_decoy,CXCR4,Decoy,0,-8.48539,-8.79,-0.68,-10.503748230900973
C[C@H]1[C@H](C(=O)CS[C@@H]2[NH+]=c3cccnc3=[NH+]2)c2ccccc2N1C,C63558228_decoy,CXCR4,Decoy,0,-8.72636,-6.24,-1.05,-5.887740957779691
CC(=O)Nc1ccc(NC(=O)CSC2[NH+]=c3ccccc3=[NH+]2)cc1,C63562635_decoy,CXCR4,Decoy,0,-8.26656,-7.22,-0.74,-9.06402804701396
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)C(=O)Nc1ccc(C[NH+](C)C)cc1,C63914249_decoy,CXCR4,Decoy,0,-7.70995,-8.31,-2.11,-7.205781186903251
C[C@@H](NS(=O)(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2)c1ccccc1F,C63996530_decoy,CXCR4,Decoy,0,-7.11101,-8.57,-0.81,-10.225783249673196
O=C1[NH+]=c2ccc(S(=O)(=O)NCc3ccccc3Cl)cc2=[NH+]1,C64470732_decoy,CXCR4,Decoy,0,-8.67358,-8.68,-1.1,-3.9108123804523567
COc1ccc2c(c1)=C[C@@H](CNC(=O)[C@@H](C)n1cc[nH+]c1C(C)C)[NH+]=2,C65403645_decoy,CXCR4,Decoy,0,-8.33254,-7.54,-1.67,-7.90499690691777
CC1=c2cc(C)ccc2=[NH+][C@H]1C(=O)NCC1(Cn2cc[nH+]c2C)CC1,C65408955_decoy,CXCR4,Decoy,0,-7.16521,-8.73,-3.42,-8.154784086791329
O=C(NC[C@H]1C=c2ccc(F)cc2=[NH+]C1=O)C1=CN=[NH+][C@@H]1c1ccccc1,C65526439_decoy,CXCR4,Decoy,0,-7.80588,-9.43,-1.89,-7.737676630039501
CC[NH+](Cc1ccc(C[NH+](C)C)cc1)Cn1nc2ccccn2c1=O,C66795636_decoy,CXCR4,Decoy,0,-6.96347,-7.52,-1.15,-3.533683108500877
C[C@H](C(=O)N1CCC[C@H](C(N)=O)C1)[NH+]1CCC(CC[NH+](C)C)CC1,C67119455_decoy,CXCR4,Decoy,0,-8.16447,-6.13,-2.78,-9.6538435974587
CCC(CC)[C@@H](C[NH2+]Cc1cn(C)c(=O)n(C)c1=O)[NH+]1CCCC1,C67187131_decoy,CXCR4,Decoy,0,-7.87225,-6.62,-1.91,-7.880270412353927
CS(=O)(=O)N1CCO[C@H](C[NH2+]C2CCC3(CC[NH2+]CC3)CC2)C1,C67654211_decoy,CXCR4,Decoy,0,-8.81454,-6.49,-1.86,-7.869001748161501
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCOCC1)c1ccc(C(F)(F)F)cc1,C08635544_decoy,CXCR4,Decoy,0,-7.75682,-6.75,-2.39,-5.56200700578142
[NH2+]=c1n(CCc2ccccc2)c2ccccc2n1CC[NH+]1CCOCC1,C09426376_decoy,CXCR4,Decoy,0,-7.7135,-6.34,-1.63,-5.745099711321108
Brc1cc2c(cc1C[NH2+]C1CC[NH+](C3CC3)CC1)OCO2,C10352380_decoy,CXCR4,Decoy,0,-8.27324,-7.58,-1.19,-6.922378886043207
CC[NH+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](C2CCOCC2)CC1,C11879572_decoy,CXCR4,Decoy,0,-8.58915,-6.9,-1.8,-8.126218067005771
C[C@H](C[NH+]1CCCCC1)[NH2+][C@@H]1CCOc2ccc(Br)cc21,C37319703_decoy,CXCR4,Decoy,0,-9.36333,-8.12,-2.01,-8.962800242479894
Ic1ccc(C[NH2+]C[C@@H]2CC[NH+](C3CC3)C2)o1,C37648837_decoy,CXCR4,Decoy,0,-8.14652,-6.24,-0.04,-6.833415446713738
Ic1ccc(C[NH2+]C[C@H]2CC[NH+](C3CC3)C2)o1,C37648838_decoy,CXCR4,Decoy,0,-8.0984,-6.23,-2.21,-7.421785851606893
C[NH+]1CCN(c2ccc(NC[C@H]3C=c4ccccc4=[NH+]C3=O)cc2)CC1,C38789842_decoy,CXCR4,Decoy,0,-7.13513,-8.33,-3.11,-7.260867350042186
C=CCN[C@@H]1[NH+]=c2ccccc2=[NH+]/C1=N\S(=O)(=O)c1cccs1,C38980167_decoy,CXCR4,Decoy,0,-8.52815,-7.81,-4.28,-3.717271701880623
C[C@@H]1C(/C=C(\C#N)C2[NH+]=c3ccccc3=[NH+]2)=C[C@H](C)N1NC(=O)c1ccccc1,C39934807_decoy,CXCR4,Decoy,0,-8.13007,-9.02,-3.43,-7.31340276947133
COc1ccc2c(c1)=C[C@@H]([C@@H]1[NH2+]CCc3cc(OC)c(OC)cc31)C(=O)[NH+]=2,C40011055_decoy,CXCR4,Decoy,0,-9.21429,-7.5,-0.58,-7.172886560367601
Brc1ccc2c(c1)[C@H]([NH2+]CCCCn1cc[nH+]c1)CCO2,C45106335_decoy,CXCR4,Decoy,0,-8.93013,-7.62,-1.59,-8.457511940657923
C[NH+]1CCN(c2cc(CNC(=O)CSc3ccc(Cl)cc3)cc[nH+]2)CC1,C48329088_decoy,CXCR4,Decoy,0,-9.62161,-7.22,-2.08,-7.520071616007327
Cc1ccc(OCCC(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)cc1C,C48336389_decoy,CXCR4,Decoy,0,-7.87011,-6.95,-1.9,-6.311764222387899
CC[NH+]1CCN([C@H](C)C[NH2+]Cc2c(C)nn(-c3ccc(F)cc3F)c2C)CC1,C48712896_decoy,CXCR4,Decoy,0,-8.98053,-8.21,-2.57,-9.286157492130831
CCCC[NH+](C)CC1CC[NH+](CC(=O)N2CCN(C(=O)C3CC3)CC2)CC1,C52210246_decoy,CXCR4,Decoy,0,-8.31438,-6.69,-3.31,-6.723612547161021
C[NH+](CCn1cc(C[NH2+]C2CC2)nn1)Cc1cc(Br)cs1,C52517076_decoy,CXCR4,Decoy,0,-9.22487,-5.5,-0.57,-7.998437316956844
C[NH2+][C@@H](CCN1CC[NH+](C2CC2)CC1)c1ccccc1Br,C54022974_decoy,CXCR4,Decoy,0,-9.00852,-7.51,-3.5,-9.382310902180851
C=C(C)COc1ccccc1C[NH+]1C[C@H](O)[C@@H](N2CC[NH+](C)CC2)C1,C55327312_decoy,CXCR4,Decoy,0,-9.84389,-7.68,-2.05,-8.873575482798925
Cc1csc2[nH+]c(CN3CC[NH+](CCC(C)(C)C)CC3)cc(=O)n12,C55935767_decoy,CXCR4,Decoy,0,-8.41038,-7.87,-2.33,-8.373106681783437
CC[NH+]1CCC[C@@H]1C[NH2+][C@@H]1CCCOc2cc(Br)ccc21,C37213905_decoy,CXCR4,Decoy,0,-9.31813,-7.4,-1.47,-10.597305500602364
COc1cc(C[NH2+]CC(C)(C)[NH+](C)C)cc(Br)c1OC,C35161417_decoy,CXCR4,Decoy,0,-8.53542,-6.91,-1.87,-11.204078023381268
C[NH+](Cc1csc(Br)c1)Cc1occc1C[NH2+]C1CC1,C52547570_decoy,CXCR4,Decoy,0,-9.22641,-6.36,-1.69,-9.578627703298682
C[NH+](C)CCN1CCN(CC[NH2+]Cc2cc(Br)cs2)CC1,C61655258_decoy,CXCR4,Decoy,0,-9.56928,-6.07,-1.9,-6.6809963331463535
Cc1ccc(Cn2nc(C)c(C[NH2+]C[C@H](C)Cn3cc[nH+]c3)c2C)cc1,C62254492_decoy,CXCR4,Decoy,0,-7.32906,-7.69,-1.43,-6.85923703980903
Brc1ccc(C[NH2+]C2CC2)c(N2CCn3cc[nH+]c3C2)c1,C62254938_decoy,CXCR4,Decoy,0,-8.03033,-6.93,-2.01,-7.462388279323824
Cc1[nH+]ccn1CCOc1ccc(C[NH2+]C(C)C)cc1Br,C62701690_decoy,CXCR4,Decoy,0,-6.77398,-5.85,-1.83,-6.168440197853639
C[NH+](C)[C@H]1CCN(c2ncc(Br)cc2C[NH2+]C(C)(C)C)C1,C62971261_decoy,CXCR4,Decoy,0,-7.73677,-6.37,-2.07,-3.3043640104833667
Cc1ccc(N2C(=O)C[C@@H]([NH2+]CCC3=c4ccccc4=[NH+]C3)C2=O)cc1,C63172620_decoy,CXCR4,Decoy,0,-8.1369,-8.05,-1.17,-6.964647363718558
CCOc1ccc2c(c1)=[NH+][C@@H](SCC(=O)Nc1nc(C)cs1)[NH+]=2,C63393525_decoy,CXCR4,Decoy,0,-7.93624,-7.22,-3.56,-8.351020181302804
COC(=O)[C@H]1[NH+]=c2cccc(C)c2=C1NC(=O)C[NH+]1CCCC[C@@H]1C,C63448341_decoy,CXCR4,Decoy,0,-8.69612,-8.29,-0.68,-14.332512767093265
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)[C@@H]2C=C3C(=O)[NH+]=c4ccccc4=C3N2C)C1,C63480561_decoy,CXCR4,Decoy,0,-8.5651,-8.78,-1.93,-7.611278072858091
COC(=O)[C@@H](NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1)c1ccccc1,C63515577_decoy,CXCR4,Decoy,0,-8.24575,-8.44,-1.46,-9.02487984313154
CC[C@H](S[C@@H]1[NH+]=c2cccnc2=[NH+]1)C(=O)Nc1ccc(C(C)=O)cc1,C63558243_decoy,CXCR4,Decoy,0,-8.44656,-7.07,-0.72,-7.728334935471912
C=CCN1C(SCC2[NH+]=c3ccccc3=[NH+]2)=NN[C@H]1c1ccncc1,C63596516_decoy,CXCR4,Decoy,0,-8.14624,-8.02,-2.04,-3.7314058492060496
CCc1ccccc1N1C(=O)C[C@@H]([NH2+]CCC2=c3cc(OC)ccc3=[NH+]C2)C1=O,C63626106_decoy,CXCR4,Decoy,0,-8.3017,-8.59,-1.93,-8.006485794917985
COc1ccc(-n2cc[nH+]c2C[NH+](C)[C@H](C)Cc2cc(C)ccn2)cc1,C63855905_decoy,CXCR4,Decoy,0,-8.36398,-7.62,-2.08,-8.565743228705951
O=C(NC[C@@H]1CCC[NH+](Cc2cccc3c2OCO3)C1)[C@H]1C=c2ccccc2=[NH+]1,C64044976_decoy,CXCR4,Decoy,0,-8.76407,-9.42,-0.99,-7.496024313856483
C[C@@]1(C2CC[NH+](C[C@H]3C=c4ccccc4=[NH+]3)CC2)NC(=O)N(Cc2ccsc2)C1=O,C64045433_decoy,CXCR4,Decoy,0,-8.95834,-7.79,-0.56,-7.41880499360064
CC(C)C1=[NH+][C@@H](CCC(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2C)ON1,C64117533_decoy,CXCR4,Decoy,0,-8.27929,-9.07,-1.94,-4.03406477497732
O=C(C[NH+]1CCC[C@@H]1C(=O)Nc1ccccc1)C1=c2ccccc2=[NH+]C1,C64120524_decoy,CXCR4,Decoy,0,-7.01888,-8.54,-0.46,-7.610557758936084
CCN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2,C64131405_decoy,CXCR4,Decoy,0,-7.79776,-8.17,-1.84,-8.739217617560245
O=C(NC1CC[NH+](CC(F)F)CC1)N1CCC[C@@H]([NH+]2CCCC2)C1,C64255196_decoy,CXCR4,Decoy,0,-7.90538,-6.84,-1.25,-7.909418965354022
O=C(NCCCCn1cc[nH+]c1)N1CC[NH+](CC2CCCCC2)CC1,C65460489_decoy,CXCR4,Decoy,0,-9.06986,-7.63,-1.98,-7.306645146184372
Cn1cnnc1CC1CC[NH+](C[C@H]2C=c3ccc(F)cc3=[NH+]C2=O)CC1,C65529854_decoy,CXCR4,Decoy,0,-9.1003,-7.15,-0.99,-5.9658519267216965
CC(C)[NH+](C)Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2ccncc2)c1,C65976471_decoy,CXCR4,Decoy,0,-9.2554,-8.05,-3.27,-7.895435551372566
C[C@H]1CCCC[C@H]1OCCNC(=O)C[NH+]1CCC[C@@H]1C[NH+]1CCCC1,C66535936_decoy,CXCR4,Decoy,0,-9.27203,-7.63,-2.87,-4.017873709979185
CCc1nn(C[NH+](CC)Cc2ccc(C[NH+](C)C)cc2)c(=S)n1C,C66795598_decoy,CXCR4,Decoy,0,-7.95875,-6.38,-2.18,-6.850316295552127
C[C@@H](C[NH2+]Cc1ccc(OC(F)F)c(Cl)c1)N1CC[NH+](C)CC1,C67121529_decoy,CXCR4,Decoy,0,-7.77538,-7.59,-2.26,-7.860759263118537
C[C@H](C[NH2+]Cc1cn(C)nc1-c1cc2ccccc2o1)Cn1cc[nH+]c1,C67500397_decoy,CXCR4,Decoy,0,-8.31946,-7.15,-1.83,-8.591173108121335
C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[NH+]1CCC([NH+]2CCCCC2)CC1,C04969018_decoy,CXCR4,Decoy,0,-9.30437,-8.68,-2.79,-6.770336070966126
CC[NH+]1CCC([NH2+][C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CC1,C12029063_decoy,CXCR4,Decoy,0,-6.70765,-8.54,-1.12,-6.866839308800125
Fc1ccc2cc(C[NH2+]CCC[NH+]3C[C@@H]4C=C[C@H]3C4)c(N3CCOCC3)nc2c1,C12125684_decoy,CXCR4,Decoy,0,-9.51859,-8.54,-2.72,-8.388793714182198
CC(=O)N1CCN(c2[nH+]cccc2C[NH2+]C[C@H](C)CCC=C(C)C)CC1,C12478585_decoy,CXCR4,Decoy,0,-8.56947,-7.73,-1.6,-8.181009086001222
COCC[NH+]1CCC[C@@]2(CC[NH+](Cc3cc4c(cc3OC)CCC4)C2)C1,C12585213_decoy,CXCR4,Decoy,0,-9.35892,-8.94,-0.82,-10.686767776583505
COCC[NH+]1CCC[C@]2(CC[NH+](Cc3c[nH]nc3-c3cc(C)ccc3C)C2)C1,C12306044_decoy,CXCR4,Decoy,0,-9.65702,-8.59,-1.37,-11.24639213012257
CC[NH+]1CCN(C(=O)c2ccc(N3CCC([NH+]4CCc5sccc5C4)CC3)cc2)CC1,C15004334_decoy,CXCR4,Decoy,0,-9.96733,-9.31,-3.78,-7.432632070586761
C[NH2+]Cc1cc(Br)c(OCC[NH+]2CCCCC2)c(OC)c1,C19777586_decoy,CXCR4,Decoy,0,-7.46404,-6.17,-1.55,-6.708705519015645
CCn1cc[nH+]c1CN1CC[C@]2(CCC[NH+](Cc3cc(OC)ccc3F)C2)C1,C20110069_decoy,CXCR4,Decoy,0,-8.75747,-8.57,-2.27,-8.363199105597202
COc1ccc(F)c(C[NH+](Cc2ccncc2)CC2CC[NH+](C3CCN(C)CC3)CC2)c1,C23338510_decoy,CXCR4,Decoy,0,-10.6622,-7.99,-3.25,-10.26957418428263
COc1ccccc1[C@@H](CN/C=C1/C=c2ccccc2=[NH+]C1=O)[NH+]1CCCC1,C27062916_decoy,CXCR4,Decoy,0,-8.43626,-7.77,-2.04,-3.964406875231864
CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(I)o1,C37320097_decoy,CXCR4,Decoy,0,-7.81504,-6.31,-2.74,-7.1891968054612185
COc1ccc2c(c1)=[NH+]C(=O)[C@H](CNc1ccc(N3CC[NH+](C)CC3)cc1)C=2,C38789849_decoy,CXCR4,Decoy,0,-7.65214,-6.7,-1.86,-3.401417883416129
COc1ccc(OCC[NH+]2CCN([C@H](C)C(=O)C3=c4ccccc4=[NH+][C@H]3C)CC2)cc1,C39736651_decoy,CXCR4,Decoy,0,-8.60548,-8.96,-1.7,-7.996038730552932
COc1ccc2c(c1)=C[C@@H]([C@H]1[NH2+]CCc3cc(OC)c(OC)cc31)C(=O)[NH+]=2,C40011053_decoy,CXCR4,Decoy,0,-7.84475,-9.51,-0.82,-9.870925889955672
COc1cc(C[NH2+]CC2CC[NH+](C)CC2)cc(Br)c1OC,C44516336_decoy,CXCR4,Decoy,0,-8.66198,-6.91,-2.63,-8.237871747613095
C[C@@H]1CCCC[NH+]1CCC[n+]1c(-c2ccccc2)csc1Nc1cc(F)ccc1F,C44944532_decoy,CXCR4,Decoy,0,-9.31007,-8.65,-1.44,-10.557939296672066
CCC[C@@H]1CC[NH+](Cc2cn(C3CC[NH+](C4CCOCC4)CC3)nn2)C1,C48121597_decoy,CXCR4,Decoy,0,-9.4471,-6.93,-2.59,-4.5325656606320885
Cc1ccc2[nH+]c(C[NH+]3CCN(c4ccc(C(F)(F)F)cn4)CC3)cc(=O)n2c1,C25572074_decoy,CXCR4,Decoy,0,-7.70255,-7.13,-3.24,-5.462720350519014
O=C(C[NH+]1CCC[C@@H]1c1ccsc1)NC[C@@H]1CC[NH+](CC(F)(F)F)C1,C51853071_decoy,CXCR4,Decoy,0,-8.33782,-8.32,-1.45,-3.865432532755328
C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)[NH+]1CCC([NH+]2CCCC2)CC1,C51952414_decoy,CXCR4,Decoy,0,-7.72073,-9.33,-1.37,-10.1712241886616
C[NH+](Cc1csc(Br)c1)CC1(C[NH2+]C2CC2)CCOCC1,C52197466_decoy,CXCR4,Decoy,0,-8.58457,-5.31,-2.11,-7.438874910237644
CCC[NH2+]Cc1occc1C[NH+](C)Cc1csc(Br)c1,C52547593_decoy,CXCR4,Decoy,0,-8.24394,-6.53,-1.57,-7.514967070125219
O[C@@H]1C[NH+](C/C=C/c2ccco2)CC[C@H]1N1CCN(c2cccc[nH+]2)CC1,C19732639_decoy,CXCR4,Decoy,0,-8.87542,-8.35,-1.61,-6.334815693919211
Cc1cc(C[NH2+]CCCn2cc[nH+]c2)c(C)n1-c1cccc2ccccc12,C12539871_decoy,CXCR4,Decoy,0,-9.52994,-8.57,-3.3,-10.019866208178833
Cc1ccc2c(c1)=[NH+][C@H](SCC(=O)N[C@H]1S[C@H]3CCCC3=C1C#N)[NH+]=2,C63068091_decoy,CXCR4,Decoy,0,-9.19048,-8.99,-1.53,-4.39055482523299
C[NH2+]C[C@@H]1CCCC[NH+]1Cc1cc(OC)c(OC)cc1Br,C63166425_decoy,CXCR4,Decoy,0,-8.16774,-6.31,-1.47,-8.194201367994038
Cc1ccc2c(c1)=C1S[C@H](C(=O)NCCC[NH+]3CCC(C)CC3)C=C1C(=O)[NH+]=2,C63494167_decoy,CXCR4,Decoy,0,-9.16997,-7.48,-3.16,-8.086533399170216
Cc1ccc2c(c1)=C1S[C@H](C(=O)NCCC[NH+]3[C@H](C)CCC[C@@H]3C)C=C1C(=O)[NH+]=2,C63494504_decoy,CXCR4,Decoy,0,-8.72148,-9.28,-3.61,-4.214329197197417
Cc1ccc(CNC(=O)C2CCN([C@@H]3[NH+]=c4ccc(Br)cc4=[NH+]3)CC2)o1,C63695670_decoy,CXCR4,Decoy,0,-7.8619,-8.24,-1.17,-6.62023248817027
Cc1ccc(CNC(=O)[C@H]2CCCN([C@@H]3[NH+]=c4ccc(Cl)cc4=[NH+]3)C2)o1,C63695961_decoy,CXCR4,Decoy,0,-8.87131,-8.4,-0.8,-7.795039406647724
C[C@@H](S[C@@H]1[NH+]=c2cc(Cl)cnc2=[NH+]1)C(=O)NC1(C#N)CCCCC1,C63731412_decoy,CXCR4,Decoy,0,-8.75573,-6.6,-2.27,-3.5164645321685497
C[C@@H](NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1)c1ccc2c(c1)OCCO2,C63751057_decoy,CXCR4,Decoy,0,-8.33551,-8.66,-1.2,-9.408818929916778
COc1ccc(C(=O)N2CCC[C@@H](C3[NH+]=c4ccccc4=[NH+]3)C2)cc1OC,C63767690_decoy,CXCR4,Decoy,0,-7.64311,-8.43,-2.49,-7.900914647112181
COc1ccc2c(c1)=[NH+][C@@H](CN1CN[C@H]3SC(c4ccccc4)=C[C@@H]3C1=O)[NH+]=2,C63856733_decoy,CXCR4,Decoy,0,-7.6893,-8.87,-1.23,-3.66990332350057
CC[NH+](Cc1noc(CC(C)C)n1)C[C@H]1C=c2ccc(F)cc2=[NH+]C1=O,C63872064_decoy,CXCR4,Decoy,0,-8.67426,-8.77,-1.09,-8.291292406597503
COc1ccccc1OCC(=O)N1CCC[C@H](C2[NH+]=c3ccccc3=[NH+]2)C1,C63967689_decoy,CXCR4,Decoy,0,-8.07767,-7.4,-1.96,-7.252081874755202
Cc1ccc2c(c1)=C(CC[NH2+][C@H]1CC(=O)N(c3ccc(Br)cc3)C1=O)C[NH+]=2,C63980235_decoy,CXCR4,Decoy,0,-8.93048,-8.79,-1.36,-7.917800778280199
Cc1ccn(CCC(=O)N2CCC[C@@H]2[C@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)n1,C64066700_decoy,CXCR4,Decoy,0,-8.65685,-8.32,-0.89,-8.662895380717382
O=C(Nc1ccc([C@H]2C=c3ccccc3=[NH+]2)cc1)[C@@H]1CCC[NH+]1C1CCOCC1,C64066937_decoy,CXCR4,Decoy,0,-8.55625,-9.16,-2.62,-5.987809264839951
CC(C)[C@H]1Nc2cc(C(=O)N(C)CCC3[NH+]=c4ccccc4=[NH+]3)ccc2O1,C64093332_decoy,CXCR4,Decoy,0,-8.36329,-7.45,-4.13,-5.0454281722884575
O=C(CC1=c2ccccc2=[NH+]C1)N1CCC[C@@H]([C@H]2[NH+]=C(c3ccc(Cl)cc3)NO2)C1,C64128616_decoy,CXCR4,Decoy,0,-9.08021,-10.62,-0.97,-4.15772935757024
COc1ccc2c(c1)=C(C)[C@H](CN1CC[NH+](CC(C)C)[C@H](CCO)C1)[NH+]=2,C64157890_decoy,CXCR4,Decoy,0,-8.76177,-8.39,-1.07,-8.925917190859456
O=C1C[C@H]([NH2+]CCC2=c3ccccc3=[NH+]C2)C(=O)N1c1cccc(C(F)(F)F)c1,C64165796_decoy,CXCR4,Decoy,0,-8.56011,-10.28,-2.38,-8.941818220064821
COc1ccc(CC(=O)N2CCC[C@H]2C2[NH+]=c3ccccc3=[NH+]2)c(OC)c1,C64380856_decoy,CXCR4,Decoy,0,-6.50411,-9.18,-3.97,-7.680535038711994
O=C(NCCC1=c2cc(Cl)ccc2=[NH+]C1)[C@@H]1CCCN(c2cc[nH+]cc2)C1,C64541290_decoy,CXCR4,Decoy,0,-8.78924,-6.65,-1.15,-6.5107449556757455
c1ccc(-n2cc(C[NH2+]CCC3=c4ccccc4=[NH+]C3)c(-c3ccncc3)n2)cc1,C64705044_decoy,CXCR4,Decoy,0,-8.30334,-9.32,-4.79,-8.525447004334074
CN(CC(=O)c1ccc2c(c1)=[NH+]C(=O)[NH+]=2)Cc1cccc(Cl)c1Cl,C39756384_decoy,CXCR4,Decoy,0,-7.031,-8.34,-1.7,-6.3127220807640665
CC(C)[NH+](C)Cc1ccccc1C[NH2+]Cc1cn(C)nc1-c1cccnc1,C67187986_decoy,CXCR4,Decoy,0,-8.71419,-7.72,-1.18,-12.783447473167616
COc1ccc(OC)c(C[NH2+][C@H](C)c2ccc(N3CC[NH+](C)CC3)cc2)c1,C67250888_decoy,CXCR4,Decoy,0,-8.58213,-7.59,-3.64,-7.702085478971882
O=C(C[NH+]1CCN(c2cccc[nH+]2)CC1)N1N=C(c2cccs2)C[C@H]1c1cccs1,C09050103_decoy,CXCR4,Decoy,0,-9.53192,-8.33,-1.27,-7.634832583413497
COc1ccc(F)c(C[NH+]2CCC[C@]3(CC[NH+](C4CCSCC4)C3)C2)c1,C11933280_decoy,CXCR4,Decoy,0,-9.65467,-7.79,-4.64,-3.964795751550164
O=C(NC[C@H]1CCCO1)C1CC[NH+](C2CC[NH+](CC#Cc3ccccc3)CC2)CC1,C12465238_decoy,CXCR4,Decoy,0,-9.7513,-7.09,-2.8,-6.6649558000159
CC[C@@H](C)[NH+]1CCC2(CC1)C(=O)N(CC[NH+](C)C)C(=O)N2CCC(C)C,C14731656_decoy,CXCR4,Decoy,0,-8.29522,-6.84,-1.03,-11.993208295966529
Cc1[nH+]ccn1CC1CC[NH+](Cc2c(-c3ccc(F)cc3)nc3sccn23)CC1,C19715784_decoy,CXCR4,Decoy,0,-9.31015,-7.9,-1.39,-9.7033124230983
Cc1cccc(C(=O)N2CC[NH+](CC/[NH+]=c3\cc(O)oc4ccccc34)CC2)c1,C22472398_decoy,CXCR4,Decoy,0,-8.22678,-6.9,-3.76,-6.251782100976573
COC(=O)[C@H]1[NH+]=c2ccc(C)cc2=C1NC(=O)C[NH+]1CCCC(C)(C)C1,C38597051_decoy,CXCR4,Decoy,0,-8.89886,-8.63,-0.73,-11.654753575524568
COC(=O)[C@H]1[NH+]=c2ccc(C)cc2=C1NC(=O)[C@@H](C)[NH+]1CCCC(C)(C)C1,C38604956_decoy,CXCR4,Decoy,0,-8.54179,-8.63,-1.72,-4.176844368928643
CC[NH+](CC)CCn1c2c(c(SC[C@H]3CCCC[NH+]3C)nc1=O)CCC2,C38786513_decoy,CXCR4,Decoy,0,-9.28984,-6.3,-2.68,-4.002065699767132
COc1ccc([NH+]2CCN([C@@H]3CCC[NH+](C4CCOCC4)C3)CC2)cc1,C22851598_decoy,CXCR4,Decoy,0,-9.45809,-7.54,-2.3,-6.766436897401808
O=C1[NH+]=c2ccccc2=[NH+][C@H]1c1ccccc1NS(=O)(=O)c1ccccc1,C39404663_decoy,CXCR4,Decoy,0,-7.1767,-9.04,-1.24,-7.858585995491386
COCCNc1c([C@H]2C=c3cc(C)ccc3=[NH+]C2=O)[nH+]c2cc(C)ccn12,C39697738_decoy,CXCR4,Decoy,0,-8.52585,-8.76,-1.67,-4.148442792248495
C[C@H](OC(=O)C1=c2ccccc2=[NH+]C(=O)C1)C(=O)C1=c2ccccc2=[NH+]C1,C39726988_decoy,CXCR4,Decoy,0,-7.56795,-8.29,-1.8,-7.691982068793919
C[NH+](C)CCCSC1=N[C@@H]2[NH+]=c3ccc(Br)cc3=C2N=N1,C39777966_decoy,CXCR4,Decoy,0,-9.21141,-6.7,-1.21,-7.450419117785804
Cc1nc(-c2cccs2)cc([C@H]2C[NH+]3CC[C@@H]2C[C@@H]3C[NH2+]Cc2ccco2)n1,C43527978_decoy,CXCR4,Decoy,0,-8.56614,-8.3,-3.16,-3.840730140477718
COc1c(Br)cc(Br)cc1C[NH2+]CCCCn1cc[nH+]c1,C44353322_decoy,CXCR4,Decoy,0,-8.62748,-7.05,-0.98,-7.457992999075275
Cc1cc(=O)oc2c3c(c(Cl)cc12)OC[NH+](CCCn1cc[nH+]c1)C3,C39232480_decoy,CXCR4,Decoy,0,-8.91118,-8.71,-1.19,-8.379473504403652
C[NH2+]Cc1cc(Br)c(OCCC[NH+]2CCCC2)c(OC)c1,C49332011_decoy,CXCR4,Decoy,0,-8.249,-5.6,-1.05,-8.570793861731289
COc1cc2c(cc1OC)[C@H](C)[NH+](Cc1cc(=O)n3cc(C)ccc3[nH+]1)CC2,C49749954_decoy,CXCR4,Decoy,0,-8.62913,-7.97,-2.86,-6.514935799025123
CC[NH+](C)CC[NH2+]Cc1cc(Br)cc(Br)c1OC,C49938290_decoy,CXCR4,Decoy,0,-8.91107,-6.42,-0.82,-10.017776918345277
Cc1oc(C[NH+](C)Cc2csc(Br)c2)cc1C[NH2+]C(C)C,C52547576_decoy,CXCR4,Decoy,0,-9.15842,-6.29,-5.32,-6.96539648587011
CC[NH2+]Cc1oc(C[NH+](C)Cc2csc(Br)c2)cc1C,C52547718_decoy,CXCR4,Decoy,0,-9.4006,-6.47,-2.88,-7.082108947664841
CC[NH+]1CCN(C(=O)CCC2CC[NH+](C[C@H]3CCOC(C)(C)C3)CC2)CC1,C11949913_decoy,CXCR4,Decoy,0,-9.68253,-6.77,-4.06,-7.828883994853159
CC(C)[C@H](C[NH2+]Cc1ccc(Br)s1)N1CC[NH+](C)CC1,C40435586_decoy,CXCR4,Decoy,0,-9.21175,-6.17,-1.55,-12.499329866664722
Cc1ccc(S(=O)(=O)Nc2ccc(N3CC[NH+](C)CC3)[nH+]c2)c(C)c1,C11857352_decoy,CXCR4,Decoy,0,-8.86971,-7.81,-2.98,-6.753552509393114
CC[NH+]1CCC[C@@H]1CN(Cc1ccc(OC)c(OC)c1)C1=[NH+]CCCS1,C17077282_decoy,CXCR4,Decoy,0,-8.73592,-7.52,-1.14,-8.951254262275164
Cc1ccc(Cn2nc(C)c(C[NH2+]C[C@H](C)Cn3cc[nH+]c3)c2Cl)cc1,C62254422_decoy,CXCR4,Decoy,0,-8.13556,-7.07,-2.37,-7.079722614400866
C[NH2+]CC1CC[NH+](Cc2cc(Br)c(Br)o2)CC1,C63159124_decoy,CXCR4,Decoy,0,-8.80625,-5.53,-0.63,-8.447121290935089
COCC/[NH+]=C1\SC[C@@H](c2ccco2)N1/N=C/C1=c2ccccc2=[NH+]C1,C39946660_decoy,CXCR4,Decoy,0,-8.55167,-6.3,-1.97,-3.409482035446327
Cc1cc(C)cc(N2C(=O)C[C@@H]([NH2+]CCC3=c4ccccc4=[NH+]C3)C2=O)c1,C63330616_decoy,CXCR4,Decoy,0,-9.01775,-7.5,-1.53,-8.222426553181956
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](C[NH2+]CCC4=c5ccccc5=[NH+]C4)[C@H]3[C@@H]3O[C@@]132,C63375679_decoy,CXCR4,Decoy,0,-8.78811,-9.52,-1.66,-8.112996332317014
CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1C=c2ccccc2=[NH+]C1=O)Cc1ccccc1,C63405646_decoy,CXCR4,Decoy,0,-8.40602,-7.84,-1.59,-8.08641827955881
C=CCn1c(=S)sc2c(SC3[NH+]=c4ccccc4=[NH+]3)ncnc21,C63598669_decoy,CXCR4,Decoy,0,-8.68526,-6.57,-0.91,-6.324314281446803
CCC[NH+]1CCN(C(=O)[C@@H](C)C2CCN(C(=O)[C@@H]3C=c4cc(Cl)ccc4=[NH+]3)CC2)CC1,C63739593_decoy,CXCR4,Decoy,0,-8.29313,-7.14,-2.95,-3.3152858005815173
O=C(Nc1ccc(SC[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1)c1ccco1,C63751697_decoy,CXCR4,Decoy,0,-8.02661,-9.14,-2.98,-3.861385801491569
COc1ccc2c(c1)=C(C)[C@@H](CN1CC[NH+](CCC(C)C)[C@H](CCO)C1)[NH+]=2,C64006490_decoy,CXCR4,Decoy,0,-9.5508,-8.75,-0.7,-8.743887203092827
COc1ccc(F)c(C[NH+]2CCC[C@]3(CCN(C(=O)[C@@H]4C=c5ccccc5=[NH+]4)C3)C2)c1,C64015334_decoy,CXCR4,Decoy,0,-8.47411,-10.12,-1.21,-7.291326403798982
COc1ccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2Cc2[nH]cc[nH+]2)c(F)c1,C64031791_decoy,CXCR4,Decoy,0,-8.91918,-7.16,-2.1,-7.706580578728032
CCN(Cc1ccc(Cl)s1)C(=O)c1ccc2c(c1)=[NH+]C(=O)C(=O)[NH+]=2,C64042846_decoy,CXCR4,Decoy,0,-8.04807,-7.02,-2.36,-6.382903163206976
O=C1[NH+]=c2ccc(S(=O)(=O)NCC3(c4ccccc4)CCCC3)cc2=[NH+]1,C32865575_decoy,CXCR4,Decoy,0,-9.62765,-11.14,-2.04,-4.600056320219482
CC[C@@H]1[C@@H](C(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3C2)C(=O)C=C(C)N1C[C@@H]1CCC[NH+]1CC,C64640541_decoy,CXCR4,Decoy,0,-10.0171,-8.84,-1.7,-9.576506566792665
CC(=O)Oc1c(C)cc(C[NH2+]C[C@H]2C=c3ccc(F)cc3=[NH+]C2=O)cc1C,C65398126_decoy,CXCR4,Decoy,0,-8.36221,-9.2,-2.54,-7.021879097712938
Cc1ccccc1-n1nc(C)c(C[NH+](C)Cc2cn3ccccc3[nH+]2)c1C,C65604140_decoy,CXCR4,Decoy,0,-7.69963,-7.92,-2.05,-7.41930301500087
Brc1cc(C[NH2+]CCCC[NH+]2CCCC2)cc2c1OCCCO2,C65932052_decoy,CXCR4,Decoy,0,-9.66346,-8.09,-0.61,-12.730840007352183
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)N1CC[C@@H]([NH+]2CCCC2)C1,C66175189_decoy,CXCR4,Decoy,0,-9.13246,-7.16,-1.45,-7.823352427048278
C[C@@H](NC(=O)N1CC[C@H]([NH+]2CCCC2)C1)c1ccc(N2CC[NH+](C)CC2)cc1,C66188458_decoy,CXCR4,Decoy,0,-9.46985,-6.34,-3.89,-6.408052172394624
C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1cccc(OCc2ccccc2C#N)c1,C66906052_decoy,CXCR4,Decoy,0,-8.35004,-7.79,-2.83,-7.832510723706862
O=C(C[NH+]1CCC[C@@H]1Cc1cccc(F)c1)NC1CC[NH+](C2CC2)CC1,C66962006_decoy,CXCR4,Decoy,0,-8.75879,-8.17,-1.79,-9.612464500143156
CCc1nc(C[NH2+][C@@H](C)c2ccc(N3CC[NH+](C)CC3)c(F)c2)cs1,C67248956_decoy,CXCR4,Decoy,0,-8.83876,-6.48,-1.42,-6.61426291883493
C[C@H]([NH2+]Cc1cccc2c1OCCO2)c1ccc(N2CC[NH+](C)CC2)cc1,C67250605_decoy,CXCR4,Decoy,0,-8.66413,-7.79,-2.0,-8.318927580760539
C[NH+]1CCC=C(c2nsnc2SCCCSc2nsnc2C2=CCC[NH+](C)C2)C1,C01536411_decoy,CXCR4,Decoy,0,-11.5441,-7.23,-2.71,-11.8318341664678
O=c1c(-c2ccccc2C[NH+]2CCOCC2)ccc2n1C[C@H]1C[C@@H]2C[NH+](CC2CCCCC2)C1,C08296436_decoy,CXCR4,Decoy,0,-10.4781,-7.16,-3.2,-6.771010776707977
COc1ccc(F)c(C[NH+](CC2CC[NH+](C3CCCC3)CC2)C[C@@H]2CCCO2)c1,C12373014_decoy,CXCR4,Decoy,0,-10.3014,-7.59,-1.8,-8.978720036650685
CC[NH+]1CCN(C(=O)c2ccc(C[NH+]3CCn4cccc4[C@H]3c3ccccc3Cl)o2)CC1,C35523312_decoy,CXCR4,Decoy,0,-8.5985,-5.89,-3.53,-3.0788047232084
Cc1cc(N2CC[NH+](CC(=O)Nc3ccc(Cl)cc3F)CC2)nc(C(C)C)[nH+]1,C12807552_decoy,CXCR4,Decoy,0,-9.50536,-9.29,-2.66,-7.847551547171486
Fc1ccccc1CN1C[C@@H](/C=N/NC2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C38690081_decoy,CXCR4,Decoy,0,-8.59446,-8.32,-2.68,-8.218645237569739
CCN(C[C@H]1C=c2cc(C)ccc2=[NH+]C1=O)c1ccc(N2CC[NH+](C)CC2)cc1,C38790068_decoy,CXCR4,Decoy,0,-8.19372,-8.62,-1.28,-8.131762471101515
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@H](C)N1CC[NH+](C/C=C/c2ccccc2)CC1,C39164080_decoy,CXCR4,Decoy,0,-8.29948,-9.21,-2.48,-8.092097012184732
Cn1nc(C(=O)N2CCCC2)c2c1CC[C@@H]([NH2+]CC1([NH+]3CCCCC3)CCCCC1)C2,C32533090_decoy,CXCR4,Decoy,0,-9.64454,-8.65,-1.24,-8.957177968425158
Cc1ccc(OCCN(C)C(=O)[C@H]2CC23CC[NH+](C[C@H]2C=c4ccccc4=[NH+]C2=O)CC3)cc1,C39412701_decoy,CXCR4,Decoy,0,-8.76084,-9.36,-1.45,-7.346158468067742
CCc1cccc2c1=[NH+]CC=2C(=O)CS[C@H]1N=N[C@@H]([C@@H](C)[NH+](C)C)N1c1ccc(F)cc1,C39457974_decoy,CXCR4,Decoy,0,-8.97941,-8.81,-1.79,-7.735371783754529
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C[C@H](c2ccc(-c3ccccc3)cc2)[NH+]=N1,C39707961_decoy,CXCR4,Decoy,0,-9.3973,-10.53,-4.66,-10.257877372563865
C[NH+](C)C[C@H](N[C@@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1)c1ccccc1,C39730270_decoy,CXCR4,Decoy,0,-8.45578,-7.76,-2.14,-8.608075899422957
C[C@@H](NC(=O)CC[C@@H]1[NH+]=c2ccccc2=[NH+]C1=O)c1ccc(-c2ccccc2)cc1,C39745837_decoy,CXCR4,Decoy,0,-7.81147,-8.37,-1.89,-7.017901079611119
CC1=CN2C(=N[C@@H]([C@@H]3C=c4cc(C)cc(C)c4=[NH+]C3=O)[C@@H]2[NH2+]Cc2ccco2)C=C1,C39980683_decoy,CXCR4,Decoy,0,-8.0336,-8.37,-2.92,-6.755904110305928
COc1ccc2c(c1)=[NH+]C(=O)[C@H]([C@@H]1N=C3C=CC(C)=CN3[C@H]1[NH2+]Cc1ccccc1)C=2,C40011174_decoy,CXCR4,Decoy,0,-8.34855,-8.86,-2.56,-8.682280474451973
c1cc(C[NH+](CC2CC[NH+](C3CCCC3)CC2)C[C@H]2CCCO2)c2c(c1)OCO2,C42936059_decoy,CXCR4,Decoy,0,-9.30379,-8.58,-2.54,-5.164899487647395
Cc1c(Cc2ccccc2)c(=O)oc2c3c(c(Cl)cc12)OC[NH+](CCCn1cc[nH+]c1)C3,C38776370_decoy,CXCR4,Decoy,0,-7.3426,-7.53,-1.37,-6.335345747299603
C[C@@H](O)c1ccc(N2CCN(c3[nH+]nc(Cc4ccccc4)c4ccccc34)CC2)[nH+]c1,C45484440_decoy,CXCR4,Decoy,0,-10.13,-8.91,-2.21,-7.913883529062268
COc1c(Br)cc(Br)cc1C[NH2+][C@H](C)CC[NH+](C)C,C49554042_decoy,CXCR4,Decoy,0,-8.95645,-5.8,-2.54,-7.9629776059739745
CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1cc(Br)c(Br)o1,C50360648_decoy,CXCR4,Decoy,0,-8.96823,-6.88,-2.96,-9.458772566017451
C[C@H](C[NH2+]Cc1cc(Br)c(Br)o1)C[NH+]1CCCCC1,C50361059_decoy,CXCR4,Decoy,0,-8.86832,-7.16,-2.62,-7.037219846460668
COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)cc1Cl,C63098840_decoy,CXCR4,Decoy,0,-9.9895,-7.99,-2.3,-7.976314683449978
C[C@H](C(=O)Nc1ccc(OC(F)F)cc1)[NH+]1CCC(C2=c3ccccc3=[NH+]C2)CC1,C63098874_decoy,CXCR4,Decoy,0,-8.41375,-7.75,-1.33,-7.839819641611494
O=C(CC1=c2ccccc2=[NH+]C1)NC[C@@H](C1=c2ccccc2=[NH+]C1)c1cccs1,C63110619_decoy,CXCR4,Decoy,0,-9.2609,-9.71,-3.31,-8.958736968395687
C/C(=N/NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1)c1cccc(Br)c1,C63135124_decoy,CXCR4,Decoy,0,-8.46407,-9.52,-1.9,-8.228458479310433
CC[NH+]1CCN(c2ccc(NC(=O)CCCC3=c4ccccc4=[NH+]C3)cc2C)CC1,C63135283_decoy,CXCR4,Decoy,0,-8.89446,-9.64,-4.67,-8.616984478713624
CC1=c2ccccc2=[NH+]C(=O)[C@@H]1Sc1nnc(S[C@H]2C(=O)[NH+]=c3ccccc3=C2C)s1,C39933447_decoy,CXCR4,Decoy,0,-9.72179,-10.54,-3.36,-9.370806186233564
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)Nc1cccc(I)c1,C63233123_decoy,CXCR4,Decoy,0,-8.44361,-7.17,-0.98,-6.797159937137423
COc1cc(/C=N/c2ccccc2C2[NH+]=c3ccccc3=[NH+]2)cc(OC)c1OC,C63393876_decoy,CXCR4,Decoy,0,-6.47561,-7.82,-1.48,-6.3236346637543885
O=C(CSC1[NH+]=c2ccccc2=[NH+]1)N/N=C/c1ccc(Br)cc1,C63462839_decoy,CXCR4,Decoy,0,-7.20797,-6.34,-1.42,-5.919489007023447
O=C(NCc1cccc(Br)c1)C1CCN(C2[NH+]=c3ccccc3=[NH+]2)CC1,C63505940_decoy,CXCR4,Decoy,0,-9.12055,-8.05,-1.41,-7.836522498342917
C[NH+]1CCN(CCNC(=O)[C@@H]2[NH+]=c3ccccc3=C2Sc2ccc(Cl)cc2)CC1,C63530459_decoy,CXCR4,Decoy,0,-9.26207,-7.74,-2.38,-7.761956344078847
O=C1c2sccc2N[C@@H](SCC2[NH+]=c3ccccc3=[NH+]2)N1Cc1ccccc1F,C63709745_decoy,CXCR4,Decoy,0,-8.27318,-9.01,-2.5,-8.720954308260325
O=C(CC1=c2ccccc2=[NH+][C@@H]1Sc1ccccc1F)N1CCN(c2cccc[nH+]2)CC1,C63743318_decoy,CXCR4,Decoy,0,-9.06761,-9.7,-1.22,-9.402823798711005
CCC[NH+]1CCN(C(=O)CC2=c3ccccc3=[NH+][C@H]2Sc2cccc(F)c2)CC1,C63743407_decoy,CXCR4,Decoy,0,-8.40606,-8.11,-0.88,-7.551473875153551
Cc1cc2c(cc1C)=[NH+][C@@H](CSc1ccc(NC(=O)c3ccco3)cc1)C(=O)[NH+]=2,C63751571_decoy,CXCR4,Decoy,0,-8.80114,-8.86,-4.11,-10.726495296220085
Cc1ccc(C(=O)Nc2ccc(SC[C@@H]3[NH+]=c4ccccc4=[NH+]C3=O)cc2)cc1,C63751692_decoy,CXCR4,Decoy,0,-8.44782,-8.04,-2.97,-6.745423935146867
O=C(Nc1ccc(SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1)c1ccccc1F,C63751810_decoy,CXCR4,Decoy,0,-8.6941,-7.46,-2.71,-6.904889756935901
Cc1ccsc1C(=O)Nc1ccc(SC[C@@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1,C63751828_decoy,CXCR4,Decoy,0,-8.85218,-9.5,-3.02,-8.591381137491377
Cc1cc(C)c(NC(=O)C[NH+](C)Cc2nc(C3=c4ccccc4=[NH+][C@H]3C)cs2)c(C)c1,C63842619_decoy,CXCR4,Decoy,0,-8.79062,-9.99,-1.76,-8.535440170857495
CCOc1cc(C[NH2+]C[C@H]2C=c3ccc(F)cc3=[NH+]C2=O)cc(Cl)c1OCC,C63856125_decoy,CXCR4,Decoy,0,-9.63246,-8.59,-1.75,-4.438841945447288
O=C(CC[NH+]1Cc2ccccc2O[C@H](c2ccccc2)C1)NCCC1=c2ccccc2=[NH+]C1,C64006308_decoy,CXCR4,Decoy,0,-9.1002,-8.64,-1.34,-8.059738717344658
Cc1[nH+]ccn1CCC(=O)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@H]1C1CCCCC1,C64031673_decoy,CXCR4,Decoy,0,-8.48315,-9.2,-2.55,-10.582501568579325
O=C1CC[C@@H]2C[NH+](C[C@H]3C=c4ccccc4=[NH+]3)CC[C@@H]2N1Cc1cccc(C(F)(F)F)c1,C64040328_decoy,CXCR4,Decoy,0,-7.9198,-10.0,-2.07,-8.42742913748273
COc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2Cc2[nH]cc[nH+]2)c(C)c1C,C64053312_decoy,CXCR4,Decoy,0,-7.4494,-9.78,-2.54,-8.116021287328186
O=C(CC1=c2ccccc2=[NH+][C@@H]1Sc1ccccc1)N1CCN(c2cccc[nH+]2)CC1,C64518786_decoy,CXCR4,Decoy,0,-8.34361,-8.27,-2.05,-9.911923036820324
CCn1cc[nH+]c1CN1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1c1ccc(OC)c(C)c1C,C64636335_decoy,CXCR4,Decoy,0,-8.81797,-9.15,-0.98,-9.70013829630696
CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1,C67188422_decoy,CXCR4,Decoy,0,-7.73005,-7.32,-2.13,-6.797905808061861
C[C@@H]([NH2+]Cc1csc(Br)c1)c1ccc(N2CC[NH+](C)CC2)cc1,C67250632_decoy,CXCR4,Decoy,0,-9.34234,-7.32,-1.28,-7.340790044061532
C[C@@H]([NH3+])C(=O)N1CCOCCN(C(=O)[C@@H](C)[NH3+])CCOCC1,C04718918_decoy,CXCR4,Decoy,0,-7.58408,-7.24,-1.18,-3.2985132783853413
O=C(Nc1ccc(C2=[NH+]CCN2)cc1)c1cccc(NC(=S)Nc2ccc(C3=[NH+]CCN3)cc2)c1,C01691355_decoy,CXCR4,Decoy,0,-12.1408,-7.88,-1.07,-9.831715882378424
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCc2cccc([N+](=O)[O-])c2)c1,C03954275_decoy,CXCR4,Decoy,0,-9.29076,-8.86,-2.84,-4.11087226734202
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(CCCCc2cccc(N)c2)c1,C08627517_decoy,CXCR4,Decoy,0,-9.39113,-8.91,-2.83,-8.105231259116335
C[C@H]1CNC(c2ccc(NC(=O)c3ccc(C(=O)Nc4ccc(C5=[NH+]C[C@@H](C)CN5)cc4)nc3)cc2)=[NH+]C1,C17354606_decoy,CXCR4,Decoy,0,-8.88306,-6.18,-3.56,-5.5512230350700165
COC[C@H]1CCC[NH+]1[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1C[NH2+]C1CCOCC1,C20465328_decoy,CXCR4,Decoy,0,-7.17455,-6.28,-2.87,-3.1573262101147
COc1ccc([C@@H](C[NH3+])[NH+](C)CCO)cc1OCC[NH+](C)C,C32069796_decoy,CXCR4,Decoy,0,-7.67256,-6.25,-1.91,-7.909280759397991
CC[NH+]1CCN([C@H](C[NH3+])c2cc(Cl)c(O)c(OC)c2)CC1,C32070916_decoy,CXCR4,Decoy,0,-8.74883,-7.31,-2.69,-8.790481749037697
Cc1ccc(COc2ccc([C@@H](C[NH3+])[NH+](C)CCO)cc2)cc1,C32071075_decoy,CXCR4,Decoy,0,-7.24377,-7.08,-1.82,-6.036812090551085
Cc1ccccc1COc1ccc([C@H](C[NH3+])[NH+](C)CCO)cc1,C32071099_decoy,CXCR4,Decoy,0,-8.03781,-7.75,-1.34,-8.147391351580014
CCCC[NH+](CC)[C@H](C[NH3+])c1cc(Cl)c(O)c(OCC)c1,C32071400_decoy,CXCR4,Decoy,0,-8.72698,-6.87,-0.55,-8.916172239361364
COc1cc(Br)cc([C@@H](C[NH3+])[NH+]2CCCC2)c1O,C32071428_decoy,CXCR4,Decoy,0,-8.50691,-6.72,-3.53,-3.3545960595211195
CCC[NH+](CCC)[C@H](C[NH3+])c1cc(Br)ccc1O,C32071467_decoy,CXCR4,Decoy,0,-7.71682,-6.03,-3.2,-3.555833040137455
CC[NH+]([C@H](C[NH3+])c1cc(Br)ccc1O)C(C)(C)C,C32071489_decoy,CXCR4,Decoy,0,-8.48565,-6.63,-3.68,-9.250903370729102
COC(=O)c1ccc(-c2ccc(C[NH2+]CC[NH2+]CCO)o2)cc1,C38245881_decoy,CXCR4,Decoy,0,-8.32702,-7.09,-1.72,-4.072131901965745
CCOC(=O)[C@H]1[NH+]=c2ccc(OC)cc2=C1NC(=O)[C@@H](C)[NH+]1CCC(C(N)=O)CC1,C38605476_decoy,CXCR4,Decoy,0,-9.14321,-8.27,-2.37,-4.066698785326773
CCOC(=O)[C@H]1[NH+]=c2ccc(OC)cc2=C1NC(=O)[C@H](C)[NH+]1CCC(C(N)=O)CC1,C38605482_decoy,CXCR4,Decoy,0,-9.29074,-7.28,-3.2,-4.010813230340253
Cc1ccc2c(c1)=[NH+][C@@H](C1=C(N)N(c3ccc(C(N)=O)cc3)CC1=O)[NH+]=2,C38819061_decoy,CXCR4,Decoy,0,-8.6765,-9.46,-1.9,-6.700599127617576
[NH3+]C1C[C@H]2CC[C@@H](C1)[NH+]2Cc1c[nH]c2ccc(Br)cc12,C40749436_decoy,CXCR4,Decoy,0,-8.82938,-7.89,-0.56,-9.46578161314093
CCCC[NH+](CC(N)=O)[C@H](c1ccc(Cl)cc1)[C@H]([NH3+])CC,C42947070_decoy,CXCR4,Decoy,0,-8.40536,-6.68,-1.44,-8.817984398151204
CCCC[NH+](CCO)[C@H](C[NH3+])c1ccc(Br)cc1,C42954613_decoy,CXCR4,Decoy,0,-8.08253,-6.41,-1.22,-7.913199352628884
CC[C@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](CC(N)=O)C(C)C,C42955142_decoy,CXCR4,Decoy,0,-7.38278,-6.85,-1.58,-8.174177356751747
CC[C@@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@H](O)COC,C42955319_decoy,CXCR4,Decoy,0,-9.08005,-5.67,-2.37,-3.776707090704081
CC[C@@H]([NH3+])[C@H](c1ccc(Br)cc1)[NH+](C)C[C@H](O)COC,C42955325_decoy,CXCR4,Decoy,0,-7.39704,-5.77,-1.52,-7.813237123113174
NC(=[NH2+])c1ccc(OCCCCCOc2ccc(C(N)=[NH2+])cn2)nc1,C43060190_decoy,CXCR4,Decoy,0,-10.7582,-7.81,-4.35,-3.59945530281145
CCCC[C@@H]([NH3+])c1nc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)co1,C43210015_decoy,CXCR4,Decoy,0,-9.72244,-6.87,-0.92,-8.177075887154324
CC(C)C[NH+](CCC(N)=[NH2+])Cc1cccc(Br)c1,C43423033_decoy,CXCR4,Decoy,0,-7.97762,-6.46,-2.99,-9.47628032449987
CC(C)C[NH+](CCC(N)=[NH2+])Cc1ccc(Br)cc1,C43423044_decoy,CXCR4,Decoy,0,-7.6427,-5.93,-1.61,-8.193502575199552
CC[C@@H]([NH3+])Cc1cc(C(=O)OC)c2cccc(C[C@@H]([NH3+])CC)n12,C44405661_decoy,CXCR4,Decoy,0,-8.16006,-8.09,-2.0,-9.81261287605293
C[C@@H]([NH3+])[C@@H](c1ccc(Br)s1)[NH+](CCO)CCO,C43261272_decoy,CXCR4,Decoy,0,-8.59575,-5.33,-0.75,-8.308326509459654
COc1cc(C[NH2+]CC[NH2+]C[C@@H](C)O)cc(Br)c1OC,C20500230_decoy,CXCR4,Decoy,0,-8.0649,-7.18,-4.3,-3.9071290334905617
CC[NH2+][C@@H](C[NH3+])c1cc(Br)c2c(c1)OCCCO2,C50270288_decoy,CXCR4,Decoy,0,-9.29953,-7.59,-0.06,-11.409615211190662
CC(C)[NH2+][C@H](C[NH3+])c1cc(Br)c2c(c1)OCCO2,C50270970_decoy,CXCR4,Decoy,0,-8.54637,-6.97,-0.66,-9.893392964508427
[NH3+]C1CCC([NH2+][C@@H]2CCS(=O)(=O)c3ccc(F)cc32)CC1,C51692849_decoy,CXCR4,Decoy,0,-8.4815,-8.6,-4.31,-3.546362822202012
CC[C@H]([NH3+])[C@@H](c1ccc(Br)cc1)[NH+](C)C[C@@H](C)O,C51817405_decoy,CXCR4,Decoy,0,-8.76662,-6.89,-1.54,-8.078144946172797
C[C@@H]([NH3+])C(=O)N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)N1CCC2(CCc3ccccc32)CC1,C52594508_decoy,CXCR4,Decoy,0,-10.0048,-9.47,-2.28,-10.890376804365827
COc1cc(OC)cc([C@H](Nc2cc(C)[nH+]c(N)n2)c2[nH+]ccn2C)c1,C54104321_decoy,CXCR4,Decoy,0,-9.69744,-7.39,-1.74,-8.853442848066702
C[C@H](C[NH3+])N1C(=O)NC2(CC[NH+](CC[NH+]3CCCC3)CC2)C1=O,C57845837_decoy,CXCR4,Decoy,0,-7.85051,-7.67,-2.02,-3.6102040680651
Cc1ccc2c(c1)=[NH+][C@H](SCC(=O)Nc1nnc(SCC(N)=O)s1)[NH+]=2,C63302030_decoy,CXCR4,Decoy,0,-8.93259,-8.02,-2.17,-8.315007493726613
CCN(CC)C(=O)CS[C@H]1NN[C@H]([C@@H]([NH3+])CC2=c3ccccc3=[NH+]C2)O1,C63684370_decoy,CXCR4,Decoy,0,-9.35622,-8.41,-1.87,-4.212241896388516
NN1C(SCC2[NH+]=c3ccccc3=[NH+]2)=NN[C@H]1c1ccncc1,C63744020_decoy,CXCR4,Decoy,0,-7.96846,-8.82,-2.62,-3.750446212748091
Cc1cc(=O)[nH]c(NCC[NH2+]C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)n1,C63856384_decoy,CXCR4,Decoy,0,-8.88373,-7.95,-1.55,-8.177929781502526
NC(=O)C1([NH+]2CCCCC2)CCN(C[C@]2(O)CCC[NH+]3CCCC[C@@H]32)CC1,C63857432_decoy,CXCR4,Decoy,0,-10.0074,-8.07,-1.96,-3.810296930930732
O=C(CN1C(=O)c2ccccc2N[C@H]1O)NC1[NH+]=c2ccccc2=[NH+]1,C64197151_decoy,CXCR4,Decoy,0,-7.20376,-7.5,-2.17,-3.03354420635786
Cc1cccc2c1=[NH+][C@H](CN(C)C(=O)CN1N[NH2+]N[C@H]1C[NH+](C)C(C)C)[NH+]=2,C64651179_decoy,CXCR4,Decoy,0,-7.85739,-9.03,-1.03,-8.403289367262035
N[C@@H](C(=O)N1CCN2NC(C3[NH+]=c4ccccc4=[NH+]3)=C[C@@H]2C1)c1ccccc1,C65385781_decoy,CXCR4,Decoy,0,-8.25882,-10.1,-2.66,-8.800685862760385
C=CC/[NH+]=C(\N)NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1,C66243008_decoy,CXCR4,Decoy,0,-9.29934,-7.69,-1.58,-9.04547969874616
Cc1nn(CCO)c(C)c1C[NH2+]C[C@@H](O)C[NH+]1CCC(C)CC1,C67122213_decoy,CXCR4,Decoy,0,-8.74539,-7.09,-4.13,-9.140407099192869
CC1CC[NH+](C[C@H](O)CNC(=O)NC2CC[NH+](C3CC3)CC2)CC1,C67612936_decoy,CXCR4,Decoy,0,-8.73063,-7.07,-2.34,-3.63713121906244
CC1CC[NH+](CCNC(=O)NC[C@@H](O)C[NH+]2CCC(C)CC2)CC1,C67619311_decoy,CXCR4,Decoy,0,-9.12914,-8.54,-1.36,-8.038804652917063
N#Cc1ccc(NC(=O)C[NH2+]Cc2ccccc2Cl)cc1,C04897788_decoy,CXCR4,Decoy,0,-7.964,-7.54,-1.63,-7.176072009981313
COc1ccccc1[C@H](CC[NH3+])c1ccc2c(c1)OCO2,C00287378_decoy,CXCR4,Decoy,0,-7.4999,-6.92,-3.42,-3.4814525552314106
COc1ccc(C[C@H]([NH3+])Cc2ccc3c(c2)OCO3)cc1,C11601182_decoy,CXCR4,Decoy,0,-6.06878,-6.92,-3.61,-3.0853191313264063
COc1cc(OC)cc([C@@H]([NH3+])c2ccc(N(C)C)cc2)c1,C11737563_decoy,CXCR4,Decoy,0,-7.36315,-6.27,-1.75,-8.365391531234646
Cc1ccc2nc(-n3cccc3C[NH2+]CCO)sc2c1,C10038112_decoy,CXCR4,Decoy,0,-7.13227,-7.08,-1.34,-7.154563222931374
CC(C)CC[NH2+]Cc1nc2sc3c(c2c(=O)[nH]1)CCC3,C18937017_decoy,CXCR4,Decoy,0,-8.20363,-7.75,-1.86,-7.545726882284007
COc1ccc(OC)c([C@H](C)[NH2+]C2CCC(O)CC2)c1,C19918778_decoy,CXCR4,Decoy,0,-8.29229,-7.32,-3.19,-8.632219971142755
COc1ccc([C@H]([NH3+])c2ccc(OC)c(OC)c2)c(C)c1,C19972084_decoy,CXCR4,Decoy,0,-6.68032,-7.23,-4.5,-8.063608687420597
[NH3+]CCc1cn2nc(CCc3ccccc3Cl)sc2n1,C20270595_decoy,CXCR4,Decoy,0,-8.49324,-6.1,-1.24,-6.428757375709989
COc1cc(OC)c([C@H]([NH3+])c2ccc(F)cc2)cc1OC,C20440095_decoy,CXCR4,Decoy,0,-6.94352,-6.8,-1.85,-8.261415651436513
CC[C@@H](c1ccccc1)[C@@H]([NH3+])c1cc(Cl)cc([N+](=O)[O-])c1,C21505327_decoy,CXCR4,Decoy,0,-7.31034,-7.96,-2.08,-7.751997099176924
COc1ccc(O[C@@H](C[NH3+])c2ccc(OC)cc2)cc1,C32120426_decoy,CXCR4,Decoy,0,-7.62406,-6.8,-1.2,-6.803780965331869
COc1cccc([C@H]2C[NH2+]C[C@H]2C(=O)NCC(C)C)c1,C35667075_decoy,CXCR4,Decoy,0,-6.61995,-6.85,-1.0,-6.89505471589987
CC(C)COc1ccc2c(c1)CC[C@]1(CCN(CC[NH3+])C1)O2,C36149061_decoy,CXCR4,Decoy,0,-8.03927,-7.85,-3.61,-7.350203687442983
CCOc1cccn2c(CC[NH3+])c(-c3ccc(F)cc3)nc12,C36222966_decoy,CXCR4,Decoy,0,-7.31112,-8.2,-0.75,-8.479724668095814
CC[C@@H](C)[NH2+][C@H](CO)c1cc(Cl)c2c(c1)OCO2,C38116654_decoy,CXCR4,Decoy,0,-7.6307,-7.37,-3.58,-4.28908471255681
Clc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccco2)cc1,C40464599_decoy,CXCR4,Decoy,0,-7.26585,-7.11,-1.51,-8.668669334535293
CCCn1cc[nH+]c1[C@H](N)c1cc(Cl)ccc1OC,C41109953_decoy,CXCR4,Decoy,0,-7.44165,-6.91,-0.62,-9.284534194136183
COc1ccc([C@@H]([NH3+])c2nc(C(C)C)cs2)c(OC)c1,C41182832_decoy,CXCR4,Decoy,0,-6.99397,-6.75,-2.89,-7.329447524253815
CC[NH2+][C@@H](C)c1c(F)cccc1Sc1nc(C)n[nH]1,C41632878_decoy,CXCR4,Decoy,0,-7.46903,-7.3,-1.12,-12.653688838165657
CC[C@@H](C)/[NH+]=C(\N)SCC(=O)N1C[C@@H](C)C[C@H](C)C1,C42634341_decoy,CXCR4,Decoy,0,-7.6225,-6.17,-3.18,-3.2394630520496155
C[C@@H]([NH3+])Cc1cc2c(cc1OCc1cccs1)OCO2,C42877983_decoy,CXCR4,Decoy,0,-7.74755,-6.84,-1.81,-7.898754872861155
COc1ccc([C@@H](Oc2cccc(C#N)c2)[C@H](C)[NH3+])cc1,C42963286_decoy,CXCR4,Decoy,0,-7.21822,-8.5,-2.1,-3.855868812552724
CC[C@@H]([NH3+])[C@@H](Oc1ccc2c(c1)OCO2)c1ccsc1,C43125173_decoy,CXCR4,Decoy,0,-8.4554,-7.43,-1.71,-3.77284081597352
Cc1cc(O[C@H](c2cnn(C)c2)[C@H](C)[NH3+])ccc1C(C)C,C43233616_decoy,CXCR4,Decoy,0,-7.44954,-7.56,-2.8,-9.492571023568336
CCc1cccc(O[C@@H](c2cnn(C)c2)[C@@H]([NH3+])CC)c1,C43235184_decoy,CXCR4,Decoy,0,-7.63014,-7.39,-2.76,-7.666960406748915
CC[C@H]([NH3+])[C@H](Oc1ccc(F)cc1Cl)c1cnn(C)c1,C43236592_decoy,CXCR4,Decoy,0,-8.60129,-7.23,-1.93,-8.077882941160007
CC[C@@H]([NH3+])[C@H](c1ccc(C)o1)n1ccc(C(F)(F)F)n1,C43365601_decoy,CXCR4,Decoy,0,-6.46853,-7.23,-0.89,-6.92119257949829
COc1cc(C)ccc1O[C@@H](c1ccc(C)o1)[C@@H](C)[NH3+],C43366246_decoy,CXCR4,Decoy,0,-6.80473,-7.72,-4.39,-7.720737337904352
COc1cc(C)ccc1O[C@@H](c1ccc(C)o1)[C@H](C)[NH3+],C43366250_decoy,CXCR4,Decoy,0,-6.45659,-7.13,-3.36,-7.184824729068992
Cc1ccc([C@@H](Oc2cccc(N(C)C)c2)[C@@H](C)[NH3+])o1,C43367072_decoy,CXCR4,Decoy,0,-7.17984,-6.82,-0.58,-7.190847985596792
COC(=O)[C@@H]([NH2+]Cc1ccc(O)c(Cl)c1)C(C)C,C43477560_decoy,CXCR4,Decoy,0,-7.62161,-6.83,-1.62,-7.436581962753608
CC[C@@H](C#N)Oc1c(Br)cc(C[NH3+])cc1OC,C43538968_decoy,CXCR4,Decoy,0,-7.47874,-6.42,-1.95,-8.12025440097421
Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2cc(C)oc2C)c1,C44730583_decoy,CXCR4,Decoy,0,-7.3054,-7.49,-1.33,-3.598268230938263
COc1ccc2cc(C[NH+](C)CC(C)C)c(N)nc2c1,C50812957_decoy,CXCR4,Decoy,0,-7.95654,-6.96,-0.53,-6.798942895496205
Cc1cc(C)c(NC(=O)C[NH+](C)C[C@@H](C)O)c(Cl)c1,C51837502_decoy,CXCR4,Decoy,0,-7.66471,-6.81,-2.38,-3.516489552681974
COc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2O)c(OC)c1,C51992522_decoy,CXCR4,Decoy,0,-7.09228,-7.13,-1.0,-7.307442967183026
CC(C)c1nc2cc(N)ccc2n1[C@@H](C[NH+](C)C)C(C)C,C52854594_decoy,CXCR4,Decoy,0,-7.42193,-7.0,-2.34,-4.233396426141255
CCCc1ccc(O[C@H](c2cnn(C)c2)[C@@H](C)[NH3+])cc1,C53331928_decoy,CXCR4,Decoy,0,-6.7073,-6.66,-1.34,-7.0587712241836735
CC[NH2+][C@H](C)c1cnc(-c2ccc(O)c(OC)c2)s1,C54160257_decoy,CXCR4,Decoy,0,-7.83663,-6.76,-1.0,-6.1133104694155245
Cc1[nH]cnc1C[NH2+][C@@H](C)c1ccc(OC(C)C)cc1,C54794723_decoy,CXCR4,Decoy,0,-7.09908,-7.5,-1.46,-7.028340286987975
Cc1[nH]cc(CNc2ccc(OC(F)F)c(Cl)c2)[nH+]1,C54798200_decoy,CXCR4,Decoy,0,-7.2116,-7.29,-1.24,-8.172291511302666
COc1ccc(O)c([C@@H](C)NC2CC[NH+](C3CC3)CC2)c1,C37140948_decoy,CXCR4,Decoy,0,-7.44924,-7.01,-2.06,-3.3566299142626312
COc1cccc(C[C@H](C[NH3+])c2ccc3c(c2)OCCO3)c1,C57758543_decoy,CXCR4,Decoy,0,-7.83291,-8.17,-0.91,-7.813234068659534
CC1CCC(C[NH2+]C[C@@H](O)c2ccc3c(c2)OCO3)CC1,C58864577_decoy,CXCR4,Decoy,0,-7.56243,-8.03,-3.16,-3.335258046145775
CCCn1cc[nH+]c1[C@@H](N)c1cccc(OC(C)C)c1,C61667081_decoy,CXCR4,Decoy,0,-7.4808,-7.43,-0.17,-8.45352467602782
C[C@@H]1CC[C@@H](CNS(=O)(=O)CC2CCCCC2)C[NH2+]1,C62037584_decoy,CXCR4,Decoy,0,-8.10342,-6.76,-2.72,-7.409083858977302
CC(C)CCn1nnc(C[NH3+])c1C(Cl)(Cl)Cl,C62300154_decoy,CXCR4,Decoy,0,-8.99915,-5.69,-3.6,-9.004317600502823
CC[C@@H](C)C(=O)N[C@@H](C)c1[nH]cc(-c2ccccc2)[nH+]1,C58225086_decoy,CXCR4,Decoy,0,-6.76252,-6.07,-1.19,-4.756594632077743
CC[C@@H](C)Oc1cccc(-c2[nH]nc(C)c2C[NH2+]C)c1,C66135611_decoy,CXCR4,Decoy,0,-7.28478,-7.5,-1.64,-8.069832674872423
COc1cc(OC)cc([C@H]([NH3+])C(=O)[O-])c1,C04202366_decoy,CXCR4,Decoy,0,-5.12675,-5.97,-1.07,-7.118935646211664
CC(C)C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)[O-],C04556775_decoy,CXCR4,Decoy,0,-5.79931,-6.67,-1.72,-2.8139270198955275
COc1cc(C)ccc1OCC(=O)NN,C00434082_decoy,CXCR4,Decoy,0,-5.21606,-6.98,-0.35,-8.273312484323421
C[C@@]1(O)CCOC[C@H]1[NH2+]CCC(=O)[O-],C02475561_decoy,CXCR4,Decoy,0,-5.95559,-5.79,-3.9,-2.572701523608073
Cc1nc(C)c(-c2nnco2)cc1C(=O)NN,C03239668_decoy,CXCR4,Decoy,0,-6.38565,-7.1,-4.62,-3.0769351661499345
Cc1ccc(S(=O)(=O)[C@@H](C)C(=O)NN)cc1,C04290621_decoy,CXCR4,Decoy,0,-6.79696,-7.21,-1.29,-7.4525461524075585
COC(=O)[C@@H](C)c1c(C)nc(N)[nH]c1=O,C05818098_decoy,CXCR4,Decoy,0,-5.52646,-6.15,-1.95,-2.591828281252377
C/C=C\C1=C(C(=O)[O-])N2C(=O)[C@@H]([NH3+])[C@H]2SC1,C26892296_decoy,CXCR4,Decoy,0,-5.97122,-6.48,-4.05,-2.544461380277652
CC(=O)NNC(=O)c1cc(=O)[nH]c2ccccc12,C13633194_decoy,CXCR4,Decoy,0,-6.66155,-7.6,-1.71,-6.889861728832947
CC(C)(C(=O)NN)N1CCOCC1,C30769518_decoy,CXCR4,Decoy,0,-5.35264,-5.81,-2.02,-2.5240188497428835
CNC(=O)c1c(C(C)=O)c(C)n(C)c1N,C32593664_decoy,CXCR4,Decoy,0,-5.56902,-6.43,-2.06,-2.5767210558134286
CCc1n[nH]c(=S)n1[C@H](C)C(N)=O,C35796053_decoy,CXCR4,Decoy,0,-5.78337,-5.91,-2.83,-2.509174047146848
Cc1n[nH]c(=S)n1[C@@H](C)C(N)=O,C35796056_decoy,CXCR4,Decoy,0,-5.27666,-5.75,-1.28,-6.653326111648766
Cc1cc([N-]S(=O)(=O)CC[NH3+])n(C)n1,C37116318_decoy,CXCR4,Decoy,0,-5.73525,-5.81,-0.84,-2.640320271906206
CC[C@@H](C)NC(=O)Cn1cnc(N)n1,C37996099_decoy,CXCR4,Decoy,0,-5.37586,-5.92,-2.0,-2.5090237633844152
Cc1cc(C)nc(NC(=O)C(N)=O)n1,C38723694_decoy,CXCR4,Decoy,0,-5.80486,-6.75,-2.19,-6.361864074275506
COC(=O)N1C[C@@H]([NH3+])[C@@H](C(=O)[O-])C1,C39083348_decoy,CXCR4,Decoy,0,-4.75835,-5.63,-3.32,-2.266077192501452
NNC(=O)[C@@H]1N=NN=C1Br,C39273458_decoy,CXCR4,Decoy,0,-5.11633,-5.04,-4.77,-2.0780516531373414
O=CC[C@@H](NC=O)c1ccc(O)c(O)c1F,C39496947_decoy,CXCR4,Decoy,0,-6.4004,-6.7,-3.02,-7.65193946375388
C[C@@H](NC(=O)c1cnn(C)c1)C(N)=S,C40352099_decoy,CXCR4,Decoy,0,-5.9776,-5.9,-0.64,-5.572241232154797
CN(CC(=O)[O-])C(=O)C1CCC([NH3+])CC1,C40469822_decoy,CXCR4,Decoy,0,-6.41015,-5.27,-2.69,-2.591961198599603
CO[C@H]1C[C@H](C(=O)[O-])N(C(=O)C[C@H](C)[NH3+])C1,C40480532_decoy,CXCR4,Decoy,0,-4.93269,-4.98,-3.23,-2.265677320521972
C[C@@H](CC(=O)[O-])NC(=O)[C@H]1CCC[NH2+]1,C40481836_decoy,CXCR4,Decoy,0,-4.91423,-6.05,-1.16,-2.3401213964181657
C[C@@H]1CCN(C(=O)C(=O)NCC(N)=S)C1,C40724916_decoy,CXCR4,Decoy,0,-6.40938,-5.98,-1.4,-6.588667393053737
C[C@@H]([NH3+])C(=O)N1CCC[C@H]1CC(=O)[O-],C42164460_decoy,CXCR4,Decoy,0,-4.65122,-5.26,-1.44,-5.374294684119191
[NH3+][C@H]1CCCN(C(=O)N(CC(=O)[O-])C2CC2)C1,C42305030_decoy,CXCR4,Decoy,0,-5.13587,-6.21,-1.6,-7.041984658381272
C[C@@H](C(=O)[O-])[NH+]1CCCC[C@@H]1C(N)=O,C42405347_decoy,CXCR4,Decoy,0,-4.98417,-5.97,-1.35,-2.344055519000604
CNC(=O)[C@H](C)NC(=O)NC(=O)CCl,C42576062_decoy,CXCR4,Decoy,0,-5.4656,-5.27,-1.72,-2.6303109452756
CC(C)([NH3+])C(=O)N1CCO[C@@H](C(=O)[O-])C1,C43705647_decoy,CXCR4,Decoy,0,-5.46207,-6.58,-2.84,-2.56632901765706
[NH3+][C@@H](CC(=O)[O-])c1cc(F)cc2c1OCOC2,C44219117_decoy,CXCR4,Decoy,0,-5.57283,-7.45,-1.84,-2.9363682308548933
C[C@@H](NS(=O)(=O)CC#N)C(N)=O,C44509724_decoy,CXCR4,Decoy,0,-5.41239,-4.84,-1.91,-5.291804265341929
C[C@H](C(=O)Nc1nncs1)C(N)=S,C44833285_decoy,CXCR4,Decoy,0,-6.30882,-5.27,-1.59,-6.430834331349069
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](C)C(N)=S,C44858461_decoy,CXCR4,Decoy,0,-6.05638,-6.26,-1.5,-2.841354927398371
C[C@@H](/C(N)=N/O)N(C)S(C)(=O)=O,C45145697_decoy,CXCR4,Decoy,0,-5.31926,-5.05,-0.88,-2.196287124278069
CCc1c(C)nn(C[C@H]([NH3+])C(=O)[O-])c1C,C45459122_decoy,CXCR4,Decoy,0,-5.80329,-6.32,-3.56,-2.6812641489407367
Cc1nc(-c2cnn(C)c2N)n[nH]1,C48630492_decoy,CXCR4,Decoy,0,-4.82853,-5.89,-0.1,-4.699444883616467
CNC(=O)NNC(=O)C1=COCCO1,C48949178_decoy,CXCR4,Decoy,0,-4.91913,-6.06,-1.4,-2.457383870406409
CNC(=O)NNC(=O)c1cnn(C)c1C,C48949891_decoy,CXCR4,Decoy,0,-5.59008,-6.15,-0.64,-5.856479052898795
C[C@H]([NH2+][C@H](C)c1cc[nH]n1)C(=O)[O-],C49358199_decoy,CXCR4,Decoy,0,-4.8508,-6.01,-1.18,-2.510638764722961
[NH3+][C@@H]1CCN(C(=O)/C=C/C(=O)[O-])C1,C50242357_decoy,CXCR4,Decoy,0,-5.7728,-6.32,-3.69,-2.566200787859321
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2C(=O)[O-])C1,C50250611_decoy,CXCR4,Decoy,0,-6.27053,-6.42,-0.78,-2.850559719044669
NC(=O)CCSc1ncnc2nc[nH]c12,C51037133_decoy,CXCR4,Decoy,0,-6.00464,-6.48,-1.3,-7.791525168457363
C[C@@H]1CCN(C(=O)C(=O)NN)[C@H](C)C1,C51750480_decoy,CXCR4,Decoy,0,-5.78329,-5.87,-0.89,-6.868400077954952
[NH3+]C[C@@H](CC(=O)[O-])c1ccc2c(c1)OCO2,C57515469_decoy,CXCR4,Decoy,0,-6.0026,-6.7,-1.56,-2.9204033725713003
C[C@H](C(=O)[O-])S(=O)(=O)N1CC[C@H](C[NH3+])C1,C50246536_decoy,CXCR4,Decoy,0,-5.66965,-5.64,-1.54,-2.510963749587016
C[C@@H]([NH3+])C(=O)N1CCC(C)(C(=O)[O-])CC1,C62842834_decoy,CXCR4,Decoy,0,-4.67874,-5.31,-0.57,-5.171680489505047
C[C@]1(C(=O)[O-])CCN(C(=O)N2CC[C@@H]([NH3+])C2)C1,C62935071_decoy,CXCR4,Decoy,0,-5.99591,-6.29,-1.03,-2.6775842121180964
CCC1(CC)CCN(C(=O)C(=O)NN)CC1,C62960583_decoy,CXCR4,Decoy,0,-6.2596,-6.57,-0.51,-7.34316672147344
CCCN[C@@]1(C(N)=O)CCS(=O)(=O)C1,C62962933_decoy,CXCR4,Decoy,0,-6.31526,-5.45,-1.69,-7.351047947115646
COC(=O)[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@H]1OC,C65743382_decoy,CXCR4,Decoy,0,-4.30979,-5.75,-4.72,-2.1811397832304777
O[C@H](C[NH+]1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1)C(F)(F)F,C04050461_decoy,CXCR4,Decoy,0,-7.8155,-7.98,-1.19,-6.498094705499755
COc1ccc(/C=C/C(=O)c2cc(C[NH+](C)C)c(O)c(C[NH+](C)C)c2)cc1,C06374819_decoy,CXCR4,Decoy,0,-8.38549,-6.15,-1.09,-7.016296969621205
O=c1c(-c2ccccc2C[NH+]2CCOCC2)ccc2n1C[C@H]1C[C@@H]2C[NH+](C2CCOCC2)C1,C08296447_decoy,CXCR4,Decoy,0,-10.0673,-8.09,-1.68,-4.117050216745383
C[NH+]1CCCN(C(=S)SSC(=S)N2CCC[NH+](C)CC2)CC1,C02013172_decoy,CXCR4,Decoy,0,-9.94131,-5.46,-3.18,-7.858061509841328
[NH2+]=c1n(CCOc2ccccc2)c2ccccc2n1CC[NH+]1CCOCC1,C00821025_decoy,CXCR4,Decoy,0,-8.07579,-8.0,-2.55,-3.971066613106416
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1CCCC1)c1ccc2c(c1)OCO2,C08635577_decoy,CXCR4,Decoy,0,-7.95893,-8.75,-1.53,-3.970141284047309
O=C(NC[C@H]1C[C@@H]2CC[NH+]1C[C@@H]2C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1,C08635605_decoy,CXCR4,Decoy,0,-8.12731,-9.08,-1.94,-10.565809500542564
Cc1ccc[nH+]c1N[C@]1(C(F)(F)F)[NH+]=C(c2ccccc2)N(Cc2ccco2)C1=O,C06759202_decoy,CXCR4,Decoy,0,-8.62257,-6.94,-1.78,-7.495289430930365
COc1ccc(C[NH+]2CC[C@@H]([NH+]3CCCCCC3)[C@H](O)C2)c(OC)c1OC,C11818103_decoy,CXCR4,Decoy,0,-9.6644,-6.97,-3.36,-3.880629264053688
COc1cc(C[NH+]2CC[C@]3(CCC[NH+](CC4CCC4)C3)C2)cc2c1OCO2,C11874057_decoy,CXCR4,Decoy,0,-9.7724,-8.78,-0.85,-5.173644602151757
Cc1ccc2c(c1)C[NH+](CC(=O)N1CCC([NH+]3CCOCC3)CC1)C[C@@H](c1ccsc1)O2,C11963193_decoy,CXCR4,Decoy,0,-11.5343,-10.25,-1.6,-5.288984180112512
Cc1cc(Cl)ccc1OCC(=O)N[C@@H]1CCC[NH+](C2CC[NH+](C)CC2)C1,C12588367_decoy,CXCR4,Decoy,0,-9.34991,-8.0,-1.75,-9.060157023593147
CCCCn1c(C[NH+]2CCC[C@]3(CCC[NH+](C)C3)C2)cnc1S(=O)(=O)CC,C12434243_decoy,CXCR4,Decoy,0,-8.46227,-7.73,-2.75,-7.394213628318086
C[NH+]1CC[C@@]2(CCN(C(=O)c3ccc(OC4CC[NH+](CCc5ccccc5)CC4)cc3)C2)C1,C14981585_decoy,CXCR4,Decoy,0,-9.95065,-7.34,-1.42,-7.681245581847139
C[NH+]1CCC(N2CCC[C@@H](NC(=O)C3([NH+]4CCCCC4)CCCCC3)C2)CC1,C19740412_decoy,CXCR4,Decoy,0,-10.2714,-7.97,-3.03,-3.964307172760176
O[C@H]1CCC[NH+](Cc2cn(CC3CC[NH+](C4CCSCC4)CC3)nn2)C1,C23339982_decoy,CXCR4,Decoy,0,-10.0891,-6.78,-0.87,-7.008411549793381
C[NH+](C)CC/C(O)=N/[n+]1c2c(nc3cc(Cl)ccc31)-c1cccc3cccc-2c13,C17123960_decoy,CXCR4,Decoy,0,-9.3335,-10.22,-1.88,-9.804596344380982
C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(F)c(Br)c1,C37229185_decoy,CXCR4,Decoy,0,-8.79136,-5.52,-1.47,-5.592629650411352
CCc1c(-c2cc(OC)ccc2OC)[nH+]c2ccc(N3CC[NH2+]CC3)cn12,C36237493_decoy,CXCR4,Decoy,0,-8.53943,-8.54,-0.55,-9.37952481248036
CCOC(=O)[C@H]1[NH+]=c2ccc(F)cc2=C1NC(=O)[C@H](C)[NH+]1CCCCC1,C38605504_decoy,CXCR4,Decoy,0,-8.39037,-7.52,-3.33,-9.28695552602488
CCOC(=O)[C@H]1[NH+]=c2ccc(F)cc2=C1NC(=O)CC[NH+]1CCCCC1,C38612337_decoy,CXCR4,Decoy,0,-8.73801,-7.64,-4.58,-4.120251909884183
COC(=O)[C@H]1[NH+]=c2ccc(Cl)cc2=C1NC(=O)CC[NH+]1CCC[C@@H](C)C1,C38612544_decoy,CXCR4,Decoy,0,-9.44466,-8.96,-3.07,-4.367690782923112
COc1ccc(NC(=O)C[NH+](C)CC(=O)C2=c3ccccc3=[NH+][C@H]2C)cc1,C39335679_decoy,CXCR4,Decoy,0,-8.35048,-9.06,-1.83,-5.192685830152841
Fc1ccc([C@@H]2[NH+]=NC=C2C[NH2+]Cc2ccc(-n3cncn3)cc2)c(F)c1,C39398994_decoy,CXCR4,Decoy,0,-9.19203,-9.16,-1.99,-7.207979767465778
Cc1ccc([C@H]2[NH+]=NC=C2C[NH2+]Cc2ccccc2-n2cncn2)cc1C,C39404930_decoy,CXCR4,Decoy,0,-8.49207,-6.76,-1.73,-6.170510644339746
Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[NH+](C3CCSCC3)C2)cc1,C39542142_decoy,CXCR4,Decoy,0,-9.81072,-8.24,-0.77,-9.40833748215702
COc1ccc(NC(=O)C[NH+](C)[C@@H](C)C(=O)C2=c3ccccc3=[NH+][C@H]2C)cc1,C39738397_decoy,CXCR4,Decoy,0,-7.92019,-7.89,-1.59,-7.60091708966389
CC[NH+]1CCN(c2ccc(NC(=O)N3CC[NH+](CC4CC4)CC3)c(C)c2)CC1,C47373768_decoy,CXCR4,Decoy,0,-8.23635,-5.56,-2.14,-3.0291730005295334
CCOc1ccc(/C=C/C(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)cc1,C47398356_decoy,CXCR4,Decoy,0,-8.46237,-7.24,-2.75,-6.467309916280379
CC[NH+](CC)CCC[n+]1cnc2oc(-c3ccccc3)c(-c3ccccc3)c2c1N,C49762669_decoy,CXCR4,Decoy,0,-9.89348,-6.42,-2.29,-7.83988533580218
CCC(=O)c1ccc(OC[C@H](O)C[NH+]2CCC([NH+]3CCCC3)CC2)cc1,C51924670_decoy,CXCR4,Decoy,0,-8.53953,-7.91,-1.98,-8.1336307676932
CCC[NH2+]CC1(C[NH+](C)Cc2csc(Br)c2)CCOCC1,C52197461_decoy,CXCR4,Decoy,0,-8.63365,-6.25,-1.46,-7.498803818950851
O=C(CCC1=c2ccccc2=[NH+]C1)NCc1ccc(N2CCOCC2)[nH+]c1,C63072947_decoy,CXCR4,Decoy,0,-7.24559,-8.97,-1.32,-7.067014367024536
COc1ccc2c(c1)=C1N=CN(CCC3=c4ccccc4=[NH+]C3)C(=O)[C@H]1[NH+]=2,C63349765_decoy,CXCR4,Decoy,0,-7.87475,-9.15,-0.9,-7.433173804075836
Cc1ccc2c(c1)=C1S[C@H](C(=O)NCCC[NH+](C)Cc3ccccc3)C=C1C(=O)[NH+]=2,C63494162_decoy,CXCR4,Decoy,0,-8.15252,-8.01,-3.38,-6.938422785348853
COC(=O)[C@H](NC(=O)CS[C@H]1[NH+]=c2ccc(C)cc2=[NH+]1)c1ccccc1,C63515580_decoy,CXCR4,Decoy,0,-8.34551,-9.19,-2.48,-4.405844814294805
COc1ccc2c(c1)=C(CC[NH2+][C@@H]1CC(=O)N(c3cccc4ccccc34)C1=O)C[NH+]=2,C63633139_decoy,CXCR4,Decoy,0,-9.7682,-10.2,-2.48,-8.15713254999021
C[C@@H](NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1)c1ccc2c(c1)OCCCO2,C63698894_decoy,CXCR4,Decoy,0,-8.86038,-8.49,-1.77,-4.387915757525366
CCOC(=O)[C@H]1C=C(C)S[C@@H]1NC(=O)CSC1[NH+]=c2ccccc2=[NH+]1,C63772588_decoy,CXCR4,Decoy,0,-9.5792,-7.23,-2.18,-7.906632944786449
COc1cccc(N2C(=O)C[C@@H]([NH2+]CCC3=c4cc(C)ccc4=[NH+]C3)C2=O)c1,C63867169_decoy,CXCR4,Decoy,0,-9.06434,-10.08,-2.07,-4.687996560854342
O=C(NC[C@@H]1CCC[NH+](C2CSCCSC2)C1)[C@@H]1C=c2ccccc2=[NH+]1,C64093483_decoy,CXCR4,Decoy,0,-10.888,-7.46,-1.5,-8.1395482856822
COC(=O)CC[C@H]1C[NH+](CC2=c3ccccc3=[NH+]C2)CC[C@H]1N1CCOCC1,C64110579_decoy,CXCR4,Decoy,0,-8.25717,-7.59,-2.65,-8.31822956761344
CCOc1ccc([C@@H]2CCC[NH+]2CC(=O)NC2CC[NH+](C3CC3)CC2)cc1,C64507945_decoy,CXCR4,Decoy,0,-10.056,-8.06,-0.85,-14.618460918534456
COCCN1C(=O)[C@H](C[NH2+]C[C@@H]2C=c3ccccc3=[NH+]2)Cc2cc(C)ccc21,C64609776_decoy,CXCR4,Decoy,0,-8.76276,-8.34,-4.96,-4.1094388007292935
C1=c2ccccc2=[NH+][C@H]1c1c(-c2ccccc2)ncn1C[C@H]1C[NH2+]CCO1,C65461823_decoy,CXCR4,Decoy,0,-8.55276,-6.63,-1.53,-5.90385053114852
CC1CCC([NH+]2CCC(N(C)C(=O)NCCCCn3cc[nH+]c3)CC2)CC1,C66187504_decoy,CXCR4,Decoy,0,-9.03805,-6.68,-1.51,-8.774995692653828
C[C@H]([NH2+][C@H](C)c1ccc(N2CC[NH+](C)CC2)c(F)c1)c1nc(C2CC2)no1,C66390567_decoy,CXCR4,Decoy,0,-9.24327,-6.58,-1.5,-6.757592939714525
C(=C/CN1CCC([NH+]2CCCC2)CC1)\CN1CCC([NH+]2CCCC2)CC1,C66532896_decoy,CXCR4,Decoy,0,-9.64158,-6.61,-3.14,-3.5819176445975573
COc1cc(C[NH2+][C@H](C)c2ccc(N3CC[NH+](C)CC3)cc2)cc2c1OCO2,C67250845_decoy,CXCR4,Decoy,0,-8.43479,-7.59,-2.51,-7.4320496782151055
CCc1oc(C(=O)N[C@H]2C[C@H]3C[NH+](C)CCN3C2)cc1C[NH+](CC)CC,C67587863_decoy,CXCR4,Decoy,0,-8.08188,-7.32,-2.86,-3.5800229929161227
Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc(N3CC[NH+](C)CC3)[nH+]c2)c(C)c1C,C08705466_decoy,CXCR4,Decoy,0,-8.60997,-7.89,-2.34,-6.7294645148743
O=C(OCC[NH+]1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1)c1cccs1,C08782010_decoy,CXCR4,Decoy,0,-9.63258,-7.52,-1.56,-9.08022530308794
Cc1ccc(C)c(C[NH+]2C[C@H](Sc3nc(C)cc(C)n3)C[C@H]2C(=O)N2CCC[NH+](C)CC2)c1,C11995274_decoy,CXCR4,Decoy,0,-10.0195,-9.99,-2.6,-14.642710571662588
Cc1ccc2occ(C[NH+]3CCC[C@@H](c4ccnc(SCC[NH+]5CCCC5)n4)C3)c(=O)c2c1,C12098869_decoy,CXCR4,Decoy,0,-10.1457,-8.87,-4.38,-4.676901667608904
COc1ccc(-c2nn(-c3ccccc3C)cc2C[NH2+]CC[C@H]2CCC[NH+]2C)cc1F,C12298759_decoy,CXCR4,Decoy,0,-9.04635,-8.11,-1.58,-8.087497737745506
COc1ccc(F)c(C[NH+]2CCC[C@]3(CC[NH+](CCCC(F)(F)F)C3)C2)c1,C12385357_decoy,CXCR4,Decoy,0,-8.52516,-8.07,-3.06,-7.664845688179675
COc1ccc(NC(=O)[C@H]2C[C@H](C3CC[NH+](C[C@@H]4CCOC4)CC3)[NH+](C)C2)cc1,C19587638_decoy,CXCR4,Decoy,0,-8.31332,-8.02,-2.09,-3.9304891666660233
CCC[NH+]1CCC(N2CC[C@@]3(CCC[NH+](Cc4cccc(F)c4F)C3)C2)CC1,C20210131_decoy,CXCR4,Decoy,0,-9.26755,-8.18,-0.99,-9.050165385623218
O=C(c1ccc(Cl)cc1)N1CC[NH+](CC/[NH+]=c2\cc(O)oc3ccccc23)CC1,C22472434_decoy,CXCR4,Decoy,0,-9.35995,-10.26,-1.07,-8.714763506075666
COc1c(Br)cc(Br)cc1C[NH2+]CCC[NH+]1CCCC1,C35015692_decoy,CXCR4,Decoy,0,-9.57048,-5.91,-2.01,-9.718790795130175
O=C(C[NH+]1CCn2cccc2[C@H]1c1ccc(Cl)cc1)NCC[NH+]1CCCCC1,C35522953_decoy,CXCR4,Decoy,0,-9.32905,-8.52,-1.76,-11.089330889395136
C[C@H]1CCCC[NH+]1CCCNC(=O)C[NH+]1CCn2cccc2[C@@H]1c1ccc(F)cc1F,C35523276_decoy,CXCR4,Decoy,0,-9.35802,-8.86,-1.81,-11.307719792304257
CCC[NH+](CC(=O)Nc1ccc(F)c(F)c1F)CC(=O)C1=c2ccccc2=[NH+][C@@H]1C,C38787334_decoy,CXCR4,Decoy,0,-8.78545,-9.67,-1.22,-8.967052719027473
CC(C)CCN[C@H]1[NH+]=c2ccccc2=[NH+]/C1=N\S(=O)(=O)c1ccc(F)cc1,C38979466_decoy,CXCR4,Decoy,0,-8.80827,-8.79,-1.31,-8.75714570889628
COCCN1[C@H](C)C(C)=C(C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1NC(=O)c1cccs1,C39041489_decoy,CXCR4,Decoy,0,-8.49874,-7.5,-4.01,-3.817508387354824
COc1cc(OCCCC#N)c(Br)cc1/C=C(\C#N)C1[NH+]=c2ccccc2=[NH+]1,C39370670_decoy,CXCR4,Decoy,0,-9.23596,-7.63,-3.08,-7.27140874937862
O=C1[NH+]=c2ccccc2=[NH+][C@@H]1c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1,C39404745_decoy,CXCR4,Decoy,0,-8.4632,-8.87,-1.77,-7.471362571936976
C[C@H]([NH2+][C@@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1)c1ccc2c(c1)OCCO2,C39746810_decoy,CXCR4,Decoy,0,-8.97989,-10.53,-3.09,-9.200429373637451
COc1ccc2c(c1)=[NH+][C@@H](/C(C#N)=C\c1cc(Br)cc(OC)c1OC)[NH+]=2,C39969141_decoy,CXCR4,Decoy,0,-9.74464,-7.25,-1.18,-11.417163661802446
N#Cc1ccccc1CN1C[C@@H](/C=N/NC2[NH+]=c3ccccc3=[NH+]2)c2ccccc21,C39978355_decoy,CXCR4,Decoy,0,-8.20652,-10.52,-2.67,-10.24568681803876
O=c1cc(C[NH+]2CCN(c3ccc(O)cc3)CC2)[nH+]c2scc(-c3ccccc3)n12,C49590218_decoy,CXCR4,Decoy,0,-8.98254,-8.81,-4.09,-6.562538852485468
CCOc1c(Br)cc(C[NH2+]CC[NH+](C)CC)cc1Br,C49938286_decoy,CXCR4,Decoy,0,-9.12302,-6.58,-0.74,-9.43426977935053
O=C(CS[C@@H]1N[NH+]=C(N2CCCCC2)N1c1ccccc1)C1=c2ccccc2=[NH+]C1,C39933502_decoy,CXCR4,Decoy,0,-9.78223,-8.93,-1.02,-9.330080798784463
CC[C@H](SC1[NH+]=c2ccccc2=[NH+]1)C(=O)N[C@H]1N=C(c2ccccc2)CS1,C63279377_decoy,CXCR4,Decoy,0,-9.07422,-8.35,-1.56,-7.791231810109447
COc1ccc(C(=O)N[C@@H](c2ccccc2)C2[NH+]=c3ccccc3=[NH+]2)cc1OC,C63478221_decoy,CXCR4,Decoy,0,-6.96992,-7.06,-1.52,-3.148976543443883
COc1ccc(C(=O)N[C@H](c2ccccc2)C2[NH+]=c3ccccc3=[NH+]2)cc1OC,C63478222_decoy,CXCR4,Decoy,0,-8.15337,-7.73,-1.54,-7.237500964450175
COCCN1[C@@H](C)[C@@H](C)[C@H](C2[NH+]=c3ccccc3=[NH+]2)[C@@H]1NC(=O)c1ccccc1C,C63491018_decoy,CXCR4,Decoy,0,-8.20608,-8.76,-1.44,-9.365367792130906
CCOc1ccc(CNC(=O)C2CCN([C@@H]3[NH+]=c4ccc(C)cc4=[NH+]3)CC2)cc1,C63694798_decoy,CXCR4,Decoy,0,-8.69937,-7.86,-0.85,-7.325590642980211
C[C@@H](Cc1ccco1)NC(=O)C1CCN([C@@H]2[NH+]=c3ccc(Cl)cc3=[NH+]2)CC1,C63695508_decoy,CXCR4,Decoy,0,-9.29555,-8.36,-0.91,-6.812050071519179
Cc1ccc(S(=O)(=O)CCC(=O)Nc2ccc(C3[NH+]=c4ccccc4=[NH+]3)cc2)cc1,C63696123_decoy,CXCR4,Decoy,0,-9.44927,-10.16,-3.69,-4.787019913312001
O=C(Nc1ccc(SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1)c1ccccc1,C63751694_decoy,CXCR4,Decoy,0,-8.6304,-8.73,-2.61,-6.69845427548091
O=C(Nc1ccc(SC[C@H]2[NH+]=c3ccccc3=[NH+]C2=O)cc1)c1c(F)cccc1F,C63751818_decoy,CXCR4,Decoy,0,-9.10596,-10.05,-2.51,-8.529845994613952
C[C@H]([NH2+]C[C@H](C1=c2ccccc2=[NH+]C1)[C@@H]1CC=CS1)C(=O)N1CCc2ccccc21,C63830800_decoy,CXCR4,Decoy,0,-9.17888,-8.78,-3.07,-10.572333970284092
CC(C)N1C(=O)N(CCc2ccccc2)C2(CC[NH+](CC3=c4ccccc4=[NH+]C3)CC2)C1=O,C63980677_decoy,CXCR4,Decoy,0,-8.84275,-9.0,-1.59,-8.652618142612205
CCN1C(=O)N(C2Cc3ccccc3C2)C(=O)C12CC[NH+](C[C@H]1C=c3ccccc3=[NH+]1)CC2,C63985638_decoy,CXCR4,Decoy,0,-9.06756,-8.08,-1.21,-6.747737276759846
CN1C(=O)N(Cc2ccc3ccccc3c2)C(=O)C12CC[NH+](C[C@@H]1C=c3ccccc3=[NH+]1)CC2,C63993975_decoy,CXCR4,Decoy,0,-9.17751,-9.9,-0.91,-7.481358104871162
Cc1ccc2c(c1)=[NH+][C@@H](SCC(=O)N1CCC3(CC1)C[C@@H]3C(=O)Nc1ccc(F)c(F)c1)[NH+]=2,C64002166_decoy,CXCR4,Decoy,0,-9.02209,-9.37,-2.66,-9.519112474778288
COC(=O)[C@H]1CC(=O)N(CCC(C)C)C12CC[NH+](CC1=c3ccccc3=[NH+]C1)CC2,C64006902_decoy,CXCR4,Decoy,0,-9.6335,-8.11,-1.0,-9.47197144038763
O=C(CC1=c2ccccc2=[NH+]C1)NCC[NH+]1Cc2ccccc2O[C@H](c2ccccc2)C1,C64015506_decoy,CXCR4,Decoy,0,-9.00445,-9.87,-1.51,-8.724071847575905
Cc1[nH+]ccn1CCC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2[C@H]1C1CCCCC1,C64031674_decoy,CXCR4,Decoy,0,-8.35863,-9.01,-1.38,-8.389937728907961
CN1CC[NH+]=C1SCC(=O)NC[C@H](C1=c2ccccc2=[NH+]C1)c1ccc(Cl)cc1Cl,C64054961_decoy,CXCR4,Decoy,0,-8.69272,-8.73,-1.86,-9.171238273676575
CCn1cc[nH+]c1CN1CCC2=c3ccccc3=[NH+][C@H]2[C@@H]1c1ccc(OC)c(C)c1,C64057953_decoy,CXCR4,Decoy,0,-9.08876,-9.15,-1.52,-9.050268934253358
COc1ccccc1CCNC(=O)[C@@H]1CC12CC[NH+](C[C@@H]1C=c3ccccc3=[NH+]1)CC2,C64058465_decoy,CXCR4,Decoy,0,-8.51703,-8.08,-2.96,-9.497827284389526
COc1cccc([C@H](CNC(=O)CC2=c3cc(F)ccc3=[NH+][C@@H]2C)[NH+]2CCCC2)c1,C64066541_decoy,CXCR4,Decoy,0,-9.07528,-9.76,-2.63,-4.629269202433453
N#Cc1c(NC(=O)CC[NH+]2CCC(C3=c4ccccc4=[NH+]C3)CC2)sc2c1CCC2,C64076603_decoy,CXCR4,Decoy,0,-9.61892,-8.3,-3.63,-7.330724584500794
O=C1[C@@H]2C3=C(C[C@H]([NH2+]CCC4=c5ccccc5=[NH+]C4)CC3)S[C@@H]2N=CN1Cc1cccc(F)c1,C64152257_decoy,CXCR4,Decoy,0,-9.37761,-8.9,-2.48,-8.380102634350148
COc1ccc2c(c1)=[NH+][C@@H](CN1CCN(C(=O)C3(c4cccs4)CCCC3)CC1)[NH+]=2,C64410785_decoy,CXCR4,Decoy,0,-8.46654,-9.89,-2.29,-10.008833569155565
CC[C@H](S[C@@H]1[NH+]=c2cccnc2=[NH+]1)C(=O)Nc1ccc(Br)cc1,C64490970_decoy,CXCR4,Decoy,0,-9.27455,-7.01,-0.94,-7.667145323546574
CSc1ccc(NC(=O)[C@H]2CC23CC[NH+](C[C@@H]2C=c4ccccc4=[NH+]2)CC3)cc1,C64651336_decoy,CXCR4,Decoy,0,-8.82006,-7.05,-2.61,-5.990827915350049
CC[C@@H]1CCCCN1C(=O)[C@@H](C)[NH2+]C[C@H](C1=c2ccccc2=[NH+]C1)[C@@H]1CC=CS1,C64726209_decoy,CXCR4,Decoy,0,-10.2219,-9.24,-1.88,-10.073451646630929
C=CCOC(=O)c1nnn(-c2nonc2N)c1C,C02024944_decoy,CXCR4,Decoy,0,-5.85938,-6.58,-0.79,-5.617870896453185
Cn1ncc(Cl)c1-c1nc(-c2nonc2N)no1,C00970310_decoy,CXCR4,Decoy,0,-7.11592,-7.43,-1.26,-6.582214981440029
CC(=O)O[C@H](C)CNc1nc2c([nH]1)c(=O)n(C)c(=O)n2C,C01042098_decoy,CXCR4,Decoy,0,-6.05511,-6.51,-1.49,-2.956616535377594
CCOC(=O)c1cnn(C(=O)c2snnc2C)c1N,C00155015_decoy,CXCR4,Decoy,0,-6.45259,-5.85,-1.47,-5.589499310339413
CNC(=O)c1nn(C)cc1NC(=O)c1ccn(C(F)F)n1,C02800419_decoy,CXCR4,Decoy,0,-6.36061,-7.33,-1.68,-3.284241756328655
CCOC(=O)Cc1c(C)nn(-c2nncn2N)c1C,C06667953_decoy,CXCR4,Decoy,0,-6.68267,-7.14,-1.73,-3.4058038522810383
CNC(=O)NC(=O)[C@@H](C)Sc1ncnc2c1cnn2C,C11680326_decoy,CXCR4,Decoy,0,-7.01082,-7.63,-1.98,-3.707407254289635
Cn1c(=O)c2nc(/N=N/SCCO)[nH]c2n(C)c1=O,C16990227_decoy,CXCR4,Decoy,0,-7.25833,-7.06,-0.61,-10.206325406994337
CC1(C)O[C@@H]2O[C@@H]([C@H](O)CO)[C@@H](N=[N+]=[N-])[C@@H]2O1,C19891524_decoy,CXCR4,Decoy,0,-5.16954,-6.31,-1.56,-2.2929968845033417
CC1(C)O[C@@H]2O[C@@H]([C@H](O)CO)[C@H](N=[N+]=[N-])[C@@H]2O1,C25627094_decoy,CXCR4,Decoy,0,-4.20696,-6.51,-1.12,-2.2386121753200525
Cc1nc(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cs1,C31811350_decoy,CXCR4,Decoy,0,-5.84955,-6.98,-1.52,-2.937710326680716
Cc1c(C(=O)N2CCCC2)nnn1-c1nonc1N,C00052422_decoy,CXCR4,Decoy,0,-6.11887,-7.57,-0.96,-6.566185500697876
CCn1cc([N+](=O)[O-])cc1C(=O)NCc1cn[nH]c1,C38007025_decoy,CXCR4,Decoy,0,-5.79921,-7.25,-4.08,-3.1397913315739854
CC(C)n1cc([N+](=O)[O-])cc1C(=O)NCc1cn[nH]c1,C38007031_decoy,CXCR4,Decoy,0,-5.99605,-7.38,-2.84,-3.140846199041195
COC(=O)Cn1cc(NC(=O)c2c(C)n[nH]c2C)cn1,C38030348_decoy,CXCR4,Decoy,0,-6.66538,-6.94,-0.87,-6.926414016757528
COC(=O)[C@H](N[C@H]1N=NC(=O)NC1=O)C(C)C,C38813950_decoy,CXCR4,Decoy,0,-5.95708,-6.07,-2.15,-2.8641551735359547
CC(=O)NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1,C40413061_decoy,CXCR4,Decoy,0,-6.07746,-6.77,-1.78,-2.9911559328822204
Cc1[nH]ncc1S(=O)(=O)N[C@@H](C)c1nncn1C,C40827221_decoy,CXCR4,Decoy,0,-5.96146,-6.44,-2.19,-2.726846073747974
COC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O,C42319432_decoy,CXCR4,Decoy,0,-5.51673,-6.91,-1.79,-2.944594020648862
CCc1nnc(NC(=O)NCc2nncn2C)s1,C43343814_decoy,CXCR4,Decoy,0,-6.53785,-6.55,-1.67,-3.1772238358322005
C[C@@H](Cn1cc[nH+]c1)NC(=O)N1CCO[C@@H](C(=O)[O-])C1,C43706972_decoy,CXCR4,Decoy,0,-5.54391,-6.53,-1.69,-2.7807005550493176
CCOC(=O)c1nc(C)n(Cc2nc(C)no2)c1N,C45007999_decoy,CXCR4,Decoy,0,-6.46865,-6.93,-3.81,-3.2980870896481087
CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1c(C)noc1C,C06612364_decoy,CXCR4,Decoy,0,-6.75586,-6.97,-2.27,-3.404876783418353
Cc1noc(C)c1C(=O)O[C@H](C)C(=O)NC(=O)NC(C)C,C07836005_decoy,CXCR4,Decoy,0,-6.50787,-7.18,-2.88,-3.3983415578138456
COc1ccc(NC(=O)N[C@H](C)c2nncn2C)cn1,C46963812_decoy,CXCR4,Decoy,0,-6.83136,-6.64,-1.61,-6.438732961257404
CC(C)NC(=O)NC(=O)[C@H](C)Sc1nnnn1C,C15797852_decoy,CXCR4,Decoy,0,-6.18961,-6.71,-1.9,-8.379952936218416
CNC(=O)[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-],C48439544_decoy,CXCR4,Decoy,0,-6.45611,-6.0,-3.02,-2.9619914260670086
CNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1C,C48498942_decoy,CXCR4,Decoy,0,-5.87665,-8.5,-1.03,-3.4736048270204685
CNC(=O)NC(=O)CN1CCN(C(=O)OC)CC1,C48584248_decoy,CXCR4,Decoy,0,-5.92848,-5.71,-2.27,-2.785162532481807
O=C(Cn1nnc(-c2ccsc2)n1)Nc1cc[nH]n1,C48798762_decoy,CXCR4,Decoy,0,-6.68224,-5.58,-2.86,-2.7854231484788303
CCc1nnnn1Cc1nc(N)nc(N(C)C)n1,C48838169_decoy,CXCR4,Decoy,0,-6.00467,-7.06,-1.39,-5.922555910793439
COC(=O)NCC(=O)N[C@@H](C)c1nncn1C,C48936130_decoy,CXCR4,Decoy,0,-5.55863,-5.84,-3.05,-2.850706400858935
COC(=O)NCC(=O)NC1(c2noc(C)n2)CCCC1,C48939896_decoy,CXCR4,Decoy,0,-6.50468,-7.17,-3.62,-3.291154145591097
CCc1nnnn1CC(=O)NC(=O)NCC(F)(F)F,C49423049_decoy,CXCR4,Decoy,0,-5.61147,-7.1,-1.54,-3.2938260828152144
CC(C)c1nc(C#N)c(NNC(=O)[C@H]2COCCO2)o1,C49519988_decoy,CXCR4,Decoy,0,-6.96156,-7.6,-2.64,-3.43646764303076
Cc1ccc(-n2nc(C)c([N+](=O)[O-])c2N)nn1,C49960932_decoy,CXCR4,Decoy,0,-4.66309,-6.96,0.02,-4.9275311788763565
CCOC(=O)c1ncn([C@@H](C)c2nncn2C)c1N,C50422179_decoy,CXCR4,Decoy,0,-6.30353,-6.26,-2.86,-2.8842482162048904
CCOC(=O)c1ncn([C@H](C)c2nncn2C)c1N,C50422181_decoy,CXCR4,Decoy,0,-6.21489,-6.56,-2.55,-5.61593616361834
CNC(=O)[C@@H](C)Nc1ncnc(Cl)c1[N+](=O)[O-],C50455375_decoy,CXCR4,Decoy,0,-5.46033,-6.03,-1.59,-2.769987288328194
O=C(Cn1cc([N+](=O)[O-])cn1)NC1(CO)CCCC1,C53068529_decoy,CXCR4,Decoy,0,-6.44189,-7.66,-3.44,-3.40802592677906
O=C(Nc1ccc([N+](=O)[O-])cc1)c1nc[nH]n1,C04991963_decoy,CXCR4,Decoy,0,-5.10638,-7.77,-3.87,-2.818711974547184
CC[C@H](C)NC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1,C57902620_decoy,CXCR4,Decoy,0,-6.41799,-7.6,-1.78,-3.41679298471555
OCCNc1nc(Cl)nc(-n2cncn2)n1,C61535857_decoy,CXCR4,Decoy,0,-6.65354,-6.68,-0.74,-8.172864166771664
CNC(=O)[C@@H](C)Nc1nc(Cl)nc(-n2cncn2)n1,C61538993_decoy,CXCR4,Decoy,0,-7.28096,-7.35,-2.46,-3.4720057143315546
Cc1cc(-n2cnc(C(N)=S)n2)n2ncnc2n1,C61843563_decoy,CXCR4,Decoy,0,-6.56208,-7.3,-0.94,-6.277580814059752
CONS(=O)(=O)c1nnc(NC(C)=O)s1,C62139464_decoy,CXCR4,Decoy,0,-4.99265,-6.22,-0.86,-2.75855142180189
COC(=O)/C=C1\Nc2cc([N+](=O)[O-])ccc2NC1=O,C18116778_decoy,CXCR4,Decoy,0,-6.0015,-7.63,-3.14,-2.9443160154731243
CNc1nc(CSc2ncn[nH]2)nc2c1cnn2C,C63079900_decoy,CXCR4,Decoy,0,-6.2975,-7.11,-1.45,-3.183146234407986
CC(C)CNC(=O)CNc1c(C#N)c(=O)n(C)c(=O)n1C,C64538886_decoy,CXCR4,Decoy,0,-7.17395,-6.97,-2.28,-6.715808072105713
Cc1noc(CCCNC(=O)Nc2nnc(C)s2)n1,C67014529_decoy,CXCR4,Decoy,0,-6.84572,-7.19,-2.13,-3.40201372241086
O=C(NC([NH2+]CCC[NH+]1CCOCC1)(C(F)(F)F)C(F)(F)F)C1CCCCC1,C04301653_decoy,CXCR4,Decoy,0,-7.23203,-7.23,-1.48,-7.1614161769710485
COc1ccc(COC[C@@H](O)C[NH+]2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)cc1,C04324419_decoy,CXCR4,Decoy,0,-8.16468,-8.5,-4.18,-7.189955590066182
C#CC1(OC(=O)CCCCC(=O)OC2(C#C)CC[NH+](C)CC2)CC[NH+](C)CC1,C05510071_decoy,CXCR4,Decoy,0,-8.68755,-6.95,-3.61,-3.8930832989809327
CC1CC[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNC(=S)NCc2ccco2)CC1,C08635595_decoy,CXCR4,Decoy,0,-8.9301,-8.08,-2.18,-10.586706061448965
O[C@@H](COc1cccc(C[NH2+]Cc2ccc(F)cc2F)c1)C[NH+]1CCOCC1,C12597327_decoy,CXCR4,Decoy,0,-8.33007,-6.82,-2.06,-6.8615898292551405
COc1ccc(-c2nn(-c3ccccc3)cc2C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(F)c1,C12744909_decoy,CXCR4,Decoy,0,-8.28381,-7.53,-1.98,-7.05416126038836
COCC[NH+]1CCC[C@@]2(CC[NH+](C3CCN(c4ccc(OC)cc4)CC3)C2)C1,C12305947_decoy,CXCR4,Decoy,0,-9.371,-6.93,-3.03,-6.635352197990526
CC1CC[NH+](C[C@H]2C[NH+]3CC[C@H]2C[C@@H]3CNC(=S)Nc2ccccc2)CC1,C08636225_decoy,CXCR4,Decoy,0,-9.35333,-7.85,-3.91,-4.003229398677721
CN(C)c1ccc(NC(=S)NC[C@H]2C[C@@H]3CC[NH+]2C[C@@H]3C[NH+]2CCSCC2)cc1,C08636232_decoy,CXCR4,Decoy,0,-10.539,-7.82,-2.3,-9.12364442035054
CC1(C)CC([NH+](Cc2cnc(N3CCOCC3)nc2)Cc2cccs2)CC(C)(C)[NH2+]1,C19461035_decoy,CXCR4,Decoy,0,-9.99007,-6.85,-0.49,-8.215741459095353
COCC[NH+]1CCC(C[NH+](Cc2ccncc2)C2CSCCSC2)CC1,C20389534_decoy,CXCR4,Decoy,0,-9.80111,-5.55,-1.48,-7.966869484980672
CCCOc1c(Br)cc(C[NH2+]CC2CC[NH2+]CC2)cc1OCC,C20968160_decoy,CXCR4,Decoy,0,-9.20682,-6.86,-2.05,-4.081801293273779
O=C(NCCCN1CCC([NH+]2CCCCC2)CC1)[C@H]1CCCN(c2[nH+]ccc3sccc23)C1,C33174398_decoy,CXCR4,Decoy,0,-9.9642,-8.35,-3.82,-8.361302270706924
Cc1ccc(C)c(C[NH+](Cc2nc(C(=O)N3CC[NH+](C)CC3)co2)[C@H](C)C(C)C)c1,C36065564_decoy,CXCR4,Decoy,0,-9.40029,-7.75,-4.17,-9.396311602601813
CN(C)c1cc(N2CC[NH+](C/C=C/c3ccccc3)CC2)[nH+]c(N(C)C)c1C#N,C39265176_decoy,CXCR4,Decoy,0,-8.81633,-8.53,-2.04,-9.286822192692314
CC[NH+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)C1=C[C@H]2N=CC=C2C=C1,C39358074_decoy,CXCR4,Decoy,0,-9.75194,-8.08,-1.36,-11.141828149484198
CO[C@H](C(=O)Nc1ccccc1[C@H]1[NH+]=c2ccccc2=[NH+]C1=O)c1ccccc1,C39460408_decoy,CXCR4,Decoy,0,-7.42146,-8.46,-1.18,-9.700264732299482
C[NH+]1CC[C@H](CNC(=O)[C@@H]2CN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC23CC[NH2+]CC3)C1,C39689626_decoy,CXCR4,Decoy,0,-8.6937,-10.01,-2.37,-8.592308655136224
C[C@H](C(=O)C1=c2ccccc2=[NH+]C1)[NH+]1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1,C39736261_decoy,CXCR4,Decoy,0,-8.24299,-7.05,-1.92,-5.877526604822456
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@H](C)S[C@@H]1NN=C(c2cc[nH+]cc2)N1C1CC1,C39776992_decoy,CXCR4,Decoy,0,-8.55234,-8.73,-3.33,-8.388272471077617
CC[NH+](CC)C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNS(=O)(=O)c1ccc(Cl)cc1,C43526848_decoy,CXCR4,Decoy,0,-9.96577,-8.09,-1.76,-8.95998896244212
CC(=O)c1ccc(NC(=O)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3C[NH+]2CCC(C)CC2)cc1,C43527115_decoy,CXCR4,Decoy,0,-9.71836,-7.65,-3.35,-7.209804467353778
COC[C@H]1CCC[NH+]1C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNC(=S)Nc1cccc(Cl)c1,C43528205_decoy,CXCR4,Decoy,0,-10.1848,-8.47,-1.47,-10.775144754605344
Nc1c2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccccc3)c2nc[n+]1CCCn1cc[nH+]c1,C04041896_decoy,CXCR4,Decoy,0,-8.77532,-7.74,-2.51,-7.254977583688722
C[NH+](C)[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1cccnc1)Cc1ccccc1,C22384881_decoy,CXCR4,Decoy,0,-9.56033,-9.1,-2.13,-9.573662419842828
Cc1ccc(NC(=O)COc2ccc(Br)cc2C[NH2+]CC[NH+](C)C)cc1,C20406717_decoy,CXCR4,Decoy,0,-8.82388,-7.39,-1.64,-8.274594404229076
CC[NH+](CC)CCN1C(=O)[C@@H](Cc2ccccc2)[NH2+]C12CCN(C(=O)c1ccccc1Cl)CC2,C36026526_decoy,CXCR4,Decoy,0,-9.72426,-7.56,-1.29,-8.210961166647289
COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)[NH+]2CCC(CC[NH+](C)C)CC2)c1,C56523338_decoy,CXCR4,Decoy,0,-8.50722,-7.7,-2.27,-8.75536206786322
Cc1ccc(C[NH+](CCCn2cc[nH+]c2)Cc2cc(C)n(-c3cccnc3)c2C)o1,C43277755_decoy,CXCR4,Decoy,0,-8.09584,-7.52,-2.77,-7.933107956669806
CC[NH+](CC)CC[n+]1c(N)n(CCOc2ccc3ccccc3c2)c2ccccc21,C59233637_decoy,CXCR4,Decoy,0,-7.6827,-7.61,-1.5,-7.141467026863873
O=C(C[NH+]1CCC[C@@H]([NH+]2CCCC2)C1)Nc1ccc(OC(F)F)c(Cl)c1,C59386196_decoy,CXCR4,Decoy,0,-8.65956,-8.43,-1.4,-7.285596734142574
C[NH+](C)C[C@H]1CCCN1[C@@H](C[NH3+])c1cc(Br)c(Br)o1,C61642761_decoy,CXCR4,Decoy,0,-9.75234,-6.28,-1.23,-8.15568819526344
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCC[NH+]1Cc1ccccc1F,C62356168_decoy,CXCR4,Decoy,0,-8.20251,-8.43,-3.43,-4.147151716015418
Cc1c([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cnn1-c1ccc(F)cc1,C62420935_decoy,CXCR4,Decoy,0,-8.01489,-6.59,-2.55,-6.985931546262534
COc1ccc([C@H](CNC(=O)CN2CC[NH+](C)CC2)C2=c3ccccc3=[NH+]C2)cc1,C63108208_decoy,CXCR4,Decoy,0,-9.0804,-7.75,-3.72,-4.068800905248782
COc1ccc2c(c1)S[C@H](NC(=O)CS[C@H]1[NH+]=c3ccc(C)cc3=[NH+]1)N2,C63229160_decoy,CXCR4,Decoy,0,-8.78633,-9.3,-2.88,-4.0381368558520805
Cc1ccc2c(c1)=C1S[C@@H](C(=O)NCCC[NH+]3C[C@@H](C)C[C@H](C)C3)C=C1C(=O)[NH+]=2,C63490522_decoy,CXCR4,Decoy,0,-8.34652,-8.37,-4.23,-3.795799712132783
O=C(NC(=S)Nc1ccc(C2[NH+]=c3ccccc3=[NH+]2)cc1)c1cncc(Br)c1,C63569264_decoy,CXCR4,Decoy,0,-9.43422,-8.98,-3.91,-9.184974025118114
CCOc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)CCn2cc[nH+]c2C)cc1,C64006734_decoy,CXCR4,Decoy,0,-9.33263,-8.93,-4.07,-9.486441348898838
C[C@@]1(C2CC[NH+](C[C@@H]3C=c4ccccc4=[NH+]3)CC2)NC(=O)N(Cc2ccsc2)C1=O,C64045430_decoy,CXCR4,Decoy,0,-10.6449,-6.98,-1.81,-3.6060975641569297
O=C(Nc1cccc([C@H]2C=c3ccccc3=[NH+]2)c1)[C@@H]1CCC[NH+](Cc2ccc(CO)o2)C1,C64053597_decoy,CXCR4,Decoy,0,-8.04432,-10.12,-3.41,-4.477338925054589
[NH3+][C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@H](SCc2c(F)cccc2Cl)O1,C64428674_decoy,CXCR4,Decoy,0,-8.92704,-8.58,-0.93,-11.46550550479675
Cc1c(C[NH+]2CCC[C@H](C(=O)Nc3cccc([C@@H]4C=c5ccccc5=[NH+]4)c3)C2)cnn1C,C64626195_decoy,CXCR4,Decoy,0,-8.94035,-8.28,-3.42,-7.373812231312262
CC(C)C[C@H](NC(=O)c1cc(F)cc(F)c1)C(=O)NC1[NH+]=c2ccccc2=[NH+]1,C65305823_decoy,CXCR4,Decoy,0,-7.25299,-7.29,-2.87,-6.652194784691207
COc1ccc([C@H](CNC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)[NH+]2CCCC2)cc1,C66174196_decoy,CXCR4,Decoy,0,-9.14271,-8.1,-0.85,-8.07454574604448
O=C(C[NH+]1CCC[C@@H]1C[NH+]1CCCC1)NCCOc1ccc(C(F)(F)F)cc1,C66535174_decoy,CXCR4,Decoy,0,-7.92363,-6.76,-1.24,-6.661216969267398
CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cccc(OCc3ccccc3C#N)c2)CC1,C66905311_decoy,CXCR4,Decoy,0,-8.05893,-7.79,-1.74,-7.239225024440465
CC1CC[NH+](C[C@H](O)C[NH2+]Cc2ccc(Br)c([N+](=O)[O-])c2)CC1,C67122394_decoy,CXCR4,Decoy,0,-7.87969,-7.62,-1.94,-3.5736081516826257
COc1ccc(OC)c(C[NH2+][C@H](C)c2ccc(N3CC[NH+](C)CC3)c(F)c2)c1,C67249049_decoy,CXCR4,Decoy,0,-9.42443,-7.62,-4.76,-4.245553700934104
C[C@H](C[NH2+]Cc1cn(Cc2ccccc2)nc1-c1cccs1)Cn1cc[nH+]c1,C67500600_decoy,CXCR4,Decoy,0,-9.64861,-7.09,-1.53,-8.462259669565354
COc1ccc(C[NH+](Cc2cccs2)C[C@H](O)C[NH+]2CCOCC2)cc1OC,C08187908_decoy,CXCR4,Decoy,0,-8.75703,-7.36,-2.2,-8.171874756548899
C=CC[NH+](C)C[C@H]1C[NH+]2CC[C@H]1C[C@@H]2CNC(=S)NCc1ccco1,C08635569_decoy,CXCR4,Decoy,0,-9.17575,-6.54,-2.62,-7.8912646236829
COc1ccc(C[NH2+]CCc2cccs2)cc1OC[C@H](O)C[NH+]1CCCC1,C11759773_decoy,CXCR4,Decoy,0,-9.87155,-7.25,-1.9,-8.670136641662726
COCC[NH+]1CCC(C[NH+](Cc2ccncc2)Cc2ccsc2)CC1,C11820662_decoy,CXCR4,Decoy,0,-9.51572,-5.74,-3.68,-7.838774832520528
COc1cc(C[NH2+]Cc2ccc(C)o2)ccc1OC[C@H](O)C[NH+](C)C(C)C,C12203372_decoy,CXCR4,Decoy,0,-8.22471,-6.87,-3.37,-3.807718528547604
C[NH+](Cc1ccc(OC[C@@H](O)C[NH+](C)Cc2ccccc2)cc1)Cc1ccno1,C12313944_decoy,CXCR4,Decoy,0,-8.20126,-6.54,-3.55,-6.759640331236362
CCCn1cc(C[NH+]2CCC(CCC(=O)NC[C@H]3CCC[NH+]3CC)CC2)c(C)n1,C12373177_decoy,CXCR4,Decoy,0,-8.66435,-6.81,-2.06,-3.7564677737925214
COc1cc(C[NH2+]Cc2cccc(SC)c2)ccc1OC[C@H](O)C[NH+](C)C(C)C,C12454114_decoy,CXCR4,Decoy,0,-9.4514,-7.96,-2.76,-9.209942379240088
COc1ccc(C[NH2+]C(C)C)cc1OC[C@@H](O)C[NH+](C)Cc1ccccc1,C12597489_decoy,CXCR4,Decoy,0,-9.09426,-7.05,-2.37,-9.095344221816948
CC[NH+](CC)C[C@@H](O)COc1cc(C[NH2+]Cc2c(F)cccc2F)ccc1OC,C12708528_decoy,CXCR4,Decoy,0,-8.58334,-7.46,-2.22,-8.4263385003009
COc1ccc(C[NH2+]CCc2cscn2)cc1OC[C@H](O)C[NH+](C)C(C)C,C12713432_decoy,CXCR4,Decoy,0,-9.35189,-7.22,-2.1,-8.855137129596175
CC[NH+](CC)C[C@@H](O)COc1ccc(C[NH2+]Cc2c(F)cccc2F)cc1OC,C12714070_decoy,CXCR4,Decoy,0,-9.38745,-7.17,-1.93,-8.025822634885936
CC[NH+](CC)C[C@@H](O)COc1cc(C[NH2+]C2CCCC2)ccc1OC,C12716230_decoy,CXCR4,Decoy,0,-8.25922,-6.94,-2.66,-4.031216002804526
C=CC[NH2+]Cc1ccc(OC[C@@H](O)C[NH+]2CCSCC2)c(OC)c1,C12759254_decoy,CXCR4,Decoy,0,-8.42968,-5.84,-3.13,-7.406167057278058
CC[NH+](CC)CCn1c(=[NH2+])n(CC(=O)c2ccc(OC)cc2)c2ccccc21,C05311563_decoy,CXCR4,Decoy,0,-7.06031,-7.31,-2.04,-8.048709582297574
CC[NH+](CC)C[C@@H](O)COc1ccc(C[NH+](C)Cc2cccnc2)cc1OC,C12319398_decoy,CXCR4,Decoy,0,-7.98109,-7.22,-3.22,-7.243184539754096
COCC[NH+]1CCC(C[NH+](Cc2ccncc2)Cc2ccc(OC)cc2OC)CC1,C12434464_decoy,CXCR4,Decoy,0,-9.0007,-7.37,-1.18,-10.419538038924877
CCOCCC[NH2+]Cc1ccccc1OC[C@@H](O)C[NH+]1CCc2ccccc2C1,C15077598_decoy,CXCR4,Decoy,0,-10.0861,-7.03,-3.79,-4.292085970514883
COc1ccc(C[NH2+]C2CCCCC2)cc1OC[C@H](O)C[NH+]1CCCN(C)CC1,C20167832_decoy,CXCR4,Decoy,0,-8.83683,-7.25,-2.07,-8.476035042954953
CC[NH+](Cc1ccccc1)Cc1ccc(OC)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1,C20599137_decoy,CXCR4,Decoy,0,-8.00982,-7.24,-2.97,-7.8656895349525024
CC[NH+]1CCN(C[C@@H](O)COc2cccc(C[NH2+]C3CC3)c2)CC1,C20778133_decoy,CXCR4,Decoy,0,-8.63428,-7.2,-1.31,-7.314630851824247
COCC[NH+](Cc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1)C(C)C,C20910062_decoy,CXCR4,Decoy,0,-8.25368,-6.27,-2.46,-9.333195330660248
CC[C@@H](C)[NH+](Cc1nc(C(=O)NCC[NH+](C)C)co1)Cc1ccc(F)cc1F,C35713460_decoy,CXCR4,Decoy,0,-8.76411,-6.72,-0.59,-7.390553848989238
C[NH+]1CCC[C@@H](OC(=O)CCCCC(=O)O[C@H]2CCC[NH+](C)C2)C1,C36046749_decoy,CXCR4,Decoy,0,-8.78328,-7.19,-1.66,-11.316041354001468
Cc1ccc(OC[C@H](O)C[NH2+]CCC[NH+](C)C)c(Br)c1,C37851710_decoy,CXCR4,Decoy,0,-8.65036,-6.37,-1.06,-9.17829195783668
COc1cc(C(C)=O)ccc1OC[C@H](O)C[NH2+]C[C@@H](c1ccccc1)[NH+](C)C,C22794381_decoy,CXCR4,Decoy,0,-7.80057,-8.47,-3.11,-10.164425241111072
COCCNC(=O)C[NH2+]C[C@H](c1ccc(OC)cc1)[NH+]1CCCC1,C39620377_decoy,CXCR4,Decoy,0,-8.71381,-6.86,-2.59,-8.312991435103463
CC[C@H](C(=O)N1C[C@H](C(=O)NCC[NH+](CC)CC)C2(CC[NH2+]CC2)C1)c1ccccc1,C39626917_decoy,CXCR4,Decoy,0,-8.96319,-7.58,-1.73,-10.050444908754374
COc1ccc([C@H](C[NH2+]C[C@@H](O)COCc2cccc(OC)c2)[NH+]2CCCC2)cc1,C22792069_decoy,CXCR4,Decoy,0,-8.83378,-8.52,-2.12,-12.246625258265237
CC(C)C[C@H](CNC(=O)C(=O)Nc1cccc(C[NH+](C)C)c1)[NH+](C)C,C41322867_decoy,CXCR4,Decoy,0,-8.45041,-6.56,-2.17,-7.522287585406508
CC[NH+](CC)Cc1cccc(NC(=O)C(=O)NC[C@@H](C)[NH+](CC)CC)c1,C41605818_decoy,CXCR4,Decoy,0,-8.81676,-7.77,-3.16,-8.46996767645577
CC(C)CN(CC[NH+](C)C)S(=O)(=O)c1ccc(CC[NH3+])s1,C42782435_decoy,CXCR4,Decoy,0,-7.85792,-6.21,-2.48,-3.4972109642713693
COc1cc(C[NH2+]CCCC[NH+](C)C)cc(Br)c1OC,C45598427_decoy,CXCR4,Decoy,0,-7.60891,-6.78,-2.32,-7.734049840374334
CCC[C@H](C)C[NH+]1CCC(Cn2cc(C[NH+](C)CCO)nn2)CC1,C48302740_decoy,CXCR4,Decoy,0,-7.96602,-5.82,-2.02,-8.908519072058638
COc1ccccc1[C@@H](CNC(=O)NC[C@@H](c1cccs1)[NH+](C)C)[NH+](C)C,C54042182_decoy,CXCR4,Decoy,0,-9.75023,-7.36,-4.19,-4.320409359180382
COc1ccc(CN(CCCn2cc[nH+]c2)C2=[NH+]CCCS2)c(OC)c1,C17076672_decoy,CXCR4,Decoy,0,-8.23255,-6.92,-3.38,-8.052529106677957
CCCCOc1cc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2)ccc1OC,C62254723_decoy,CXCR4,Decoy,0,-8.48929,-7.2,-1.61,-7.961752455791199
COc1cc(C[NH2+]C[C@H](C)[NH+]2CCC(C)CC2)cc(OC)c1OC,C62423520_decoy,CXCR4,Decoy,0,-8.21229,-7.82,-2.87,-7.587270269306547
COCC[NH2+]Cc1cc(Br)c(OCC[NH+](C)C)c(OC)c1,C62729802_decoy,CXCR4,Decoy,0,-7.43761,-5.47,-1.38,-3.620300727312424
COCCN1CC[C@@H](C[NH2+]CC2=CN=[NH+][C@H]2c2ccc(C)c(C)c2)C1,C39399517_decoy,CXCR4,Decoy,0,-9.27947,-7.32,-1.14,-7.830465321637911
CCOCCOc1ccc2ccccc2c1C[NH+]1CCN(CCC[NH3+])CC1,C66143260_decoy,CXCR4,Decoy,0,-9.75045,-7.56,-1.81,-10.651924099673112
CC[C@H](C)[NH+](C)CCNC(=O)N[C@@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C66188412_decoy,CXCR4,Decoy,0,-9.00411,-6.45,-1.99,-6.3238823938166
CCC[C@](C)(NC(=O)C[NH+]1CCC[C@@H]1C[NH+]1CCCC1)C(=O)OC,C66537085_decoy,CXCR4,Decoy,0,-8.09404,-6.83,-1.47,-7.728280363510174
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NC1CC[NH+](CCCOC)CC1,C66703111_decoy,CXCR4,Decoy,0,-9.29476,-6.13,-2.2,-3.8802446539601054
CCCC[NH+]1CCCC[C@@H]1CNC(=O)NC[C@@H]1CC[NH+](CCOC)C1,C66703655_decoy,CXCR4,Decoy,0,-9.7893,-6.53,-3.63,-4.192019989306274
CNC(=O)COc1ccccc1C[NH2+]C[C@H](C(C)C)[NH+]1CCCC1,C67187264_decoy,CXCR4,Decoy,0,-8.51414,-7.62,-3.78,-9.338663581314773
CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2ccccc2OCC(=O)N(C)C)CC1,C67188414_decoy,CXCR4,Decoy,0,-8.18528,-7.72,-1.29,-8.90954403774659
CCOC(=O)C[NH+](CC(=O)NC[C@@H]1CC[NH+](CC(F)(F)F)C1)CC1CC1,C67410403_decoy,CXCR4,Decoy,0,-7.92072,-6.83,-2.09,-4.082295971649665
COc1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc1OCC(C)C,C67500823_decoy,CXCR4,Decoy,0,-7.60441,-6.88,-1.53,-7.697878731802064
CCCOc1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc1OCC,C67500924_decoy,CXCR4,Decoy,0,-7.45822,-6.36,-2.3,-7.504739000629003
Cc1ccc(C(=O)[C@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)c[nH+]3)CC2)cc1,C07989951_decoy,CXCR4,Decoy,0,-7.19281,-8.24,-3.65,-6.0116309657594105
COc1ccc(Br)cc1C[NH+](C)Cc1nc(-c2ccc(Cl)cc2)no1,C09753906_decoy,CXCR4,Decoy,0,-9.6793,-7.67,-1.54,-7.927270614131534
Cc1ccc(C(=O)N(CC[NH+]2CCOCC2)c2nc3c(F)cc(F)cc3s2)cc1C,C10046988_decoy,CXCR4,Decoy,0,-7.97757,-7.33,-1.67,-7.548227358536359
CSc1ccc(C(=O)N(CC[NH+]2CCOCC2)c2nc3c(C)c(C)ccc3s2)cc1,C10127624_decoy,CXCR4,Decoy,0,-10.3625,-9.06,-2.26,-9.2098372274927
Cc1cc2oc3c(c(=O)c2cc1C)[C@@H](c1ccc(Cl)cc1)N(CCC[NH+](C)C)C3=O,C10233144_decoy,CXCR4,Decoy,0,-8.74098,-5.29,-3.91,-5.41693703643318
CC[NH+](CC)CCCN1C(=O)c2oc3cc(C)c(C)cc3c(=O)c2[C@@H]1c1ccccc1,C10233158_decoy,CXCR4,Decoy,0,-8.90153,-9.33,-0.93,-9.566427314181157
Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1C[NH+](C)Cc1ccc(-n2cccn2)cc1,C11879978_decoy,CXCR4,Decoy,0,-7.44313,-8.39,-0.64,-6.03988276741618
COc1ccc(C[NH+]2Cc3cc(C)ccc3O[C@H](c3ccsc3)C2)c(OC)c1OC,C12198052_decoy,CXCR4,Decoy,0,-9.19192,-7.61,-3.47,-8.242377949703728
COc1ccc([C@@H]2C[C@H]3CN(Cc4cccc(Cl)c4)C(=O)[C@]34CCC[NH+]24)c(OC)c1C,C12582177_decoy,CXCR4,Decoy,0,-9.19519,-9.04,-1.35,-7.371384875537943
COc1ccc(-c2nn(-c3ccccc3F)cc2C[NH+](C)[C@@H](C)c2nccs2)cc1,C12711674_decoy,CXCR4,Decoy,0,-8.61468,-7.37,-2.86,-8.06554800267271
COc1ccccc1-c1nn(C[NH+](Cc2c(F)cccc2Cl)C2CC2)c(=S)n1C,C12792396_decoy,CXCR4,Decoy,0,-8.63836,-9.37,-2.34,-8.828926383112206
COc1ccc(Cc2nn(C[NH+](C)Cc3ccc(Cl)c(Cl)c3)c(=S)o2)cc1,C13071942_decoy,CXCR4,Decoy,0,-10.2587,-8.81,-1.42,-8.155366010408905
C[C@H](Sc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(F)cc1)C(=O)c1ccc(Cl)cc1,C12554257_decoy,CXCR4,Decoy,0,-8.48007,-7.16,-3.88,-8.32427818163503
C[C@H](Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(F)cc1)C(=O)c1cccc(Cl)c1,C12557987_decoy,CXCR4,Decoy,0,-8.31933,-8.26,-3.92,-10.254492917465244
CC(C)c1ccccc1-n1c(-c2cccnc2)nn(C[NH+]2CCc3sccc3C2)c1=S,C14309441_decoy,CXCR4,Decoy,0,-9.52475,-6.72,-2.29,-7.135045666935545
CC1(C)C[C@@H](C[NH+]2CCC(Oc3cc(Cl)ccc3C(=O)N3CCCCC3)CC2)CCO1,C14957230_decoy,CXCR4,Decoy,0,-10.4181,-8.17,-1.18,-9.188074707420002
Cc1ccc(-c2cc3c(c(OC[C@H]4CCC[NH+](C)C4)c2)OCCN(C(=O)C2CC2)C3)s1,C14994090_decoy,CXCR4,Decoy,0,-10.0144,-6.28,-2.14,-6.796698578263452
CCc1ccc([C@@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2CCC[NH+](C)C)cc1,C16741933_decoy,CXCR4,Decoy,0,-8.59793,-5.98,-3.03,-5.752924311469641
Cc1cc2c(s1)c1cnn(CC[NH+](C(C)C)C(C)C)c(=O)c1n2Cc1ccc(F)cc1,C19126011_decoy,CXCR4,Decoy,0,-8.69482,-8.44,-2.4,-8.987933842082564
COc1cccc(-c2cc3nc(SCC[NH+]4CCCC4)n(C4CC4)c(=O)c3s2)c1,C19797154_decoy,CXCR4,Decoy,0,-9.31238,-7.52,-0.49,-7.190650775965649
C[C@@H](Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)c1ccc(F)cc1,C23483421_decoy,CXCR4,Decoy,0,-9.44105,-7.55,-2.08,-8.908438099573496
Cc1cc(C)cc(OCC[NH+](C)Cc2nnc(-c3ccc(Br)cc3)o2)c1,C24339796_decoy,CXCR4,Decoy,0,-8.10596,-8.64,-2.18,-7.6019227494251
CC[C@H]1CSC(N(CC(=O)c2ccc3c(c2)OCCO3)c2ccc(Cl)cc2)=[NH+]1,C26442113_decoy,CXCR4,Decoy,0,-9.52252,-6.69,-1.95,-6.913001753478843
CCc1ccc([C@H]2c3c(oc4ccc(Cl)cc4c3=O)C(=O)N2CCC[NH+](C)C)cc1,C32622746_decoy,CXCR4,Decoy,0,-9.05996,-7.84,-1.97,-7.874803908539648
CCc1ccc([C@@H]2c3c(oc4ccc(Cl)cc4c3=O)C(=O)N2CCC[NH+](C)C)cc1,C32622748_decoy,CXCR4,Decoy,0,-9.59882,-8.13,-1.44,-9.212012420977146
CC[NH+](CC)CCN1C(=O)c2oc3ccc(C)cc3c(=O)c2[C@H]1c1ccc(SC)cc1,C35486212_decoy,CXCR4,Decoy,0,-9.55727,-8.8,-1.93,-10.5936744670133
Cc1ccc2oc3c(c(=O)c2c1)[C@@H](c1ccc(Cl)c(Cl)c1)N(CCC[NH+](C)C)C3=O,C35486890_decoy,CXCR4,Decoy,0,-10.0641,-5.31,-2.51,-5.84023020383143
COc1ccc(C2=NN(C(=O)C[NH+](C)Cc3ccccc3)[C@H](c3ccc(F)cc3)C2)cc1,C36341315_decoy,CXCR4,Decoy,0,-7.63796,-7.43,-2.35,-6.038014203673863
COc1ccc(C[NH+]2CCCn3cccc3[C@H]2c2cccc(Cl)c2)c(OC)c1OC,C36347545_decoy,CXCR4,Decoy,0,-9.3141,-7.86,-4.63,-8.508834413262276
O=C(Cc1ccc(Cl)cc1)N(CCCn1cc[nH+]c1)c1nc2c(F)cccc2s1,C38847739_decoy,CXCR4,Decoy,0,-8.82275,-8.3,-1.75,-7.780099144506252
Cc1ccc2sc(N(CCCn3cc[nH+]c3)C(=O)c3ccc(F)cc3F)nc2c1C,C38848055_decoy,CXCR4,Decoy,0,-8.03843,-8.56,-1.26,-9.358922024853603
Cc1ccc2c(c1)=C[C@@H](CN(CC(C)C)S(=O)(=O)c1ccc(Cl)cc1)C(=O)[NH+]=2,C39016447_decoy,CXCR4,Decoy,0,-8.85373,-7.46,-2.05,-7.725627476498096
Cc1ccc2c(c1)=C[C@H](CN(CC(C)C)S(=O)(=O)c1ccc(Cl)cc1)C(=O)[NH+]=2,C39016448_decoy,CXCR4,Decoy,0,-9.412,-8.75,-1.34,-8.50279104510786
CCN1[C@@H](S[C@H]2C(=O)[NH+]=c3ccccc3=C2c2ccccc2)N=N[C@H]1c1cccs1,C39431563_decoy,CXCR4,Decoy,0,-9.17448,-8.54,-1.92,-8.674464370673778
C[C@H](c1cccs1)[NH+](C)[C@@H]1CCC(=O)N(Cc2cc3c(cc2Cl)OCO3)CC1,C39500475_decoy,CXCR4,Decoy,0,-10.0227,-8.59,-1.97,-11.447782575842078
COc1cccc(N(C[C@@H]2C=c3cc(C)ccc3=[NH+]C2=O)C(=O)c2ccc(F)cc2)c1,C39928322_decoy,CXCR4,Decoy,0,-7.37017,-8.95,-3.48,-8.205771220553203
Cc1cccc2c1=[NH+]C(=O)[C@@H](CN(Cc1cccs1)S(=O)(=O)c1ccccc1F)C=2,C39970342_decoy,CXCR4,Decoy,0,-8.89589,-9.1,-2.09,-9.203743766848811
Cc1ccc2c(c1)=C[C@H](CN(Cc1ccccc1)S(=O)(=O)c1ccccc1F)C(=O)[NH+]=2,C39970345_decoy,CXCR4,Decoy,0,-6.39566,-9.52,-2.12,-7.429105503880707
Cc1cc(CN(C)Cc2cc(=O)n3c(C)csc3[nH+]2)cc(C)c1OCC(F)(F)F,C59577810_decoy,CXCR4,Decoy,0,-8.42567,-8.13,-2.11,-9.326720915585076
COc1ccc(CC/[NH+]=C\c2cccn2-c2sc3c(c2C#N)CCCC3)cc1OC,C13941960_decoy,CXCR4,Decoy,0,-8.99107,-7.7,-1.57,-9.452339455203392
COc1cc2c(cc1OC)[C@@H](c1cccs1)N(Cc1[nH+]cc(C)c(OC)c1C)CC2,C60375690_decoy,CXCR4,Decoy,0,-9.25893,-8.26,-2.75,-7.823772235448619
CCCCCN1CC(=O)N2[C@H](CC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2ccc(Cl)cc2)C1=O,C63137245_decoy,CXCR4,Decoy,0,-9.0725,-7.33,-1.04,-6.458756993846349
CCCCCN1CC(=O)N2[C@H](c3ccc(C)cc3)[C@H]3[NH+]=c4ccccc4=C3C[C@H]2C1=O,C63137638_decoy,CXCR4,Decoy,0,-8.57081,-8.58,-1.53,-7.819278069061766
N#Cc1ccccc1Sc1ccccc1C(=O)OCC(=O)C1=c2ccccc2=[NH+]C1,C39946299_decoy,CXCR4,Decoy,0,-8.62831,-9.28,-2.18,-8.259135660552266
COc1ccc2c(c1)=C[C@@H](CN(C(=O)CCc1ccccc1)c1cccc(C)c1)C(=O)[NH+]=2,C63428322_decoy,CXCR4,Decoy,0,-8.83195,-7.49,-1.93,-6.807883109529528
CCN(C(=O)[C@@H]1CC(=O)N(CCC2=c3cc(Cl)ccc3=[NH+]C2)C1)c1ccccc1C,C63557859_decoy,CXCR4,Decoy,0,-8.44705,-8.8,-1.71,-7.411536416707073
CCOC(=O)[C@H]1CCCN(C(=O)CC2=c3ccccc3=[NH+][C@H]2Sc2ccccc2)C1,C63743353_decoy,CXCR4,Decoy,0,-9.32279,-8.1,-1.37,-10.764800574298308
COc1ccc(CN2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2cnn(C(C)C)c2)c(F)c1,C64053748_decoy,CXCR4,Decoy,0,-8.86751,-9.06,-3.8,-11.953245398309257
CCOc1ccccc1[C@H]1[C@H]2[NH+]=c3ccccc3=C2CCN1Cc1ccc(COC)o1,C64074471_decoy,CXCR4,Decoy,0,-8.29868,-8.19,-1.36,-7.7607341637258545
COc1ccc([C@@H]2N=[NH+]C(=S)N2/N=C/C(Br)=C/c2ccccc2)cc1,C39016485_decoy,CXCR4,Decoy,0,-7.86622,-5.98,-1.28,-4.175283768235349
C[NH+](C)CCN1C(=O)c2oc3ccc(Cl)cc3c(=O)c2[C@@H]1c1cccs1,C04337790_decoy,CXCR4,Decoy,0,-9.17719,-6.47,-1.35,-7.292292803985675
CC[NH+]1CCN(C(=O)c2cc(-c3ccccc3)n(-c3ccccc3OC)c2C)CC1,C04421258_decoy,CXCR4,Decoy,0,-8.71244,-8.96,-3.72,-12.13068802779783
COc1ccc(C(=O)N2CC[NH+](C34CC5CC(CC(C5)C3)C4)CC2)cc1OC,C04751649_decoy,CXCR4,Decoy,0,-9.60767,-8.77,-1.81,-4.288412713915719
N#Cc1cccc(C[NH+]2C[C@@H]3C[C@H](C2)c2c(-c4ccco4)ccc(=O)n2C3)c1,C05411659_decoy,CXCR4,Decoy,0,-8.17428,-9.76,-0.69,-11.235619443867034
COc1ccc(Br)cc1C[NH+](C)Cn1c(=O)oc2ccccc21,C06209182_decoy,CXCR4,Decoy,0,-7.61391,-7.92,-3.33,-7.446290669605891
Cc1cccc(N2C(=O)C[C@H]([NH+]3CCN(c4ccc(Cl)cc4)CC3)C2=O)c1,C00821676_decoy,CXCR4,Decoy,0,-8.67553,-8.91,-1.99,-6.252746828487885
C[NH+](C)CCN1C(=O)c2oc3ccc(Cl)cc3c(=O)c2[C@@H]1c1cccc(F)c1,C11614665_decoy,CXCR4,Decoy,0,-9.01598,-8.66,-1.23,-7.856918819294121
O=C(/C=C/c1ccco1)N1CCC[C@@H]([NH+]2CCN(c3ccccc3F)CC2)C1,C12308011_decoy,CXCR4,Decoy,0,-8.56936,-6.2,-1.42,-5.606734714289599
CC[C@@H](C)[NH+]1CCC2(CC1)C(=O)N(Cc1ccc3ccccc3c1)C(=O)N2C,C14742968_decoy,CXCR4,Decoy,0,-8.62966,-9.8,-1.5,-9.9508246176151
COc1cc(-c2nc(C[NH+]3CCCC[C@@H]3c3nccs3)c(C)o2)ccc1F,C14971111_decoy,CXCR4,Decoy,0,-9.645,-8.05,-3.6,-10.18031218455296
COC(=O)[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(C(=O)c2sccc2C)CC1,C25160511_decoy,CXCR4,Decoy,0,-9.34692,-8.72,-1.28,-9.092597270573812
C=C(C)C[NH+]1CCN(c2nc(C)nc3sc4c(c23)CC(C)(C)OC4)CC1,C34749818_decoy,CXCR4,Decoy,0,-9.46587,-8.23,-0.93,-10.003110526373268
CCc1c(C(=O)N2CC[NH+](CC)CC2)c(C2CC2)nn1-c1cccc(Cl)c1,C35638023_decoy,CXCR4,Decoy,0,-8.56545,-7.85,-2.66,-3.881148701138627
COc1ccc(N2CC[NH+](Cc3ccc(F)cc3F)[C@H](C)C2=O)c(OC)c1,C35798825_decoy,CXCR4,Decoy,0,-8.61572,-7.45,-1.2,-7.29869996325778
O=C(C1CCC1)N1CCN(C2=[NH+]N=C(c3ccc(Cl)cc3)CS2)CC1,C38553621_decoy,CXCR4,Decoy,0,-8.29618,-5.0,-3.24,-2.8651299140202235
Cc1cccc2c1=[NH+]C(=O)[C@H](CN(Cc1ccco1)C(=O)c1ccccc1F)C=2,C39000810_decoy,CXCR4,Decoy,0,-8.07081,-9.2,-2.05,-9.168808890316056
Cn1c[nH+]cc1CN1CCC2=NN=C(C3(c4ccc(Cl)cc4)CCCC3)[C@@H]2C1,C39353940_decoy,CXCR4,Decoy,0,-9.32829,-8.05,-1.04,-5.172924670976664
CCOc1ccc([C@@H]2[C@H]3N=C4C=CC=C[C@H]4[C@@H]3CC[NH+]2C[C@@H]2C=CN=N2)cc1,C39515745_decoy,CXCR4,Decoy,0,-8.36545,-7.61,-0.9,-7.169332692337685
Cc1ccc2c(c1)=[NH+]C(=O)[C@H](CN(C[C@@H]1CCCO1)C(=O)c1ccc(F)cc1)C=2,C39699406_decoy,CXCR4,Decoy,0,-8.58914,-6.88,-0.78,-6.4297064089722245
COc1cc2c(cc1OC)C[NH+](C[C@@H]1C=NN=C1c1ccc(Cl)cc1)CC2,C39938324_decoy,CXCR4,Decoy,0,-9.23417,-8.73,-2.34,-8.004775761356322
Cn1cc(C[NH+]2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)c(-c2ccc3c(c2)OCCO3)n1,C43619522_decoy,CXCR4,Decoy,0,-8.73807,-9.4,-0.63,-9.37621406036492
COc1ccc(-c2ccccc2)cc1N1C(=O)[C@H]2C[C@@H]1C[NH+]2Cc1ccoc1,C43631119_decoy,CXCR4,Decoy,0,-7.72934,-7.89,-2.24,-6.611746371143289
C=C1CCC[C@@]2(C)C[C@H]3OC(=O)[C@H](C[NH+]4CCC(C(=O)OCC)CC4)[C@H]3C[C@H]12,C43737214_decoy,CXCR4,Decoy,0,-8.16189,-6.81,-2.49,-6.592988818314828
CCOC(=O)[C@H]1CCC[NH+](C[C@H]2C(=O)O[C@@H]3C[C@]4(C)CCCC(C)=C4C[C@@H]32)C1,C43741056_decoy,CXCR4,Decoy,0,-9.20563,-8.26,-2.18,-8.044779062435616
O=C(C[NH+]1CCC(c2nnc(-c3ccco3)s2)CC1)c1ccc(Cl)cc1,C49363167_decoy,CXCR4,Decoy,0,-9.60908,-9.32,-0.8,-8.235885209047892
Cn1c(-c2ccccc2)c(C(=O)N2CCN(c3cc[nH+]cc3)CC2)c2ccccc21,C52609999_decoy,CXCR4,Decoy,0,-8.37187,-9.37,-3.79,-4.026163133072664
COc1ccc(-c2nn(C[NH+]3CCC[C@@H]3c3ccsc3)c(=S)n2C)cc1,C54513466_decoy,CXCR4,Decoy,0,-10.1967,-6.92,-1.79,-9.027490249197418
Cn1c(-c2ccco2)nn(C[NH+]2CCC[C@@H]2Cc2cccc(F)c2)c1=S,C54546812_decoy,CXCR4,Decoy,0,-8.20047,-8.49,-1.46,-11.497514290226992
COc1cc(C)ccc1OCC(=O)N1c2ccc(C)cc2[C@H]2C[NH+](C)CC[C@@H]21,C60848016_decoy,CXCR4,Decoy,0,-7.39536,-9.16,-0.94,-7.572316416839965
Cc1ccc(-c2ncc(C(=O)N3CCN(c4cc[nH+]cc4)CC3)s2)c(C)c1,C61367061_decoy,CXCR4,Decoy,0,-7.93509,-6.07,-0.48,-5.464200363325036
COc1cc(C(=O)N2CCC(C3=c4ccccc4=[NH+]C3)CC2)ccc1OC(F)F,C63135218_decoy,CXCR4,Decoy,0,-8.75824,-9.13,-1.32,-7.627715337338308
CCCN1CC(=O)N2[C@H](CC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccc(Cl)cc2)C1=O,C63137704_decoy,CXCR4,Decoy,0,-8.56959,-9.28,-1.12,-9.313338192295738
CCCN1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2ccc(C)cc2)C1=O,C63138655_decoy,CXCR4,Decoy,0,-8.12061,-5.8,-1.0,-5.579617294497337
C=CCN1CC(=O)N2[C@H](c3cccc(Cl)c3)[C@@H]3[NH+]=c4ccccc4=C3C[C@H]2C1=O,C63140671_decoy,CXCR4,Decoy,0,-9.24414,-8.02,-0.94,-7.771599182105378
CC[C@@H](C)N1CC(=O)N2[C@@H](CC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccccc2C)C1=O,C63141130_decoy,CXCR4,Decoy,0,-8.27046,-7.78,-1.07,-6.073785190322821
CC(=O)c1ccc(N2CCN(C(=O)C3=c4ccccc4=[NH+][C@@H]3C)CC2)c(F)c1,C63153290_decoy,CXCR4,Decoy,0,-7.55462,-8.86,-1.37,-8.82557846712719
O=C1C[C@@H](C(=O)N2CCc3ccccc32)CN1CCC1=c2cc(Cl)ccc2=[NH+]C1,C63557285_decoy,CXCR4,Decoy,0,-7.76992,-10.79,-0.93,-5.095921427205639
O=C1C[C@H](C(=O)N2CCc3ccccc32)CN1CCC1=c2cc(Cl)ccc2=[NH+]C1,C63557287_decoy,CXCR4,Decoy,0,-8.65908,-10.37,-2.04,-8.16668438979967
O=C1C[C@@H](C(=O)N2CCc3ccccc32)CN1CCC1=c2cc(F)ccc2=[NH+]C1,C63557404_decoy,CXCR4,Decoy,0,-7.334,-9.32,-0.53,-7.600358636016779
O=C(CC1CCN(C(=O)[C@@H]2C=c3cc(Cl)ccc3=[NH+]2)CC1)N1CCCCC1,C63739409_decoy,CXCR4,Decoy,0,-7.72704,-9.93,-1.36,-3.947577514908037
C[C@@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)SC1=Nc2ccccc2[C@H]2CC=NN12,C38691467_decoy,CXCR4,Decoy,0,-8.36014,-9.16,-2.96,-4.60451357753977
CCn1cc(C(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3[C@H]2C2CCCCC2)cn1,C64040254_decoy,CXCR4,Decoy,0,-8.36016,-10.04,0.09,-9.588145034184596
CCn1cc(C(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2ccccc2F)cn1,C64074352_decoy,CXCR4,Decoy,0,-8.02216,-7.03,-3.4,-6.252323842089463
O=C(CCC1=c2ccccc2=[NH+]C1)N1C[C@@H]2C[C@H]1C(=O)N2c1ccccc1Cl,C64131738_decoy,CXCR4,Decoy,0,-8.43968,-9.64,-0.5,-8.396421963909823
CCOc1ccc([C@H]2[C@@H]3[NH+]=c4ccccc4=C3CCN2Cc2cnn(C)c2)cc1,C64137289_decoy,CXCR4,Decoy,0,-8.68298,-6.04,-3.47,-6.705964350039105
CCOc1ccc([C@@H]2[C@H]3[NH+]=c4ccccc4=C3CCN2C(=O)c2ccncc2)cc1,C64568191_decoy,CXCR4,Decoy,0,-8.59621,-8.85,-2.04,-8.994224072232903
Cc1sc2ncnc(N3CCC([C@@H](C)N4CC[NH+](C)CC4)CC3)c2c1C,C65374698_decoy,CXCR4,Decoy,0,-9.82205,-8.48,-3.07,-8.293628990027294
CC1=c2ccccc2=[NH+][C@@H]1c1c(-c2ccccc2)ncn1CCS(C)(=O)=O,C65435536_decoy,CXCR4,Decoy,0,-8.57421,-7.87,-2.19,-7.703598907781263
COc1ccc(S(=O)(=O)N(C)C2CC[NH+](C3CCC(C)CC3)CC2)cc1,C66103417_decoy,CXCR4,Decoy,0,-8.9271,-8.68,-2.12,-3.946123600578168
Cc1ccc(C)c(OC2CC[NH+]([C@@H](C)c3nnc(-c4cccs4)o3)CC2)c1,C66437307_decoy,CXCR4,Decoy,0,-9.4831,-8.59,-2.46,-10.709480907364558
CC[NH+](CC)CCN1C(C)=CC(=Cc2sc3ccccc3[n+]2C)C=C1C,C05444971_decoy,CXCR4,Decoy,0,-8.5921,-6.8,-1.62,-7.504007085574829
Cc1c(CCC(C)C)c(NCCC[NH+]2CCOCC2)[n+]2c([nH]c3ccccc32)c1C#N,C01798381_decoy,CXCR4,Decoy,0,-9.32103,-8.28,-1.17,-9.29951873875144
Cc1ccc(S(=O)(=O)Nc2ccc(N3CC[NH+](C)CC3)[nH+]c2)s1,C11857373_decoy,CXCR4,Decoy,0,-8.05943,-7.44,-2.37,-3.32239459745388
COc1cc(C(=O)NCC[C@@H]2CCC[NH+]2C)ccc1OC1CC[NH+](C2CCCC2)CC1,C12225426_decoy,CXCR4,Decoy,0,-9.11413,-7.96,-3.96,-4.196774964590291
CCc1nc(C)c(C[NH+]2CC[C@]3(CCC[NH+](Cc4cccc(OC)c4OC)C3)C2)[nH]1,C12440646_decoy,CXCR4,Decoy,0,-9.52294,-7.6,-2.57,-7.703840186832263
CCC[NH+]1CCC([NH+]2CCC(C(=O)N[C@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)CC1,C04261664_decoy,CXCR4,Decoy,0,-8.21503,-7.76,-2.14,-6.837808490648172
CSc1ncc(C[NH+](Cc2ccncc2)CC2CC[NH+](C3CCN(C)CC3)CC2)cn1,C20389195_decoy,CXCR4,Decoy,0,-11.934,-7.64,-2.34,-4.667330684257473
O[C@H]1C[NH+](Cc2ccccc2OC(F)F)C[C@@H]1N1CCN(c2cccc[nH+]2)CC1,C20534995_decoy,CXCR4,Decoy,0,-9.13466,-9.29,-1.75,-9.101485937428771
CCCn1nc(C(=O)N2CC[NH+](C)CC2)c2c1CC[C@@H]([NH2+]CCCSC)C2,C20993123_decoy,CXCR4,Decoy,0,-10.3007,-6.83,-3.48,-10.114354657626668
C[n+]1c(N/C(=[NH+]/c2ccccc2)c2ccccc2)sn(-c2ccccc2)c1=S,C28120148_decoy,CXCR4,Decoy,0,-9.17798,-7.78,-2.18,-7.798258722315692
CC[n+]1c(/C=C2/C=C(/C=C/[NH+](C)C)Oc3ccccc32)sc2ccccc21,C32519846_decoy,CXCR4,Decoy,0,-8.78156,-8.43,-1.02,-8.110487204736042
Ic1ccc(C[NH2+][C@@H]2CCC[C@H]2n2cc[nH+]c2)o1,C37313985_decoy,CXCR4,Decoy,0,-7.78553,-7.1,-1.02,-6.719672512567352
CC(C)(C)c1nn(-c2ccc(Cl)cc2)c2c1=C[C@H](C[NH2+]Cc1ccccc1)C(=O)[NH+]=2,C38790140_decoy,CXCR4,Decoy,0,-9.15362,-6.9,-1.18,-6.799495134272753
COP(=O)(OC)[C@@H](c1ccccc1)[C@H]1[NH+]=c2ccccc2=[NH+]C1=O,C39205331_decoy,CXCR4,Decoy,0,-5.87014,-6.18,-3.24,-2.5408758899351294
CCCCc1[nH]cc(CN2CCC([NH+]3CCC(C(=O)N4CCCC4)CC3)CC2)[nH+]1,C39430380_decoy,CXCR4,Decoy,0,-9.10594,-7.22,-0.94,-7.290547942845737
COC(=O)[C@H]1[NH+]=c2ccc(C)cc2=C1NC(=O)CC[NH+]1CCCCC1,C39578880_decoy,CXCR4,Decoy,0,-8.50285,-7.35,-1.57,-11.009955291547644
COc1ccc2c(c1)=[NH+]C(=O)[C@H]([C@H]1[NH2+]CCc3cc(OC)c(OC)cc31)C=2,C40011050_decoy,CXCR4,Decoy,0,-7.92447,-7.41,-2.97,-5.792849404385452
COc1ccc2c(c1)=C[C@H]([C@H]1[NH2+]CCc3cc(OC)c(OC)cc31)C(=O)[NH+]=2,C40011054_decoy,CXCR4,Decoy,0,-8.32053,-8.66,-1.35,-7.273737456309433
COC[C@H]1CCC[NH+]1C[C@H]1C[NH+]2CC[C@@H]1C[C@@H]2CNS(C)(=O)=O,C43527611_decoy,CXCR4,Decoy,0,-9.00891,-6.98,-0.85,-9.23872385910356
CC[NH+]1CCC(NC(=O)CSc2[nH+]c(C)c(C)n2C[C@H]2CCCO2)CC1,C45650023_decoy,CXCR4,Decoy,0,-10.0668,-7.5,-2.01,-7.856102670085698
CC1CCC(NC(=O)[C@H](C)[NH+]2CCN(CC[NH+]3CCCC3)CC2)CC1,C46062990_decoy,CXCR4,Decoy,0,-8.15507,-6.77,-4.74,-3.412874730418188
C[NH+]1CCN(c2cc(CNC(=O)/C=C/c3ccc(F)cc3)cc[nH+]2)CC1,C47398313_decoy,CXCR4,Decoy,0,-8.46057,-8.66,-1.54,-7.453970152682733
C[C@H](O)Cc1cn(CC2CC[NH+](CC(C)(C)C[NH+]3CCCC3)CC2)nn1,C48063566_decoy,CXCR4,Decoy,0,-9.31151,-7.63,-1.62,-8.319825228865406
Cc1cccc(OCCC(=O)NCc2cc[nH+]c(N3CC[NH+](C)CC3)c2)c1C,C48336429_decoy,CXCR4,Decoy,0,-7.883,-7.29,-1.56,-6.860154807127847
C[NH+]1[C@@H](CCC(=O)N2CCc3ccccc32)CNC(=O)[C@@H]2[C@H]1CC[NH+]2Cc1cccs1,C22922714_decoy,CXCR4,Decoy,0,-10.1638,-8.92,-1.18,-9.241879618332902
Brc1cc(C[NH2+]CCCCn2cc[nH+]c2)oc1Br,C50361438_decoy,CXCR4,Decoy,0,-8.58682,-6.27,-0.76,-7.343052571028479
C[NH2+]CC1(C[NH+](C)Cc2cc(Br)cs2)CCOCC1,C52182807_decoy,CXCR4,Decoy,0,-8.60507,-5.82,-1.21,-7.370712671771532
C[NH+](Cc1csc(Br)c1)Cc1cc(C[NH2+]C2CC2)no1,C52547601_decoy,CXCR4,Decoy,0,-9.26211,-5.53,-1.23,-7.12990918493741
CCOc1ccc(OC[C@@H](O)C[NH+]2CCC[C@H]([NH+]3CCCC3)C2)cc1,C59386209_decoy,CXCR4,Decoy,0,-9.48462,-7.46,-1.73,-11.394411737929795
C[NH2+]CC1CC[NH+](Cc2cc3c(cc2Br)OCCO3)CC1,C63166099_decoy,CXCR4,Decoy,0,-9.21008,-7.13,-3.1,-8.392980168645312
CCOC(=O)[C@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)CC[NH+](C)C,C38601111_decoy,CXCR4,Decoy,0,-8.26866,-7.42,-1.23,-3.9374167794574495
COC(=O)c1ccc2c(c1)C(C)(C)C(/C=C/C1=c3ccccc3=[NH+][C@H]1C)=[N+]2C,C63416479_decoy,CXCR4,Decoy,0,-9.20981,-10.19,-2.24,-8.863550664501117
CC[NH+](CC)CCCNC(=O)[C@H]1C=C2C(=O)[NH+]=c3ccccc3=C2N1C,C63480477_decoy,CXCR4,Decoy,0,-8.15134,-7.83,-2.29,-8.428764391775704
CN1C2=c3ccccc3=[NH+]C(=O)C2=C[C@H]1C(=O)NCCC[NH+]1CCCC1,C63480577_decoy,CXCR4,Decoy,0,-8.22258,-8.04,-1.43,-9.434640601132797
CC(C)C[C@H]1CC(=O)O[C@@]1(C)C(=O)CSC1[NH+]=c2ccccc2=[NH+]1,C63720238_decoy,CXCR4,Decoy,0,-8.59363,-7.93,-1.12,-6.886235750275845
S=C1N(C[NH+]2CCCC2)N[C@@H](C2=c3ccccc3=[NH+]C2)N1C[C@@H]1CCCO1,C63775675_decoy,CXCR4,Decoy,0,-8.32211,-7.0,-0.87,-7.337796469720327
CC(C)[C@@H](C(=O)NC1[NH+]=c2ccccc2=[NH+]1)N1Cc2ccccc2C1=O,C63821491_decoy,CXCR4,Decoy,0,-7.27114,-8.96,-0.85,-8.15873575298801
CC(C)n1cc(C[NH+]2CC[C@@H](N3CC[NH+](CCc4ccccc4)CC3)[C@H](O)C2)cn1,C22852890_decoy,CXCR4,Decoy,0,-9.68113,-7.54,-1.63,-6.560785570759529
C[NH+]1CCN(CC[NH2+][C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1,C44791070_decoy,CXCR4,Decoy,0,-8.13928,-7.25,-1.07,-8.518756092768458
COc1ccc(N2CC[NH+]([C@@H]3CCCN(Cc4c[nH+]c(C)[nH]4)C3)CC2)cc1,C20452218_decoy,CXCR4,Decoy,0,-9.64716,-7.1,-2.16,-7.093981840429537
O=C1CC(C(F)F)=NC(c2ccccc2C[NH+]2CCC(Cn3cc[nH+]c3)CC2)=N1,C64074128_decoy,CXCR4,Decoy,0,-8.21162,-7.04,-1.65,-6.1795150809237525
COCCNC(=O)CCC1CC[NH+](C[C@@H]2C=c3ccccc3=[NH+]2)CC1,C64074419_decoy,CXCR4,Decoy,0,-8.06829,-7.11,-1.89,-7.288916580751639
C[NH+](C)CCN1C[C@@H](C(=O)NC[C@H]2C=c3cc(F)ccc3=[NH+]2)CCC1=O,C64093868_decoy,CXCR4,Decoy,0,-8.65495,-8.19,-2.26,-7.179563723984589
O=C(C[NH+]1CCC[C@H]1C(=O)Nc1ccccc1)C1=c2ccccc2=[NH+]C1,C64120523_decoy,CXCR4,Decoy,0,-7.06128,-8.4,-0.66,-7.379429589872037
CC[NH+]1CCN(c2cc(CNC(=O)c3ccc(-n4cccc4)cc3)cc[nH+]2)CC1,C64417544_decoy,CXCR4,Decoy,0,-8.20259,-8.53,-3.33,-4.352025606292372
C[C@H](C(=O)NCCC[NH+]1CCCC1)C1CCN(C(=O)[C@@H]2C=c3ccccc3=[NH+]2)CC1,C64540626_decoy,CXCR4,Decoy,0,-8.20675,-8.21,-2.16,-3.65934005143105
O=C(NCc1cccc(F)c1)[C@H]1CCCN([C@H]2[NH+]=c3ccccc3=[NH+]C2=O)C1,C64927127_decoy,CXCR4,Decoy,0,-8.82143,-9.09,-0.94,-8.675639472525065
CCc1nc(N2CC[NH+](C3CCN(C(=O)C(C)C)CC3)CC2)cc(C)[nH+]1,C65410415_decoy,CXCR4,Decoy,0,-9.3252,-8.16,-1.99,-7.808401397705151
Cn1cnnc1CC1CC[NH+](C[C@@H]2C=c3ccc(F)cc3=[NH+]C2=O)CC1,C65529849_decoy,CXCR4,Decoy,0,-9.25316,-7.25,-2.0,-3.37495147229994
C[NH+](C)[C@@H]1CCCN(C(=O)CSCC(=O)N2CCC[C@H]([NH+](C)C)C2)C1,C67045133_decoy,CXCR4,Decoy,0,-8.56379,-7.24,-2.54,-8.076343379320347
COC[C@H](Cl)C(=[NH2+])NS(=O)(=O)c1c(C)cc(Cl)cc1Cl,C04277599_decoy,CXCR4,Decoy,0,-9.18502,-6.89,-1.62,-9.796448053292169
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1cccc(Cl)c1)c1ccsc1,C08863576_decoy,CXCR4,Decoy,0,-9.2085,-7.2,-1.93,-7.4128019688554465
Cc1cc(C)c(NC(=O)C[NH+](C)[C@H](C)C(=O)NCC(F)(F)F)c(C)c1,C12698008_decoy,CXCR4,Decoy,0,-7.55892,-7.3,-3.86,-3.79507916689792
Cc1cc(C)c(NC(=O)C[NH+](C)[C@@H](C)C(=O)NCC(F)(F)F)c(C)c1,C12698012_decoy,CXCR4,Decoy,0,-7.85612,-8.09,-2.88,-8.021584103523443
C[NH+]1CCN(c2ccc(NC(=S)NC(=O)c3ccccc3)cc2)CC1,C14257852_decoy,CXCR4,Decoy,0,-8.61995,-5.97,-3.19,-6.397825253585107
COc1ccc([C@H](C[NH3+])N2CCN(c3ccccc3)CC2)cc1OC,C19796349_decoy,CXCR4,Decoy,0,-7.77683,-7.38,-1.89,-6.8630513422695145
C[C@@H](C(=O)NC(=O)NCC(F)(F)F)[NH+](C)Cc1cccc(Cl)c1,C24373800_decoy,CXCR4,Decoy,0,-6.56792,-8.01,-2.18,-3.765714372857876
CNC(=O)c1cccc(NC(=O)[C@@H](C)[NH+](C)Cc2ccc(F)cc2F)c1,C25075033_decoy,CXCR4,Decoy,0,-7.28745,-8.18,-3.77,-3.7861379370272426
COc1cc(Br)c(C[NH2+]CC(=O)NC(C)C)cc1OC,C35011319_decoy,CXCR4,Decoy,0,-8.01438,-6.49,-1.3,-7.573120601015664
CC(C)[NH2+]CCC(=O)Nc1cc2c(cc1Br)OCCO2,C37654953_decoy,CXCR4,Decoy,0,-8.3658,-6.1,-1.09,-6.42700321986885
O=S1(=O)CC[C@H]([NH2+]C[C@H](O)COc2cc(Cl)ccc2Cl)C1,C37850317_decoy,CXCR4,Decoy,0,-9.34412,-7.48,-1.02,-8.008947386660617
O[C@H](C[NH2+]C[C@H]1COCCO1)COc1ccc(Cl)c(Cl)c1,C38061408_decoy,CXCR4,Decoy,0,-9.17675,-6.67,-1.98,-3.917732248389007
CC[C@H](C)C(=O)N1C[C@H](C(=O)NCCC(C)C)C2(CC[NH2+]CC2)C1,C39601126_decoy,CXCR4,Decoy,0,-7.81312,-7.73,-1.27,-9.55640452549236
CC[C@@H](C)C(=O)N1C[C@H](C(=O)N[C@H](C)C(C)C)C2(CC[NH2+]CC2)C1,C39607989_decoy,CXCR4,Decoy,0,-7.91299,-7.29,-1.31,-8.034267404917053
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC2CCC2)C2(CC[NH2+]CC2)C1,C39635365_decoy,CXCR4,Decoy,0,-8.28927,-7.4,-0.56,-8.153248843692875
C[C@H]1[NH+]=c2ccccc2=C1C(=O)[C@@H](C)S[C@@H]1NN=C(NC2CC2)S1,C39785404_decoy,CXCR4,Decoy,0,-8.87778,-8.83,-2.99,-3.979149730427272
O[C@@H](C[NH2+]Cc1cc(Br)ccc1F)COc1cnsn1,C41069402_decoy,CXCR4,Decoy,0,-9.43317,-7.34,-0.95,-7.783532342273418
C[C@@H]1CCCC[NH+]1CCNC(=O)C(=O)Nc1ccc(Cl)c(F)c1,C41664747_decoy,CXCR4,Decoy,0,-8.44924,-6.09,-3.43,-3.365724013047087
C[C@H]1CCCC[NH+]1CCNC(=O)C(=O)Nc1ccc(Cl)c(F)c1,C41664753_decoy,CXCR4,Decoy,0,-8.3306,-7.66,-2.44,-7.241324679310363
CC(C)[NH+](C)CCCNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F,C41716433_decoy,CXCR4,Decoy,0,-8.42983,-6.54,-4.38,-3.797159470406981
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)C(=O)Nc2ccc(F)c(F)c2)C1,C41724601_decoy,CXCR4,Decoy,0,-8.49851,-8.3,-2.52,-7.651841981571216
CC[C@H]([NH3+])[C@H](Sc1nnnn1C)c1ccc(Br)cc1,C42958683_decoy,CXCR4,Decoy,0,-7.71636,-7.25,-1.43,-7.767715310427668
C[C@@H]([NH3+])[C@@H](Sc1nnnn1C1CC1)c1cc(Br)cs1,C43290533_decoy,CXCR4,Decoy,0,-8.33621,-7.15,-1.66,-9.921597890451295
COC(=O)[C@H]([NH3+])Cc1cc(Cl)c(N2CCOCC2)c(Cl)c1C,C44336065_decoy,CXCR4,Decoy,0,-9.04039,-6.95,-1.15,-13.350244032735734
Cc1cc(C[NH2+]C[C@@H](O)COc2cccc(Br)c2)on1,C44991405_decoy,CXCR4,Decoy,0,-8.25891,-6.88,-2.08,-6.675259786422663
C=CCNC(=O)NC(=O)[C@H](C)[NH+](C)Cc1cc(Br)cs1,C48575445_decoy,CXCR4,Decoy,0,-8.33257,-7.22,-1.52,-7.327450720636827
C#Cc1cccc(NC(=O)C(=O)NC[C@@H](c2cccc(F)c2)[NH+](C)C)c1,C48842455_decoy,CXCR4,Decoy,0,-7.62564,-9.27,-2.58,-8.966908826840047
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc(F)cc1)c1cccc(F)c1,C48842901_decoy,CXCR4,Decoy,0,-7.76789,-8.15,-2.76,-4.027864200109367
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1c(F)cccc1F)c1cccc(F)c1,C48843287_decoy,CXCR4,Decoy,0,-8.28316,-9.21,-1.83,-9.070221534457524
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)C(=O)Nc1ccccc1F,C48853562_decoy,CXCR4,Decoy,0,-9.73827,-7.44,-2.79,-4.029747226950968
C[NH+](C)Cc1cccc(NC(=O)C(=O)NCCc2cccs2)c1,C48917495_decoy,CXCR4,Decoy,0,-9.1151,-7.9,-3.88,-4.150480038267244
C[C@H]([NH2+]C[C@H](O)COc1ccc(Cl)cc1Cl)C(=O)N(C)C,C49098862_decoy,CXCR4,Decoy,0,-7.76316,-6.49,-0.95,-6.620421572761303
Cc1[nH]nc(C(=O)NC[C@@H](C)C[NH+]2CCCCC2)c1Br,C49117183_decoy,CXCR4,Decoy,0,-7.85712,-7.62,-0.74,-7.933910143865781
CC[NH2+][C@@H](C)c1cc(Cl)ccc1O[C@@H]1CS(=O)(=O)C[C@@H]1O,C50210212_decoy,CXCR4,Decoy,0,-8.53582,-7.35,-1.46,-8.903804327894317
COc1ccc(N2CCN([C@@H](C[NH3+])c3ccccc3OC)CC2)cc1,C19795742_decoy,CXCR4,Decoy,0,-8.4591,-7.3,-1.21,-7.759525224187659
Cc1cccc(OC[C@@H](O)C[NH+]2CCC(C(=O)NC3CC3)CC2)c1,C56511297_decoy,CXCR4,Decoy,0,-8.63665,-8.27,-1.45,-7.998326836129151
O=C(NC[C@H]1CC[NH+](CC(F)(F)F)C1)N[C@H]1CCOc2ccccc21,C43165241_decoy,CXCR4,Decoy,0,-7.50981,-9.44,-2.25,-8.66869902007617
CC(=O)NCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(C)c(Cl)c2)CC1,C47773447_decoy,CXCR4,Decoy,0,-8.80597,-7.92,-0.97,-8.766409976763546
C[C@H](NC(=O)C(=O)Nc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1,C48724791_decoy,CXCR4,Decoy,0,-8.23793,-8.8,-1.23,-7.674253371828096
COC(=O)CC[C@@H]([NH3+])Cc1cc(Br)c2c(c1)OCCCO2,C61893233_decoy,CXCR4,Decoy,0,-8.65722,-7.84,-5.02,-2.883669565479205
O=C(COc1ccc(Cl)cc1)Nc1ccc(C2=[NH+]CCN2)cc1,C62565608_decoy,CXCR4,Decoy,0,-8.2408,-8.23,-2.03,-7.649962314753166
CC(C)[NH2+]Cc1ccc(OC[C@H]2CNC(=O)O2)c(Br)c1,C62701787_decoy,CXCR4,Decoy,0,-7.32955,-7.33,-1.22,-6.371953588905643
CC[NH2+][C@@H](c1cn[nH]c1)c1cc(OC)c(OC)cc1Br,C62776644_decoy,CXCR4,Decoy,0,-7.00057,-6.82,-2.2,-7.577687639256291
O=C(Nc1ccc(Cl)cc1F)C(=O)NC1CC[NH+](CC(F)F)CC1,C64304370_decoy,CXCR4,Decoy,0,-8.81564,-7.37,-4.16,-7.404292402553573
Cc1cc(C)n([C@@H](C)C[NH2+]CC(=O)Nc2c(C)cccc2C(C)C)n1,C65386084_decoy,CXCR4,Decoy,0,-8.15596,-7.76,-2.16,-8.8134279934168
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCN(CCC[NH3+])CC1,C66143001_decoy,CXCR4,Decoy,0,-6.97207,-7.28,-1.67,-9.122429701872186
COc1ccc2cc(CN(C)C(=O)C[NH2+]C(C)(C)CO)ccc2c1,C66862745_decoy,CXCR4,Decoy,0,-6.78454,-6.51,-1.11,-6.086899180964931
Cc1cn2c(C[NH2+]C[C@H]([O-])C[NH+]3CCC(C)CC3)c(C)nc2s1,C67122510_decoy,CXCR4,Decoy,0,-9.59394,-7.99,-0.62,-8.713911473048574
Cc1cc(C)c(NC(=O)CNC(=O)[C@H](C(C)C)[NH+]2CCCC2)c(C)c1,C67290416_decoy,CXCR4,Decoy,0,-8.07382,-8.16,-1.92,-7.361283641317823
C[C@@H]1C[C@@H](C)C[NH+](C[C@@H](C)NC(=O)C(=O)Nc2ccc(F)cc2F)C1,C67439209_decoy,CXCR4,Decoy,0,-8.00787,-6.61,-2.35,-5.960548417053363
COc1ccc(N2CC[NH+](C[C@H](O)COc3ccc(Cl)cc3)CC2)cc1,C00719704_decoy,CXCR4,Decoy,0,-8.83228,-6.46,-1.03,-7.336765193173172
CC[C@@H]([NH2+]CCOC)c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1,C04572341_decoy,CXCR4,Decoy,0,-7.50186,-7.81,-1.47,-8.524857652963775
COc1ccc(C2(C[NH2+]C[C@H]3COc4ccccc4O3)CCCC2)cc1OC,C04811826_decoy,CXCR4,Decoy,0,-9.00102,-7.8,-2.42,-8.123369507970807
CN(C)c1ccc([C@@H](CNS(=O)(=O)c2ccc(Cl)cc2)[NH+](C)C)cc1,C05098872_decoy,CXCR4,Decoy,0,-8.8558,-7.71,-1.22,-8.511345223017361
CC1CC[NH+](C[C@@H](C)NC(=O)[C@H](C)n2nc(C(F)(F)F)cc2C2CC2)CC1,C02782158_decoy,CXCR4,Decoy,0,-8.29718,-8.74,-2.95,-4.026989336333643
C[NH+](C)[C@@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)c1ccco1,C06608959_decoy,CXCR4,Decoy,0,-8.54521,-8.82,-3.18,-8.71263869598458
C[C@@H](C(=O)Nc1ccccc1C#N)[NH+](C)Cc1ccc(OC(F)F)cc1,C07421197_decoy,CXCR4,Decoy,0,-6.61475,-8.05,-2.0,-6.129908113434215
COc1ccc2c(CC(=O)NC[C@@H](c3ccccc3)[NH+]3CCCC3)coc2c1,C07686506_decoy,CXCR4,Decoy,0,-7.91196,-8.32,-1.43,-8.03048199777856
COc1ccc(C[NH+](C)[C@H](C)C(=O)c2c(C)[nH]c3ccccc23)cc1OC,C07929878_decoy,CXCR4,Decoy,0,-8.31806,-8.83,-1.85,-7.833049076593242
CCOc1cc2c(cc1C[NH2+][C@H](C)c1ccc(-n3ccnc3)cc1)O[C@H](C)C2,C07984344_decoy,CXCR4,Decoy,0,-8.88919,-8.43,-3.05,-8.163682794148684
CC(=O)c1c(C)[nH]c(C(=O)C[NH+](C)CCOc2ccc(Cl)cc2)c1C,C08120570_decoy,CXCR4,Decoy,0,-7.41363,-8.04,-2.04,-6.265462145993648
COc1c(C)cc(S(=O)(=O)NC[C@H](c2ccsc2)[NH+]2CCCC2)cc1C,C08900018_decoy,CXCR4,Decoy,0,-9.48918,-7.57,-2.65,-9.214633042226868
COc1ccc(S(=O)(=O)NC[C@H](c2ccc(C)cc2)[NH+](C)C)cc1C,C10090507_decoy,CXCR4,Decoy,0,-8.30903,-7.43,-2.01,-7.329644727323816
COc1ccc(F)cc1S(=O)(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C,C10090553_decoy,CXCR4,Decoy,0,-7.70212,-8.37,-1.17,-8.301358575057103
COc1cccc([C@H](CNS(=O)(=O)c2ccc3ccccc3c2)[NH+](C)C)c1,C10091614_decoy,CXCR4,Decoy,0,-8.80249,-9.18,-3.8,-8.884852353010379
CCc1ccc(S(=O)(=O)NC[C@H](c2ccc(OC)cc2)[NH+](C)C)cc1,C10506496_decoy,CXCR4,Decoy,0,-7.63147,-7.96,-1.38,-7.610358996587377
Cc1ccc(-c2nn(-c3cccc(F)c3)cc2C[NH2+]CCc2ccco2)o1,C11843091_decoy,CXCR4,Decoy,0,-6.93519,-6.52,-2.96,-5.79686168595434
C[C@@H](C(=O)Nc1cccc(C#N)c1)[NH+](C)CCOc1ccccc1Cl,C15103441_decoy,CXCR4,Decoy,0,-8.1303,-8.2,-3.99,-4.111539849216708
COc1ccc(C[NH+](C)CC(=O)Nc2ccc(Cl)cc2C)cc1OC,C07973611_decoy,CXCR4,Decoy,0,-8.70776,-7.26,-2.18,-9.376914119273414
CC[C@@H](CN1CC[NH+](C)CC1)NC(=O)Cc1ccc(OC)c2ccccc12,C19365222_decoy,CXCR4,Decoy,0,-7.97743,-9.08,-1.46,-12.286416307158545
CC[NH+](CC)[C@@H](CNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1Cl,C22681748_decoy,CXCR4,Decoy,0,-9.02952,-7.41,-1.66,-7.213538116155843
COC(=O)c1sccc1NC(=O)C[NH+](C)[C@@H](C)c1ccc(F)c(F)c1,C23356117_decoy,CXCR4,Decoy,0,-8.57975,-8.56,-1.74,-9.69233801998948
CC[NH+](CC)Cc1cccc(NC(=O)/C(C#N)=C/c2cccc(OC)c2)c1,C24927833_decoy,CXCR4,Decoy,0,-7.39567,-8.26,-1.55,-7.552602971039711
CC[NH+](CC)[C@@H](CNC(=O)c1c(C)oc(C)c1C)c1cccc(OC)c1,C25409443_decoy,CXCR4,Decoy,0,-7.88054,-7.78,-0.95,-9.066696098597872
CC[C@@H](C)[C@@H]([NH2+]Cc1cc2c(cc1Br)OCO2)C(=O)OC,C35044761_decoy,CXCR4,Decoy,0,-8.15499,-6.28,-3.27,-3.318474668401732
Clc1ccccc1C[NH2+]CCCSc1nnnn1-c1ccccc1,C06670166_decoy,CXCR4,Decoy,0,-7.91279,-8.57,-1.94,-7.12370634840382
CC[NH+]1CCN([C@H](CNS(=O)(=O)c2ccccc2C)c2ccccc2)CC1,C36089603_decoy,CXCR4,Decoy,0,-8.12551,-8.38,-2.22,-4.102245093118559
COc1ccc(C)cc1S(=O)(=O)NC[C@H](c1ccc(Cl)cc1)[NH+](C)C,C36090657_decoy,CXCR4,Decoy,0,-9.44888,-7.73,-3.54,-9.058154973444474
CCOC(=O)[C@H]([NH2+][C@@H](C)CC)c1cc(Br)c2c(c1)OCO2,C38067959_decoy,CXCR4,Decoy,0,-8.20367,-6.66,-2.34,-3.748612711771185
Cc1ccccc1C[NH+]1CCN(C[C@@H]2C=NN=C2c2ccccc2)C[C@@H]1CCO,C39557850_decoy,CXCR4,Decoy,0,-9.58306,-8.44,-1.08,-9.365707778692975
CC(C)NC(=O)c1coc(C[NH+](Cc2ccccc2F)[C@H](C)C(C)C)n1,C40401241_decoy,CXCR4,Decoy,0,-7.53907,-6.62,-1.52,-7.786995186521709
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)C[NH+](C)Cc1c(C)noc1C,C46060727_decoy,CXCR4,Decoy,0,-8.23521,-8.42,-2.83,-8.025170361403204
COC(=O)C[NH+](CC(=O)Nc1cccc(Cl)c1C)Cc1ccccc1,C47628409_decoy,CXCR4,Decoy,0,-7.71531,-6.85,-1.44,-7.6468499109926755
COc1ccccc1N1CC[NH+](CCNC(=O)/C=C/c2cccs2)CC1,C49512330_decoy,CXCR4,Decoy,0,-8.90289,-8.68,-1.65,-7.072943863619462
COC(=O)[C@@H](C)C[NH+](C)CC(=O)Nc1ccc(Br)cc1Cl,C50069341_decoy,CXCR4,Decoy,0,-8.18517,-6.75,-1.52,-6.5813168046462565
CCc1ccc([C@@H](CNC(=O)C(=O)N(C)c2ccc(F)cc2)[NH+](C)C)cc1,C52648483_decoy,CXCR4,Decoy,0,-7.2103,-8.93,-1.48,-7.2012576543830695
COc1ccccc1N1CCC(N2CC[NH+](CC(C)(C)C)[C@@H](CCO)C2)CC1,C20209523_decoy,CXCR4,Decoy,0,-8.83936,-6.5,-2.13,-7.007785134913748
CC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[NH+](CCC(C)(C)C)CC2)cc1,C55936362_decoy,CXCR4,Decoy,0,-8.66355,-7.16,-2.35,-7.247517499684668
COc1ccccc1[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1)[NH+]1CCCC1,C57425198_decoy,CXCR4,Decoy,0,-8.94327,-8.09,-2.98,-4.176855438960248
COc1ccc(NC(=O)[C@H](C)[NH+](C)Cc2ccccc2Cl)cc1OC,C14930299_decoy,CXCR4,Decoy,0,-8.77552,-8.05,-2.73,-7.883830820857768
O=C(C[NH+](Cc1ccco1)C[C@@H]1CCCO1)Nc1cc(Cl)ccc1Cl,C60039478_decoy,CXCR4,Decoy,0,-9.02474,-6.75,-2.66,-4.9016579610217725
CC[C@@H](C(=O)Nc1ccc(C(=O)CN2CC[NH+](C)CC2)cc1)c1ccc(F)cc1,C41316473_decoy,CXCR4,Decoy,0,-8.65143,-8.41,-1.94,-7.297292672227073
COc1ccc(C(=O)NCCSC2=c3ccccc3=[NH+][C@H]2C)cc1OC,C63437389_decoy,CXCR4,Decoy,0,-8.97565,-8.1,-2.85,-4.876649671413368
Fc1ccc(C2=NN=C[C@@H]2CN[C@H](Cn2cc[nH+]c2)c2ccccc2)cc1,C63832371_decoy,CXCR4,Decoy,0,-8.44042,-8.13,-3.21,-10.93322865676725
Cc1ccc(C)c(OC[C@H](O)C[NH+]2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)c1,C66377294_decoy,CXCR4,Decoy,0,-8.38628,-8.06,-2.23,-7.966706618718304
COc1ccc(C)cc1C[NH2+][C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1,C67010735_decoy,CXCR4,Decoy,0,-8.56334,-8.32,-2.52,-8.847543815033204
COc1ccccc1[C@H](NCc1csc(-c2ccsc2)n1)c1[nH+]ccn1C,C67186683_decoy,CXCR4,Decoy,0,-9.42124,-6.72,-3.6,-7.671099609901391
CCOc1ccc(C2(C[NH2+]Cc3cccc4c3OCCO4)CCOCC2)cc1,C67251724_decoy,CXCR4,Decoy,0,-8.8328,-8.04,-1.69,-7.943968675928515
Cc1noc(Cl)c1CCC(=O)NC[C@H]1CCC[NH+]1CC1CCCCC1,C67331910_decoy,CXCR4,Decoy,0,-8.89193,-7.67,-2.02,-7.328664054607453
COc1ccc(C[NH2+][C@H](C)c2cnn(-c3ccc(F)cc3)c2C)cc1OC,C67504655_decoy,CXCR4,Decoy,0,-7.59373,-8.15,-2.17,-7.342016603523147
CCOc1cc([C@H]2[NH2+]CCc3cc(OCC)c(OCC)cc32)ccc1O,C00718279_decoy,CXCR4,Decoy,0,-8.47932,-7.01,-2.69,-7.582406820642388
C[C@H]([NH2+]C[C@H](O)COc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1,C04771378_decoy,CXCR4,Decoy,0,-9.03417,-7.95,-1.55,-7.114305514741204
CCc1ccc(NC(=O)C(=O)NC[C@H](c2ccc(C)cc2)[NH+](C)C)cc1,C10019679_decoy,CXCR4,Decoy,0,-7.64505,-8.71,-2.52,-8.634242246453478
CCOc1ccc(C(=O)NCC[NH+]2CCC(O)(c3ccc(C)cc3)CC2)cc1,C12326361_decoy,CXCR4,Decoy,0,-8.29851,-8.45,-2.65,-8.874073111418365
CCc1ccc([C@@H](CNC(=O)CNC(=O)c2ccc(F)cc2)[NH+](C)C)cc1,C22684489_decoy,CXCR4,Decoy,0,-7.9876,-7.79,-2.02,-4.146461956512702
CCCCNC(=O)NC(=O)[C@H](C)[NH+](C)Cc1ccc(Br)s1,C24598202_decoy,CXCR4,Decoy,0,-8.56976,-6.23,-4.12,-3.79549234049102
CCc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)c2cccs2)[NH+](C)C)cc1,C27597860_decoy,CXCR4,Decoy,0,-9.12026,-7.63,-3.84,-4.462521962964009
CC[NH+](CC)[C@@H](C)CNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2,C31825505_decoy,CXCR4,Decoy,0,-8.76699,-7.55,-4.77,-4.919854267615357
CCCNC(=O)C[NH2+]Cc1cc(Br)c(OCC)c(OC)c1,C35161399_decoy,CXCR4,Decoy,0,-8.27122,-7.01,-1.93,-8.648677021827146
COC(=O)[C@H]([NH2+]C[C@@H](O)COc1cccc(Br)c1)C(C)C,C37887814_decoy,CXCR4,Decoy,0,-8.65807,-6.01,-1.98,-7.144397292085231
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)N[C@H](C)C(C)C)C2(CC[NH2+]CC2)C1,C39608212_decoy,CXCR4,Decoy,0,-8.66373,-7.88,-0.36,-9.5893654131027
COC(=O)Cc1c(C)[nH+]c2ccc(Br)cc2c1NCCCO,C41473990_decoy,CXCR4,Decoy,0,-8.70019,-6.59,-2.08,-8.864324831195521
COc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc(F)c(F)c2F)c(OC)c1,C42184094_decoy,CXCR4,Decoy,0,-8.20227,-8.46,-0.91,-7.731239526774061
COc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NCc2ccc(F)cc2)c(OC)c1,C42184314_decoy,CXCR4,Decoy,0,-7.13957,-7.0,-1.48,-6.916527504992114
CC(C)[C@H](NC(=O)NC[C@H](c1ccco1)[NH+]1CCCC1)c1cccs1,C43167491_decoy,CXCR4,Decoy,0,-8.9372,-7.72,-3.66,-7.969777747026983
CCCOc1ccccc1NC(=O)NC[C@@H](c1ccsc1)[NH+](C)C,C43452352_decoy,CXCR4,Decoy,0,-8.97135,-7.98,-4.41,-4.459526072156802
CCOC(=O)[C@@H]([NH3+])Cc1ccc(-c2ccc(C(OC)OC)cc2)s1,C44363098_decoy,CXCR4,Decoy,0,-8.588,-7.57,-2.41,-7.691058177413366
CCOC(=O)[C@H]([NH3+])Cc1ccc(-c2cccc(C(OC)OC)c2)s1,C44363179_decoy,CXCR4,Decoy,0,-9.45581,-7.86,-1.63,-11.120715647248655
C[NH+](C)C(C)(C)CNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2,C44717078_decoy,CXCR4,Decoy,0,-8.56879,-7.71,-1.07,-11.585520814360706
Cc1ccsc1C[NH+](C)CC(=O)Nc1ccccc1C(=O)NC(C)C,C46503077_decoy,CXCR4,Decoy,0,-8.63872,-7.61,-3.96,-5.054837055046961
CC[NH+](CCOc1ccc(S(N)(=O)=O)cc1)Cc1ccccc1C,C48059176_decoy,CXCR4,Decoy,0,-8.7343,-8.06,-2.03,-9.216362937894257
CCc1ccc([C@H](CNC(=O)C(=O)Nc2cc(F)ccc2C)[NH+](C)C)cc1,C48846280_decoy,CXCR4,Decoy,0,-7.40342,-9.05,-1.81,-10.29515992328737
CC[C@@H](C)CN1C(=O)[C@@H](CC(C)C)[NH2+]C12CCN(C(=S)NC1CC1)CC2,C36032792_decoy,CXCR4,Decoy,0,-9.12863,-7.06,-1.32,-8.953736489619171
C[C@@H](OC[C@@H](O)C[NH+](C)CC(=O)NC(C)(C)C)c1ccc(Cl)cc1,C53402338_decoy,CXCR4,Decoy,0,-8.48918,-7.54,-2.1,-10.178889948862585
CC[NH+](CC)CCOc1ccc(C(=O)NNc2ccc(F)cc2)cc1,C56422188_decoy,CXCR4,Decoy,0,-8.09144,-7.55,-1.35,-8.134617224907792
CCC[NH+](CC(=O)NC)C[C@H](O)COc1cc(Cl)ccc1Cl,C56508580_decoy,CXCR4,Decoy,0,-8.21364,-6.1,-1.99,-3.744568299662887
CC[NH+](CC(=O)NC)C[C@H](O)COc1cc(C)c(Cl)cc1C(C)C,C56509598_decoy,CXCR4,Decoy,0,-8.92292,-7.55,-3.08,-4.51382513413926
COc1c(Cl)cccc1NC(=O)NCCC[NH+](C)CC(F)(F)F,C56660875_decoy,CXCR4,Decoy,0,-7.27849,-7.58,-1.44,-7.117208166695569
COc1ccc(CCNC(=O)NC[C@H](c2ccc(F)cc2)[NH+](C)C)cc1,C56950428_decoy,CXCR4,Decoy,0,-8.26344,-8.94,-4.64,-9.71617212367222
CNC(=O)c1cccc(NC(=O)C[NH+](C)Cc2ccc(C(C)C)cc2)c1,C58044253_decoy,CXCR4,Decoy,0,-8.14928,-8.63,-2.05,-8.58034910831067
CC(C)NC(=O)C[NH+](C)CC(=O)N[C@H](c1ccc(F)cc1)c1cccs1,C07796522_decoy,CXCR4,Decoy,0,-8.18824,-7.25,-2.09,-8.372207511240598
CNC(=O)c1ccc(C[NH+](C)CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)cc1,C07996798_decoy,CXCR4,Decoy,0,-7.4097,-8.66,-2.92,-7.978022089620334
C[C@H](Cn1cc[nH+]c1)NC(=O)NCCC(c1ccccc1)c1ccccc1,C47677432_decoy,CXCR4,Decoy,0,-8.26743,-8.5,-1.64,-10.524021011645386
O=C(NCCOc1cccc(F)c1)NC[C@H](c1cccs1)[NH+]1CCCC1,C47956567_decoy,CXCR4,Decoy,0,-9.33875,-7.9,-4.36,-3.173171476405783
C[C@@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)CNC(=O)Cc2cccc(F)c2)C1,C54259600_decoy,CXCR4,Decoy,0,-8.63504,-9.16,-3.03,-9.488320046641917
CCCNS(=O)(=O)NC[C@@H](c1ccc(C)cc1)[NH+]1CCCCCC1,C62362824_decoy,CXCR4,Decoy,0,-10.1614,-7.41,-2.18,-8.829043542558004
CCC(CC)(CNC(=O)CCNC(=O)c1ccc(F)cc1Cl)[NH+](C)C,C63801673_decoy,CXCR4,Decoy,0,-9.01869,-7.64,-2.51,-8.975660829623546
COc1ccc(C[NH2+]CCNC(=O)c2ccc(C(F)(F)F)cc2)cc1OC,C65978888_decoy,CXCR4,Decoy,0,-7.433,-7.59,-1.77,-6.714322326966241
CCOc1ccc(C[NH2+]CCNC(=O)c2ccc(Cl)cc2)cc1OC,C65979051_decoy,CXCR4,Decoy,0,-7.60756,-7.93,-2.23,-8.312186158314336
COc1cc(C[NH2+]CCNC(=O)c2ccc(Cl)cc2)cc(Cl)c1OC,C65979063_decoy,CXCR4,Decoy,0,-8.372,-8.24,-2.3,-8.777310322728555
CC(C)[C@@H](NC(=O)NCCc1[nH+]ccn1C)c1cccc(C(F)(F)F)c1,C66234988_decoy,CXCR4,Decoy,0,-7.83116,-8.91,-1.82,-10.572898548084291
COc1ccc(C2(C[NH2+][C@@H](C)C(=O)NCCC(C)C)CCOCC2)cc1,C66392742_decoy,CXCR4,Decoy,0,-9.05251,-8.27,-2.52,-9.063199076093614
Cc1ccc(CNC(=O)[C@@H](C)[NH+](C)CC(=O)Nc2cc(F)cc(F)c2)cc1,C66844375_decoy,CXCR4,Decoy,0,-7.80586,-8.5,-1.25,-8.061334364369214
C[C@H](C(=O)N[C@H](C)c1ccccc1)[NH+](C)CC(=O)Nc1cc(F)cc(F)c1,C66844699_decoy,CXCR4,Decoy,0,-7.56007,-8.64,-1.71,-8.976940109622426
CC(C)[C@@H](C(=O)NC(C)(C)C)[NH+](C)CC(=O)Nc1cc(F)cc(F)c1,C66844722_decoy,CXCR4,Decoy,0,-7.98776,-7.56,-1.9,-4.71412793013624
C[C@@H](C[NH+](C)[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccccc1,C66853657_decoy,CXCR4,Decoy,0,-7.09571,-8.17,-1.8,-7.917987751194546
Cc1nn(CCO)c(C)c1C[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1,C67214979_decoy,CXCR4,Decoy,0,-8.38723,-7.81,-1.85,-10.02679666601553
COc1cc2c(cc1C[NH2+]C[C@@H](O)COc1ccc(F)cc1)O[C@H](C)C2,C67252419_decoy,CXCR4,Decoy,0,-8.65948,-7.9,-1.73,-8.67660537818447
CC[NH+](CC)[C@@H](C)CNC(=O)C(=O)Nc1cccc(-c2sccc2C)c1,C67497162_decoy,CXCR4,Decoy,0,-9.29901,-8.88,-2.09,-12.906929517533092
Cc1ccsc1-c1cccc(NC(=O)C(=O)NC[C@H](C(C)C)[NH+](C)C)c1,C67532707_decoy,CXCR4,Decoy,0,-9.61796,-7.51,-2.63,-7.954289119089229